A0A087YI06_POEFO Loading...

Retinol binding protein 3

AlphaFold DB , UniProt , Accession A0A087YI06, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,212 aa.

						>A0A087YI06_POEFO|A0A087YI06
IKGLFETKASYAVCLCALPVTSSFQPALILEIAKILMQNYCLPEKLFGMQEAIQQVITSGEILQISDKKTLASLLTAGVQGALRDPRLTVSYEANPVPVVPPALQTLSKDQLRRLVRNSFKVDILENNTGYLRIDQIIDQETVAKAGSQLWDNVWNKVAQTSSLILDLRYNTGGELSGVPVIISYFSDPEPPIHIDTIYDRSSNTTKELWTMSSIPGKRYGKKKDVIILTSRRTMGAAEAVAYTLKKLKRAIIVGERSAGGSVKVQKIRIAQSDFYITVPVARSINPITGQSWEVSGVSPTINVLAKEAVSKAKSLLALRYAIPKIMQIISDIMRDTYAFSDRVSTLLQHLQSTDLLSVGSETDLAVRLNQNLQTASEDPRLIIRYMQDDDAGIEQDHELYTIPDNTELLKAYVNRVFKVEVLPGNTGYLRFDELAETSAVPELEKLMAQKIWEPLKDTDNLIIDLRYNTRGSSNSLTLMLSYLCDCSQKQNFFTINDRIKNTTTEHKSLSKTTGPVYNSRHGVYVLASYHTASTGEELAYLIQSLSCGTVVGEITSGNLMHSKTFEIEGTDIAITVPFINFIDNNGEYWLGGGVVPDAIVLAEEALDRVYEVMAFHKGLRTLIAGVGELLEQHYAIEEVAINVSQVLLTKWREGLYRSVVDFESLASQLTIDLQESSGDHRIHVFHCDVEPESPHDIPKMPSPEEFGYIAESLFKTEVLPGNIGYLRFDMMLDIEVVKGVGPQLLNSVWKKMVNTEALIIDMRYNTGGYSTAVPLFCTYFFDAEPPQHLYTIYARATNTLTKIMTFSHIRGQRYGSSKDLVILTSHMTGSPAELFARAMSDLNRATVIGEPTIGGSLSSGTYQIRDSVLYASIPNQIILSPTTGKVWSFLGVEPHVSTQVTEALSVAQTIINLRAQVPSIIEESAILIANNYAFQSVGADVAEKLRELLANGEFSSVVCKESLETKLSADLKTLSGDKSLQTTTNTPALPPMEYSPEMYIELIKISFHTDVFENNIGYLRFDMFGDFEEVKPIAQIIVEHIWNKVVNTNAMIIDLRNNLGGPTTAIAGFCSYFFDGDKEILLDKLYDRSSGTTTELRTLDELTGARYGSKKSLIILTSKATASAAEEFVYIMKKLGRAMIIGETTAGGSHPPKVFPVGESNIFLSIPTVHSETSAGPAWEGVGITPHIPAAAEAALEVAKGILNKHLGGQQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	I	31.3	Very low	31.4	Very low	228 Å²	228	154.6 Å²	154.6	100%	1.169	81%	0.814	S	S	*	*				0	163.1	0	-71.5	175	0	0	0	108.1
2	K	30.8	Very low	31.3	Very low	203 Å²	203	149.2 Å²	149.2	88%	0.883	81%	0.808	S	S	*	*			trans	-61.7	160	-179.6	-64.5	176	176.6	178.1	0	112.3
3	G	33.9	Very low	31.5	Very low	67 Å²	67	148.2 Å²	148.2	69%	0.691	81%	0.81	S	S	*	*			trans	-104.6	-142.4	177.6	0	0	0	0	0	114.6
4	L	35.8	Very low	31.3	Very low	144 Å²	144	145.6 Å²	145.6	75%	0.754	81%	0.806	S	S	*	*			trans	95.3	131.7	-179.6	-74.2	76.5	0	0	0	118.2
5	F	33.8	Very low	31	Very low	182 Å²	182	146.9 Å²	146.9	80%	0.798	81%	0.81	S	S	*	*			trans	61.6	157.5	136.3	-66.7	-175.2	0	0	0	120.3
6	E	34.1	Very low	31.1	Very low	140 Å²	140	145.7 Å²	145.7	65%	0.654	81%	0.813	S	S	*	*			cis	-160.9	-170.6	-26.6	-111	-125.6	86.4	0	0	106.2
7	T	29.6	Very low	31.2	Very low	123 Å²	123	143.1 Å²	143.1	76%	0.755	81%	0.814	S	S	*	*			cis	-156.2	-166	23.8	-23.2	0	0	0	0	111.5
8	K	30.8	Very low	31.1	Very low	188 Å²	188	143.8 Å²	143.8	82%	0.817	82%	0.815	S	S	*	*			trans	-99.9	159.7	-180	-57	163.6	178.8	166.8	0	114.6
9	A	30	Very low	31.5	Very low	103 Å²	103	142.8 Å²	142.8	85%	0.851	81%	0.814	S	S	*	*			trans	-162.8	167.3	142.4	0	0	0	0	0	111.5
10	S	28.3	Very low	31.6	Very low	104 Å²	104	142.7 Å²	142.7	73%	0.727	82%	0.816	S	S	*	*			trans	-139.4	-171.1	-158.9	-52.7	0	0	0	0	116.3
11	Y	27.3	Very low	31.8	Very low	219 Å²	219	141.7 Å²	141.7	86%	0.859	81%	0.813	S	S	*	*			trans	90	116.4	179.1	-56.6	-73.4	0	0	0	114.3
12	A	29.9	Very low	32.4	Very low	89 Å²	89	135.2 Å²	135.2	74%	0.736	79%	0.788	S	S	*	*			cis	71.2	142.8	22.8	0	0	0	0	0	114.4
13	V	34.2	Very low	33	Very low	137 Å²	137	130.9 Å²	130.9	83%	0.83	78%	0.783	S	S	*	*			cis	-146.7	-175.4	19.7	-137.7	0	0	0	0	108.7
14	C	27.8	Very low	34	Very low	112 Å²	112	134.1 Å²	134.1	76%	0.757	78%	0.778	S	S	*	*			cis	-162.5	161.1	4.3	-167.1	0	0	0	0	111.1
15	L	26.8	Very low	35.4	Very low	165 Å²	165	128.9 Å²	128.9	86%	0.864	75%	0.75	S	S	*	*			trans	-156.4	164.1	155.3	-121.1	166.4	0	0	0	110
16	C	32.9	Very low	37	Very low	127 Å²	127	122.6 Å²	122.6	86%	0.858	73%	0.727	S	S	*	*			trans	-79.1	153.3	-162	-56.6	0	0	0	0	116.1
17	A	32.4	Very low	38.9	Very low	102 Å²	102	118.8 Å²	118.8	84%	0.843	72%	0.72	S	S	*	*			trans	-142.2	154.5	172.3	0	0	0	0	0	112.4
18	L	30.5	Very low	41.3	Very low	156 Å²	156	113.9 Å²	113.9	82%	0.817	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-84.6	157.6	177.5	-71.6	165.6	0	0	0	112	V20	L18-V20 PolarHBondContact O-N 3.35Å
19	P	38.5	Very low	43.6	Very low	124 Å²	124	105.8 Å²	105.8	81%	0.805	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-69.2	120.9	172.7	28.8	-33.8	0	0	0	111.3
20	V	32.7	Very low	45.9	Very low	141 Å²	141	105.3 Å²	105.3	86%	0.855	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-81.3	131.7	-179.1	178.1	0	0	0	0	111.1	L18	L18-V20 PolarHBondContact O-N 3.35Å
21	T	37.2	Very low	48.6	Very low	121 Å²	121	102.9 Å²	102.9	74%	0.742	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-97.7	132.7	175	48.8	0	0	0	0	112.6
22	S	42.8	Very low	51.4	Low	93 Å²	93	92.8 Å²	92.8	65%	0.65	58%	0.575	S	S	*	*			trans	52.1	99.1	161.3	58.3	0	0	0	0	119
23	S	44	Very low	53.9	Low	111 Å²	111	89 Å²	89	78%	0.776	54%	0.543	S	S	*	.			trans	-106.3	35.7	167.4	65	0	0	0	0	113.1
24	F	55.3	Low	56.3	Low	136 Å²	136	86.6 Å²	86.6	60%	0.596	52%	0.522	S	S	*	.			trans	-99.4	-13.2	-158.1	-110.3	-90.7	0	0	0	116.7
25	Q	64.2	Low	59.2	Low	34 Å²	34	81.8 Å²	81.8	16%	0.159	49%	0.489	C	S	.	.	H	α-helix	trans	-72.5	-44.3	-168	-70.8	131.3	-37.9	0	0	115.8	A27 L28 I29 I62 L63 I65	Q25-A27 VanDerWaalsContact C-N 3.34Å; Q25-A27 PolarHBondContact O-N 2.76Å; Q25-L28 WeakPolarHBondContact O-CB 3.49Å; Q25-L28 PolarHBondContact O-N 3.25Å; Q25-I29 PolarHBondContact O-N 2.93Å; Q25-I62 PolarHBondContact NE2-O 2.61Å; Q25-L63 HydrophobicContact CB-CD2 3.87Å; Q25-L63 PolarHBondContact NE2-O 3.14Å; Q25-L63 PolarHBondContact OE1-O 2.96Å; Q25-I65 PolarHBondContact NE2-O 2.69Å
26	P	67.9	Low	62.1	Low	50 Å²	50	74 Å²	74	33%	0.325	45%	0.448	S	S	.	.	H	α-helix	trans	-62.2	-38.3	-176.2	-25.3	35.5	0	0	0	113.6	L28 I29 L30 L63	P26-L28 VanDerWaalsContact C-N 3.31Å; P26-L28 PolarHBondContact O-N 3.31Å; P26-I29 PolarHBondContact O-N 3.41Å; P26-L30 WeakPolarHBondContact O-CG 3.31Å; P26-L30 PolarHBondContact O-N 2.82Å; P26-L30 VanDerWaalsContact O-N 3.16Å; P26-L63 HydrophobicContact CG-CD2 4.22Å
27	A	73.9	Confident	64.6	Low	59 Å²	59	73.1 Å²	73.1	49%	0.488	43%	0.432	S	S	.	.	H	α-helix	trans	-63.9	-34.4	178	0	0	0	0	0	112.8	Q25 L30 E31	Q25-A27 VanDerWaalsContact C-N 3.34Å; Q25-A27 PolarHBondContact O-N 2.76Å; A27-L30 PolarHBondContact O-N 3.06Å; A27-E31 PolarHBondContact O-N 3.33Å
28	L	79.6	Confident	67.2	Low	20 Å²	20	73.2 Å²	73.2	11%	0.105	42%	0.415	C	S	.	.	H	α-helix	trans	-64	-41.7	177.1	-171.3	73.4	0	0	0	111.5	Q25 P26 I32 L71 L75 I270 F275	Q25-L28 WeakPolarHBondContact O-CB 3.49Å; Q25-L28 PolarHBondContact O-N 3.25Å; P26-L28 VanDerWaalsContact C-N 3.31Å; P26-L28 PolarHBondContact O-N 3.31Å; L28-I32 HydrophobicContact CG-CD1 4.35Å; L28-I32 WeakPolarHBondContact O-CG1 3.35Å; L28-I32 PolarHBondContact O-N 3.33Å; L28-L71 HydrophobicContact CD2-CD2 4.09Å; L28-L75 HydrophobicContact CD2-CD1 4.01Å; L28-I270 HydrophobicContact CD1-CB 4.48Å; L28-I270 HydrophobicContact CD1-CG2 3.73Å; L28-F275 HydrophobicContact CD1-CB 4.24Å; L28-F275 HydrophobicContact CD1-CD2 3.88Å; L28-F275 HydrophobicContact CD1-CG 4.21Å; L28-F275 HydrophobicContact CD2-CD2 4.01Å; L28-F275 HydrophobicContact CD2-CE2 3.97Å; L28-F275 HydrophobicContact CD2-CG 4.33Å; L28-F275 HydrophobicContact CD2-CZ 4.24Å
29	I	79	Confident	70	Confident	19 Å²	19	67 Å²	67	10%	0.097	38%	0.383	C	S	.	.	H	α-helix	trans	-67.1	-42.7	178.7	-58.3	171.2	0	0	0	110.4	Q25 P26 I32 A33 I53 V56 I57 I62 L75	Q25-I29 PolarHBondContact O-N 2.93Å; P26-I29 PolarHBondContact O-N 3.41Å; I29-I32 WeakPolarHBondContact O-CB 3.32Å; I29-I32 PolarHBondContact O-N 2.97Å; I29-A33 WeakPolarHBondContact O-CB 3.39Å; I29-A33 PolarHBondContact O-N 3.08Å; I29-I53 HydrophobicContact CG2-CG2 4.01Å; I29-V56 HydrophobicContact CD1-CG1 4.3Å; I29-I57 HydrophobicContact CD1-CG1 4.33Å; I29-I62 HydrophobicContact CD1-CD1 4.23Å; I29-I62 HydrophobicContact CD1-CG2 4.31Å; I29-L75 HydrophobicContact CG1-CD2 4.39Å
30	L	79.6	Confident	72.6	Confident	93 Å²	93	61.1 Å²	61.1	49%	0.487	35%	0.345	S	S	.	.	H	α-helix	trans	-65.2	-39.2	178.6	-67.8	170.7	0	0	0	112.9	P26 A27 A33 K34 I53 I57	P26-L30 WeakPolarHBondContact O-CG 3.31Å; P26-L30 PolarHBondContact O-N 2.82Å; P26-L30 VanDerWaalsContact O-N 3.16Å; A27-L30 PolarHBondContact O-N 3.06Å; L30-A33 PolarHBondContact O-N 2.88Å; L30-K34 WeakPolarHBondContact O-CB 3.24Å; L30-K34 PolarHBondContact O-N 2.79Å; L30-I53 HydrophobicContact CD2-CG2 4.25Å; L30-I57 HydrophobicContact CD2-CD1 4Å; L30-I57 HydrophobicContact CG-CD1 4.17Å
31	E	84.8	Confident	75.3	Confident	53 Å²	53	54.4 Å²	54.4	25%	0.248	30%	0.304	C	S	.	.	H	α-helix	trans	-71.7	-33.4	174.2	-73.8	-67.9	138.6	0	0	112.5	A27 K34 I35 I270 A271	A27-E31 PolarHBondContact O-N 3.33Å; E31-K34 PolarHBondContact O-N 2.82Å; E31-K34 WeakPolarHBondContact OE1-CD 3.18Å; E31-K34 IonicContact OE1-NZ 2.81Å; E31-K34 PolarHBondContact OE1-NZ 2.89Å; E31-K34 IonicContact OE2-NZ 2.86Å; E31-K34 PolarHBondContact OE2-NZ 2.69Å; E31-I35 WeakPolarHBondContact O-CD1 3.47Å; E31-I35 VanDerWaalsContact O-CG1 3.25Å; E31-I35 WeakPolarHBondContact O-CG1 3.49Å; E31-I35 PolarHBondContact O-N 3.47Å; E31-I270 HydrophobicContact CB-CG2 3.85Å; E31-A271 HydrophobicContact CG-CB 4.43Å
32	I	85.1	Confident	77.7	Confident	7 Å²	7	49.7 Å²	49.7	4%	0.036	27%	0.274	C	S	.	.	H	α-helix	trans	-59.4	-48.7	169.7	-76.3	166.4	0	0	0	110.7	L28 I29 K34 I35 L36 L75 V79 I270 I277	L28-I32 HydrophobicContact CG-CD1 4.35Å; L28-I32 WeakPolarHBondContact O-CG1 3.35Å; L28-I32 PolarHBondContact O-N 3.33Å; I29-I32 WeakPolarHBondContact O-CB 3.32Å; I29-I32 PolarHBondContact O-N 2.97Å; I32-K34 PolarHBondContact O-N 3.08Å; I32-I35 PolarHBondContact O-N 3.1Å; I32-L36 HydrophobicContact CG2-CD1 4.15Å; I32-L36 WeakPolarHBondContact O-CG 3.41Å; I32-L36 PolarHBondContact O-N 2.9Å; I32-L75 HydrophobicContact CD1-CD1 3.91Å; I32-L75 HydrophobicContact CD1-CD2 4.36Å; I32-V79 HydrophobicContact CG2-CG1 4.33Å; I32-I270 HydrophobicContact CD1-CD1 3.91Å; I32-I270 HydrophobicContact CG1-CD1 3.5Å; I32-I270 HydrophobicContact CG1-CG1 3.98Å; I32-I270 HydrophobicContact CG1-CG2 4.47Å; I32-I277 HydrophobicContact CG2-CD1 4Å
33	A	82.6	Confident	79.6	Confident	9 Å²	9	47.8 Å²	47.8	7%	0.074	26%	0.259	C	S	.	.	H	α-helix	trans	-58	-48.1	178.5	0	0	0	0	0	112.4	I29 L30 I35 L36 M37 I53	I29-A33 WeakPolarHBondContact O-CB 3.39Å; I29-A33 PolarHBondContact O-N 3.08Å; L30-A33 PolarHBondContact O-N 2.88Å; A33-I35 PolarHBondContact O-N 3.33Å; A33-L36 WeakPolarHBondContact O-CB 3.24Å; A33-L36 PolarHBondContact O-N 2.82Å; A33-M37 WeakPolarHBondContact O-CG 3.34Å; A33-M37 PolarHBondContact O-N 2.87Å; A33-I53 HydrophobicContact CB-CD1 3.24Å; A33-I53 HydrophobicContact CB-CG1 4.24Å
34	K	85.1	Confident	81.4	Confident	87 Å²	87	47.6 Å²	47.6	38%	0.378	25%	0.246	S	C	.	.	H	α-helix	trans	-59.4	-42.6	176.3	174.9	-179.5	161.5	-146.6	0	112.3	L30 E31 I32 M37 Q38	L30-K34 WeakPolarHBondContact O-CB 3.24Å; L30-K34 PolarHBondContact O-N 2.79Å; E31-K34 PolarHBondContact O-N 2.82Å; E31-K34 WeakPolarHBondContact OE1-CD 3.18Å; E31-K34 IonicContact OE1-NZ 2.81Å; E31-K34 PolarHBondContact OE1-NZ 2.89Å; E31-K34 IonicContact OE2-NZ 2.86Å; E31-K34 PolarHBondContact OE2-NZ 2.69Å; I32-K34 PolarHBondContact O-N 3.08Å; K34-M37 PolarHBondContact O-N 3.34Å; K34-Q38 WeakPolarHBondContact O-CB 3.3Å; K34-Q38 VanDerWaalsContact O-CG 3.28Å; K34-Q38 WeakPolarHBondContact O-CG 3.23Å; K34-Q38 PolarHBondContact O-N 3.29Å
35	I	88.4	Confident	82.6	Confident	11 Å²	11	45.7 Å²	45.7	6%	0.056	24%	0.238	C	C	.	.	H	α-helix	trans	-63.3	-42.3	175	-69.6	162.9	0	0	0	110.8	E31 I32 A33 Q38 N39 I268 I270 I277 V279	E31-I35 WeakPolarHBondContact O-CD1 3.47Å; E31-I35 VanDerWaalsContact O-CG1 3.25Å; E31-I35 WeakPolarHBondContact O-CG1 3.49Å; E31-I35 PolarHBondContact O-N 3.47Å; I32-I35 PolarHBondContact O-N 3.1Å; A33-I35 PolarHBondContact O-N 3.33Å; I35-Q38 PolarHBondContact O-N 3.26Å; I35-N39 VanDerWaalsContact O-CB 3.3Å; I35-N39 WeakPolarHBondContact O-CB 3.25Å; I35-N39 PolarHBondContact O-N 3.44Å; I35-N39 PolarHBondContact O-ND2 3.4Å; I35-I268 HydrophobicContact CD1-CG2 4.09Å; I35-I268 HydrophobicContact CG1-CG2 4.32Å; I35-I268 HydrophobicContact CG2-CB 4.15Å; I35-I268 HydrophobicContact CG2-CD1 3.78Å; I35-I268 HydrophobicContact CG2-CG2 3.98Å; I35-I270 HydrophobicContact CD1-CB 4.32Å; I35-I270 HydrophobicContact CD1-CG1 3.82Å; I35-I277 HydrophobicContact CB-CG2 4.32Å; I35-I277 HydrophobicContact CD1-CG2 4.23Å; I35-I277 HydrophobicContact CG2-CG2 3.64Å; I35-V279 HydrophobicContact CG2-CG2 4.23Å
36	L	88.3	Confident	83.4	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-62.3	-50.9	175	-70	170.6	0	0	0	111.7	I32 A33 Q38 N39 Y40 V79 L83 L88 I277 V279	I32-L36 HydrophobicContact CG2-CD1 4.15Å; I32-L36 WeakPolarHBondContact O-CG 3.41Å; I32-L36 PolarHBondContact O-N 2.9Å; A33-L36 WeakPolarHBondContact O-CB 3.24Å; A33-L36 PolarHBondContact O-N 2.82Å; L36-Q38 PolarHBondContact O-N 3.48Å; L36-N39 PolarHBondContact O-N 3.17Å; L36-Y40 WeakPolarHBondContact O-CB 3.49Å; L36-Y40 PolarHBondContact O-N 3.04Å; L36-V79 HydrophobicContact CD1-CG1 4.16Å; L36-L83 HydrophobicContact CD1-CD1 4.32Å; L36-L88 HydrophobicContact CD2-CD1 4.42Å; L36-L88 HydrophobicContact CD2-CD2 3.68Å; L36-I277 HydrophobicContact CD1-CD1 4.45Å; L36-I277 HydrophobicContact CD2-CD1 3.94Å; L36-I277 HydrophobicContact CG-CD1 4.13Å; L36-V279 HydrophobicContact CD2-CG1 4.46Å; L36-V279 HydrophobicContact CD2-CG2 4.24Å
37	M	84.4	Confident	83.6	Confident	107 Å²	107	52.6 Å²	52.6	53%	0.527	26%	0.264	S	S	.	.	H	α-helix	trans	-56.9	-34.5	178	-69.6	178.4	79.2	0	0	113.3	A33 K34 L46 R201	A33-M37 WeakPolarHBondContact O-CG 3.34Å; A33-M37 PolarHBondContact O-N 2.87Å; K34-M37 PolarHBondContact O-N 3.34Å; M37-L46 HydrophobicContact CG-CD1 4.32Å; M37-R201 PolarHBondContact O-NH2 2.64Å
38	Q	87.3	Confident	83.2	Confident	105 Å²	105	51.3 Å²	51.3	49%	0.491	26%	0.257	S	S	.	.	H	α-helix	trans	-84.8	-29.6	-179.5	-71.6	178.1	-12.9	0	0	114.1	K34 I35 L36 R201	K34-Q38 WeakPolarHBondContact O-CB 3.3Å; K34-Q38 VanDerWaalsContact O-CG 3.28Å; K34-Q38 WeakPolarHBondContact O-CG 3.23Å; K34-Q38 PolarHBondContact O-N 3.29Å; I35-Q38 PolarHBondContact O-N 3.26Å; L36-Q38 PolarHBondContact O-N 3.48Å; Q38-R201 PolarHBondContact O-NH1 3.33Å
39	N	90.2	Very high	82.8	Confident	26 Å²	26	51.5 Å²	51.5	14%	0.139	26%	0.257	C	S	.	.	H	α-helix	trans	-125.9	-14.7	-165.6	-58.4	-90.3	0	0	0	115.4	I35 L36 R201 I268 V279 V281	I35-N39 VanDerWaalsContact O-CB 3.3Å; I35-N39 WeakPolarHBondContact O-CB 3.25Å; I35-N39 PolarHBondContact O-N 3.44Å; I35-N39 PolarHBondContact O-ND2 3.4Å; L36-N39 PolarHBondContact O-N 3.17Å; N39-R201 VanDerWaalsContact C-CG 3.43Å; N39-I268 HydrophobicContact CB-CD1 3.87Å; N39-V279 HydrophobicContact CB-CG1 4.3Å; N39-V281 HydrophobicContact CB-CG1 4.07Å; N39-V281 WeakPolarHBondContact O-CA 3.38Å; N39-V281 WeakPolarHBondContact O-CG1 3.22Å
40	Y	92.3	Very high	82.2	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.284	C	S	.	.			trans	-75.3	125.8	-176.7	-177.5	-127.3	0	0	0	112.7	L36 L42 K45 L46 L83 D85 L88 R201 V279 P280	L36-Y40 WeakPolarHBondContact O-CB 3.49Å; L36-Y40 PolarHBondContact O-N 3.04Å; Y40-L42 HydrophobicContact CD1-CB 4.16Å; Y40-L42 WeakPolarHBondContact CD1-O 3.47Å; Y40-L42 HydrophobicContact CE1-CB 3.68Å; Y40-L42 WeakPolarHBondContact CE1-O 3.44Å; Y40-L42 PolarHBondContact O-N 3.43Å; Y40-K45 HydrophobicContact CE1-CB 4.27Å; Y40-L46 HydrophobicContact CD1-CD1 4.44Å; Y40-L46 HydrophobicContact CD1-CD2 3.69Å; Y40-L46 HydrophobicContact CD1-CG 4.09Å; Y40-L46 HydrophobicContact CE1-CD2 4.15Å; Y40-L83 HydrophobicContact CD1-CD1 4.32Å; Y40-L83 HydrophobicContact CE1-CB 4.5Å; Y40-L83 HydrophobicContact CE1-CD1 3.89Å; Y40-L83 HydrophobicContact CE1-CD2 4.2Å; Y40-L83 HydrophobicContact CE1-CG 4.43Å; Y40-D85 HydrophobicContact CE2-CB 4.43Å; Y40-D85 WeakPolarHBondContact OH-CB 3.28Å; Y40-L88 HydrophobicContact CD2-CD2 4.12Å; Y40-L88 HydrophobicContact CE2-CD1 4.07Å; Y40-L88 HydrophobicContact CE2-CD2 4.17Å; Y40-L88 HydrophobicContact CE2-CG 4.28Å; Y40-R201 WeakPolarHBondContact O-CG 3.41Å; Y40-V279 HydrophobicContact CD2-CG1 4.19Å; Y40-P280 HydrophobicContact CD2-CG 3.82Å; Y40-P280 HydrophobicContact CE2-CG 3.73Å
41	C	89.2	Confident	81.6	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.285	C	S	.	.	S	Bend	trans	-68.5	-4.7	-172	70	0	0	0	0	116.2	P43 P280 R283	C41-P43 VanDerWaalsContact C-CD 3.41Å; C41-P43 WeakPolarHBondContact O-CD 3.44Å; C41-P280 WeakPolarHBondContact CB-O 3.32Å; C41-P280 PolarHBondContact N-O 3.05Å; C41-P280 PolarHBondContact SG-O 2.81Å; C41-R283 HydrophobicContact CB-CB 4.27Å; C41-R283 HydrophobicContact CB-CG 4.24Å; C41-R283 PolarHBondContact O-NE 2.66Å; C41-R283 PolarHBondContact O-NH2 3.33Å
42	L	87.6	Confident	80.9	Confident	22 Å²	22	57.3 Å²	57.3	12%	0.115	29%	0.288	C	S	.	.			trans	-119.9	65	177.9	-56.8	177.2	0	0	0	110.7	Y40 E44 K45 R283	Y40-L42 HydrophobicContact CD1-CB 4.16Å; Y40-L42 WeakPolarHBondContact CD1-O 3.47Å; Y40-L42 HydrophobicContact CE1-CB 3.68Å; Y40-L42 WeakPolarHBondContact CE1-O 3.44Å; Y40-L42 PolarHBondContact O-N 3.43Å; L42-E44 WeakPolarHBondContact CA-OE2 3.48Å; L42-E44 PolarHBondContact O-N 3.18Å; L42-K45 HydrophobicContact CB-CB 4.36Å; L42-K45 HydrophobicContact CB-CD 4.24Å; L42-K45 HydrophobicContact CB-CG 4.25Å; L42-K45 HydrophobicContact CD1-CD 3.83Å; L42-K45 PolarHBondContact O-N 3.29Å; L42-R283 VanDerWaalsContact CD2-CZ 3.45Å; L42-R283 VanDerWaalsContact CD2-NH1 3.28Å
43	P	82.8	Confident	80.1	Confident	52 Å²	52	58.1 Å²	58.1	34%	0.338	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-57.4	-29.2	-179.2	25.3	-35.5	0	0	0	113.3	C41 K45 L46	C41-P43 VanDerWaalsContact C-CD 3.41Å; C41-P43 WeakPolarHBondContact O-CD 3.44Å; P43-K45 PolarHBondContact O-N 2.83Å; P43-L46 WeakPolarHBondContact O-CB 3.33Å; P43-L46 PolarHBondContact O-N 2.63Å
44	E	81.2	Confident	79.4	Confident	107 Å²	107	63 Å²	63	50%	0.5	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-60.2	-25.2	175.5	65.9	-88.3	-149.8	0	0	113.6	L42 L46 R283	L42-E44 WeakPolarHBondContact CA-OE2 3.48Å; L42-E44 PolarHBondContact O-N 3.18Å; E44-L46 VanDerWaalsContact C-N 3.32Å; E44-R283 VanDerWaalsContact CD-NH2 3.27Å; E44-R283 IonicContact OE1-CZ 3.35Å; E44-R283 IonicContact OE1-NH1 3.47Å; E44-R283 PolarHBondContact OE1-NH1 2.96Å; E44-R283 IonicContact OE1-NH2 2.74Å; E44-R283 PolarHBondContact OE1-NH2 3.39Å; E44-R283 IonicContact OE2-CZ 3.92Å; E44-R283 IonicContact OE2-NH2 3.45Å; E44-R283 PolarHBondContact OE2-NH2 3Å
45	K	80.9	Confident	78.7	Confident	96 Å²	96	65.8 Å²	65.8	42%	0.417	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-84.6	-0.6	176.2	-71	-170	176.3	-175.4	0	113.9	Y40 L42 P43 L83	Y40-K45 HydrophobicContact CE1-CB 4.27Å; L42-K45 HydrophobicContact CB-CB 4.36Å; L42-K45 HydrophobicContact CB-CD 4.24Å; L42-K45 HydrophobicContact CB-CG 4.25Å; L42-K45 HydrophobicContact CD1-CD 3.83Å; L42-K45 PolarHBondContact O-N 3.29Å; P43-K45 PolarHBondContact O-N 2.83Å; K45-L83 HydrophobicContact CB-CD2 4.22Å; K45-L83 WeakPolarHBondContact O-CD2 3.34Å
46	L	81.1	Confident	77.8	Confident	27 Å²	27	68 Å²	68	14%	0.141	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-89.7	0.4	-179.1	-58.9	-179.3	0	0	0	113.5	M37 Y40 P43 E44 M49 L83	M37-L46 HydrophobicContact CG-CD1 4.32Å; Y40-L46 HydrophobicContact CD1-CD1 4.44Å; Y40-L46 HydrophobicContact CD1-CD2 3.69Å; Y40-L46 HydrophobicContact CD1-CG 4.09Å; Y40-L46 HydrophobicContact CE1-CD2 4.15Å; P43-L46 WeakPolarHBondContact O-CB 3.33Å; P43-L46 PolarHBondContact O-N 2.63Å; E44-L46 VanDerWaalsContact C-N 3.32Å; L46-M49 WeakPolarHBondContact O-CB 3.22Å; L46-M49 PolarHBondContact O-N 3.33Å; L46-L83 HydrophobicContact CD2-CD1 4.01Å; L46-L83 HydrophobicContact CD2-CD2 3.84Å
47	F	72.3	Confident	76.8	Confident	202 Å²	202	70.1 Å²	70.1	89%	0.886	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	136	172.7	-166.1	-94.3	0	0	0	110.7	M49	F47-M49 PolarHBondContact O-N 3.41Å
48	G	65.9	Low	76	Confident	33 Å²	33	69.9 Å²	69.9	34%	0.34	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	-4.5	-173.3	0	0	0	0	0	115.3	E51 A52	G48-E51 WeakPolarHBondContact CA-OE2 3.28Å; G48-A52 PolarHBondContact O-N 3.09Å; G48-A52 VanDerWaalsContact O-N 3.07Å
49	M	71.8	Confident	75.2	Confident	24 Å²	24	67.8 Å²	67.8	12%	0.118	35%	0.354	C	S	.	.	H	α-helix	trans	-67.5	-37.3	-178.1	179.3	55.7	64.9	0	0	112.1	L46 F47 E51 A52 I53 A82 L83	L46-M49 WeakPolarHBondContact O-CB 3.22Å; L46-M49 PolarHBondContact O-N 3.33Å; F47-M49 PolarHBondContact O-N 3.41Å; M49-E51 VanDerWaalsContact C-N 3.32Å; M49-E51 PolarHBondContact O-N 2.91Å; M49-A52 PolarHBondContact O-N 3.2Å; M49-I53 HydrophobicContact CG-CD1 3.7Å; M49-I53 HydrophobicContact CG-CG1 4.39Å; M49-I53 WeakPolarHBondContact O-CB 3.32Å; M49-I53 VanDerWaalsContact O-CD1 3.24Å; M49-I53 WeakPolarHBondContact O-CD1 3.46Å; M49-I53 WeakPolarHBondContact O-CG1 3.5Å; M49-I53 PolarHBondContact O-N 2.83Å; M49-I53 HydrophobicContact SD-CD1 3.95Å; M49-I53 HydrophobicContact SD-CG1 4.04Å; M49-A82 HydrophobicContact CE-CB 4.07Å; M49-L83 HydrophobicContact CE-CD1 3.9Å; M49-L83 HydrophobicContact CE-CD2 3.57Å; M49-L83 HydrophobicContact CE-CG 3.62Å
50	Q	65.4	Low	74	Confident	141 Å²	141	67.5 Å²	67.5	66%	0.659	36%	0.357	S	S	*	.	H	α-helix	trans	-65.7	-38.4	-179	-176.1	168.8	-29.1	0	0	111.3	Q54	Q50-Q54 WeakPolarHBondContact O-CB 3.38Å; Q50-Q54 PolarHBondContact O-N 3.04Å
51	E	67.7	Low	72.6	Confident	110 Å²	110	74.4 Å²	74.4	51%	0.514	39%	0.389	S	S	.	.	H	α-helix	trans	-67.7	-44.6	175.4	-63.4	65.9	-149.1	0	0	110.8	G48 M49 Q54 Q55	G48-E51 WeakPolarHBondContact CA-OE2 3.28Å; M49-E51 VanDerWaalsContact C-N 3.32Å; M49-E51 PolarHBondContact O-N 2.91Å; E51-Q54 PolarHBondContact O-N 2.93Å; E51-Q55 WeakPolarHBondContact O-CG 3.25Å; E51-Q55 PolarHBondContact O-N 3.49Å
52	A	68.4	Low	71.5	Confident	36 Å²	36	75.8 Å²	75.8	30%	0.298	40%	0.396	S	S	.	.	H	α-helix	trans	-62.4	-42.6	175.5	0	0	0	0	0	112.2	G48 M49 Q54 Q55 V56	G48-A52 PolarHBondContact O-N 3.09Å; G48-A52 VanDerWaalsContact O-N 3.07Å; M49-A52 PolarHBondContact O-N 3.2Å; A52-Q54 VanDerWaalsContact C-N 3.35Å; A52-Q55 PolarHBondContact O-N 2.89Å; A52-V56 WeakPolarHBondContact O-CG2 3.42Å; A52-V56 PolarHBondContact O-N 2.86Å
53	I	69.3	Low	70.2	Confident	23 Å²	23	78.9 Å²	78.9	12%	0.118	41%	0.412	C	S	.	.	H	α-helix	trans	-60.8	-45.2	173.1	-69.5	155.1	0	0	0	110.6	I29 L30 A33 M49 Q55 V56 I57	I29-I53 HydrophobicContact CG2-CG2 4.01Å; L30-I53 HydrophobicContact CD2-CG2 4.25Å; A33-I53 HydrophobicContact CB-CD1 3.24Å; A33-I53 HydrophobicContact CB-CG1 4.24Å; M49-I53 HydrophobicContact CG-CD1 3.7Å; M49-I53 HydrophobicContact CG-CG1 4.39Å; M49-I53 WeakPolarHBondContact O-CB 3.32Å; M49-I53 VanDerWaalsContact O-CD1 3.24Å; M49-I53 WeakPolarHBondContact O-CD1 3.46Å; M49-I53 WeakPolarHBondContact O-CG1 3.5Å; M49-I53 PolarHBondContact O-N 2.83Å; M49-I53 HydrophobicContact SD-CD1 3.95Å; M49-I53 HydrophobicContact SD-CG1 4.04Å; I53-Q55 VanDerWaalsContact C-N 3.34Å; I53-Q55 PolarHBondContact O-N 3.4Å; I53-V56 PolarHBondContact O-N 2.87Å; I53-I57 HydrophobicContact CG2-CD1 3.7Å; I53-I57 HydrophobicContact CG2-CG1 4.4Å; I53-I57 WeakPolarHBondContact O-CB 3.35Å; I53-I57 WeakPolarHBondContact O-CG1 3.5Å; I53-I57 PolarHBondContact O-N 2.83Å
54	Q	68.5	Low	69.4	Low	112 Å²	112	84.5 Å²	84.5	52%	0.523	43%	0.434	S	S	.	.	H	α-helix	trans	-64.1	-39.7	179.6	-171.3	58.4	49.9	0	0	111.5	Q50 E51 A52 I57 T58	Q50-Q54 WeakPolarHBondContact O-CB 3.38Å; Q50-Q54 PolarHBondContact O-N 3.04Å; E51-Q54 PolarHBondContact O-N 2.93Å; A52-Q54 VanDerWaalsContact C-N 3.35Å; Q54-I57 PolarHBondContact O-N 3.3Å; Q54-T58 PolarHBondContact NE2-OG1 3.16Å; Q54-T58 VanDerWaalsContact O-CB 3.29Å; Q54-T58 WeakPolarHBondContact O-CB 3.49Å; Q54-T58 PolarHBondContact O-N 3.28Å; Q54-T58 PolarHBondContact O-OG1 3.32Å
55	Q	69.5	Low	68.9	Low	145 Å²	145	81 Å²	81	68%	0.678	42%	0.419	S	S	*	.	H	α-helix	trans	-61.8	-47.1	172.7	-75.7	-178.2	-10.3	0	0	112	E51 A52 I53 I57 T58 S59	E51-Q55 WeakPolarHBondContact O-CG 3.25Å; E51-Q55 PolarHBondContact O-N 3.49Å; A52-Q55 PolarHBondContact O-N 2.89Å; I53-Q55 VanDerWaalsContact C-N 3.34Å; I53-Q55 PolarHBondContact O-N 3.4Å; Q55-I57 VanDerWaalsContact C-N 3.34Å; Q55-I57 PolarHBondContact O-N 2.98Å; Q55-T58 CarbonylContact O-C 3.58Å; Q55-T58 WeakPolarHBondContact O-CA 3.34Å; Q55-T58 PolarHBondContact O-N 3.12Å; Q55-S59 PolarHBondContact O-N 3.29Å
56	V	68.9	Low	68.5	Low	59 Å²	59	82.1 Å²	82.1	36%	0.358	44%	0.439	S	S	.	.	H	α-helix	trans	-65.5	-33.7	179.3	169.5	0	0	0	0	112.7	I29 A52 I53 T58 I62	I29-V56 HydrophobicContact CD1-CG1 4.3Å; A52-V56 WeakPolarHBondContact O-CG2 3.42Å; A52-V56 PolarHBondContact O-N 2.86Å; I53-V56 PolarHBondContact O-N 2.87Å; V56-T58 VanDerWaalsContact C-N 3.32Å; V56-I62 HydrophobicContact CG1-CD1 3.4Å; V56-I62 HydrophobicContact CG1-CG1 4.2Å
57	I	68.6	Low	68.6	Low	45 Å²	45	84.9 Å²	84.9	23%	0.231	45%	0.453	C	S	.	.	H	α-helix	trans	-69.4	-33.3	171.3	-70.4	170.7	0	0	0	111	I29 L30 I53 Q54 Q55	I29-I57 HydrophobicContact CD1-CG1 4.33Å; L30-I57 HydrophobicContact CD2-CD1 4Å; L30-I57 HydrophobicContact CG-CD1 4.17Å; I53-I57 HydrophobicContact CG2-CD1 3.7Å; I53-I57 HydrophobicContact CG2-CG1 4.4Å; I53-I57 WeakPolarHBondContact O-CB 3.35Å; I53-I57 WeakPolarHBondContact O-CG1 3.5Å; I53-I57 PolarHBondContact O-N 2.83Å; Q54-I57 PolarHBondContact O-N 3.3Å; Q55-I57 VanDerWaalsContact C-N 3.34Å; Q55-I57 PolarHBondContact O-N 2.98Å
58	T	68.1	Low	69.2	Low	102 Å²	102	79.7 Å²	79.7	63%	0.626	43%	0.43	S	S	*	.	H	α-helix	trans	-84.3	-28.7	-176.4	-52.1	0	0	0	0	113.3	Q54 Q55 V56 G60	Q54-T58 PolarHBondContact NE2-OG1 3.16Å; Q54-T58 VanDerWaalsContact O-CB 3.29Å; Q54-T58 WeakPolarHBondContact O-CB 3.49Å; Q54-T58 PolarHBondContact O-N 3.28Å; Q54-T58 PolarHBondContact O-OG1 3.32Å; Q55-T58 CarbonylContact O-C 3.58Å; Q55-T58 WeakPolarHBondContact O-CA 3.34Å; Q55-T58 PolarHBondContact O-N 3.12Å; V56-T58 VanDerWaalsContact C-N 3.32Å; T58-G60 VanDerWaalsContact C-N 3.26Å; T58-G60 PolarHBondContact O-N 3.3Å
59	S	69.3	Low	70.1	Confident	61 Å²	61	85 Å²	85	43%	0.427	44%	0.444	S	S	.	.	H	α-helix	trans	-68.7	-25.1	178.4	79.9	0	0	0	0	113.1	Q55 E61	Q55-S59 PolarHBondContact O-N 3.29Å; S59-E61 PolarHBondContact O-N 3.06Å; S59-E61 VanDerWaalsContact O-N 3.12Å; S59-E61 PolarHBondContact OG-OE2 3.03Å
60	G	64.6	Low	70.7	Confident	20 Å²	20	87.4 Å²	87.4	21%	0.206	46%	0.46	C	S	.	.			trans	72.8	-5	176.5	0	0	0	0	0	115.3	T58 I62 L63	T58-G60 VanDerWaalsContact C-N 3.26Å; T58-G60 PolarHBondContact O-N 3.3Å; G60-I62 VanDerWaalsContact C-N 3.29Å; G60-I62 PolarHBondContact O-N 2.95Å; G60-L63 VanDerWaalsContact O-CB 3.25Å; G60-L63 WeakPolarHBondContact O-CB 3.45Å; G60-L63 WeakPolarHBondContact O-CG 3.49Å; G60-L63 PolarHBondContact O-N 2.72Å
61	E	64.4	Low	71.6	Confident	145 Å²	145	81.2 Å²	81.2	68%	0.678	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-58.6	-39.7	-175.9	-64.6	168.4	122.4	0	0	112.3	S59 L63	S59-E61 PolarHBondContact O-N 3.06Å; S59-E61 VanDerWaalsContact O-N 3.12Å; S59-E61 PolarHBondContact OG-OE2 3.03Å; E61-L63 PolarHBondContact O-N 3.45Å
62	I	64.4	Low	72.5	Confident	30 Å²	30	76.2 Å²	76.2	15%	0.154	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-68	-22.6	178.8	-61.9	-169.8	0	0	0	112.2	Q25 I29 V56 G60 Q64 I65 L71 L75	Q25-I62 PolarHBondContact NE2-O 2.61Å; I29-I62 HydrophobicContact CD1-CD1 4.23Å; I29-I62 HydrophobicContact CD1-CG2 4.31Å; V56-I62 HydrophobicContact CG1-CD1 3.4Å; V56-I62 HydrophobicContact CG1-CG1 4.2Å; G60-I62 VanDerWaalsContact C-N 3.29Å; G60-I62 PolarHBondContact O-N 2.95Å; I62-Q64 VanDerWaalsContact C-N 3.26Å; I62-Q64 PolarHBondContact O-N 3.49Å; I62-I65 HydrophobicContact CB-CD1 4.48Å; I62-I65 HydrophobicContact CG2-CD1 4.38Å; I62-I65 PolarHBondContact O-N 3.38Å; I62-L71 HydrophobicContact CG2-CD1 3.63Å; I62-L75 HydrophobicContact CD1-CD2 4.34Å
63	L	61.4	Low	73.3	Confident	86 Å²	86	78.4 Å²	78.4	45%	0.45	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-68.7	-22.9	-176.6	-56	178.7	0	0	0	113	Q25 P26 G60 E61	Q25-L63 HydrophobicContact CB-CD2 3.87Å; Q25-L63 PolarHBondContact NE2-O 3.14Å; Q25-L63 PolarHBondContact OE1-O 2.96Å; P26-L63 HydrophobicContact CG-CD2 4.22Å; G60-L63 VanDerWaalsContact O-CB 3.25Å; G60-L63 WeakPolarHBondContact O-CB 3.45Å; G60-L63 WeakPolarHBondContact O-CG 3.49Å; G60-L63 PolarHBondContact O-N 2.72Å; E61-L63 PolarHBondContact O-N 3.45Å
64	Q	64.8	Low	74.1	Confident	171 Å²	171	81.6 Å²	81.6	80%	0.799	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-84.9	-6.8	-178.9	-56.7	-165.3	19.2	0	0	113.8	I62 S66	I62-Q64 VanDerWaalsContact C-N 3.26Å; I62-Q64 PolarHBondContact O-N 3.49Å; Q64-S66 PolarHBondContact O-N 3.42Å
65	I	72.1	Confident	74.9	Confident	33 Å²	33	77 Å²	77	17%	0.169	42%	0.418	C	S	.	.			trans	-85.3	106.1	-174.8	-53.4	162.3	0	0	0	110.4	Q25 I62 T70 L71 L74	Q25-I65 PolarHBondContact NE2-O 2.69Å; I62-I65 HydrophobicContact CB-CD1 4.48Å; I62-I65 HydrophobicContact CG2-CD1 4.38Å; I62-I65 PolarHBondContact O-N 3.38Å; I65-T70 HydrophobicContact CG2-CG2 4.21Å; I65-L71 HydrophobicContact CD1-CD1 4.22Å; I65-L71 HydrophobicContact CG2-CB 3.98Å; I65-L74 HydrophobicContact CD1-CD1 3.54Å; I65-L74 HydrophobicContact CG1-CD1 4.39Å
66	S	72.4	Confident	75.7	Confident	120 Å²	120	71.1 Å²	71.1	84%	0.839	39%	0.392	S	S	*	.			trans	-85.9	-25.9	177.4	-49.4	0	0	0	0	114.7	Q64	Q64-S66 PolarHBondContact O-N 3.42Å
67	D	83.9	Confident	76.4	Confident	84 Å²	84	71 Å²	71	45%	0.449	40%	0.398	S	S	.	.			trans	-82.9	127.8	179	-177.5	73.7	0	0	0	112.3	K69 T70 L71	D67-K69 WeakPolarHBondContact OD2-CA 3.39Å; D67-K69 WeakPolarHBondContact OD2-CB 3.45Å; D67-K69 PolarHBondContact OD2-N 2.85Å; D67-T70 PolarHBondContact OD2-N 3.08Å; D67-T70 PolarHBondContact OD2-OG1 2.94Å; D67-L71 VanDerWaalsContact O-CB 3.3Å; D67-L71 WeakPolarHBondContact O-CB 3.19Å; D67-L71 PolarHBondContact O-N 2.98Å
68	K	83.4	Confident	77.1	Confident	93 Å²	93	71 Å²	71	40%	0.404	41%	0.408	S	S	.	.	H	α-helix	trans	-74	-25.5	-174.7	-59.8	-173.9	-174.4	-178.7	0	113.8	A72 Y92 D274 F275	K68-A72 WeakPolarHBondContact O-CB 3.38Å; K68-A72 PolarHBondContact O-N 2.95Å; K68-A72 VanDerWaalsContact O-N 3.08Å; K68-Y92 HydrophobicContact CB-CD1 3.72Å; K68-Y92 HydrophobicContact CB-CD2 4Å; K68-Y92 HydrophobicContact CB-CE1 4.02Å; K68-Y92 HydrophobicContact CB-CE2 4.31Å; K68-Y92 HydrophobicContact CB-CG 3.73Å; K68-Y92 HydrophobicContact CD-CD1 4.16Å; K68-Y92 HydrophobicContact CD-CD2 3.94Å; K68-Y92 HydrophobicContact CD-CE1 3.64Å; K68-Y92 HydrophobicContact CD-CE2 3.4Å; K68-Y92 VanDerWaalsContact CD-CE2 3.4Å; K68-Y92 HydrophobicContact CD-CG 4.31Å; K68-Y92 HydrophobicContact CG-CE1 4.49Å; K68-Y92 HydrophobicContact CG-CE2 4.48Å; K68-Y92 PolarHBondContact NZ-OH 3.04Å; K68-D274 IonicContact NZ-OD2 3.75Å; K68-F275 HydrophobicContact CB-CE2 4.45Å; K68-F275 HydrophobicContact CB-CZ 3.79Å; K68-F275 HydrophobicContact CD-CE2 4.48Å; K68-F275 HydrophobicContact CG-CZ 4.22Å; K68-F275 VanDerWaalsContact O-CE1 3.23Å; K68-F275 WeakPolarHBondContact O-CE1 3.42Å
69	K	85.6	Confident	77.9	Confident	146 Å²	146	66.9 Å²	66.9	64%	0.635	38%	0.383	S	S	*	.	H	α-helix	trans	-79.7	-44.8	176.5	-68.8	-177.6	176.2	-179.4	0	110.7	D67 L71 A72 S73	D67-K69 WeakPolarHBondContact OD2-CA 3.39Å; D67-K69 WeakPolarHBondContact OD2-CB 3.45Å; D67-K69 PolarHBondContact OD2-N 2.85Å; K69-L71 VanDerWaalsContact C-N 3.27Å; K69-L71 PolarHBondContact O-N 2.9Å; K69-A72 WeakPolarHBondContact O-CB 3.32Å; K69-A72 PolarHBondContact O-N 3.3Å; K69-A72 VanDerWaalsContact O-N 3.09Å; K69-S73 PolarHBondContact O-N 3.43Å; K69-S73 PolarHBondContact O-OG 2.8Å
70	T	84.3	Confident	78.8	Confident	73 Å²	73	66.8 Å²	66.8	45%	0.448	38%	0.376	S	S	.	.	H	α-helix	trans	-57.7	-42.1	171.2	-62.1	0	0	0	0	110.9	I65 D67 S73 L74	I65-T70 HydrophobicContact CG2-CG2 4.21Å; D67-T70 PolarHBondContact OD2-N 3.08Å; D67-T70 PolarHBondContact OD2-OG1 2.94Å; T70-S73 PolarHBondContact O-N 2.97Å; T70-L74 HydrophobicContact CG2-CD1 3.85Å; T70-L74 WeakPolarHBondContact O-CB 3.47Å; T70-L74 WeakPolarHBondContact O-CG 3.43Å; T70-L74 PolarHBondContact O-N 3.36Å
71	L	84.2	Confident	79.6	Confident	12 Å²	12	68.4 Å²	68.4	6%	0.063	39%	0.392	C	S	.	.	H	α-helix	trans	-60.6	-43.8	172.7	-177.5	57.3	0	0	0	112.2	L28 I62 I65 D67 K69 S73 L74 L75 F275	L28-L71 HydrophobicContact CD2-CD2 4.09Å; I62-L71 HydrophobicContact CG2-CD1 3.63Å; I65-L71 HydrophobicContact CD1-CD1 4.22Å; I65-L71 HydrophobicContact CG2-CB 3.98Å; D67-L71 VanDerWaalsContact O-CB 3.3Å; D67-L71 WeakPolarHBondContact O-CB 3.19Å; D67-L71 PolarHBondContact O-N 2.98Å; K69-L71 VanDerWaalsContact C-N 3.27Å; K69-L71 PolarHBondContact O-N 2.9Å; L71-S73 PolarHBondContact O-N 2.94Å; L71-L74 PolarHBondContact O-N 2.78Å; L71-L75 HydrophobicContact CD1-CD1 3.93Å; L71-L75 HydrophobicContact CD1-CG 4.03Å; L71-L75 HydrophobicContact CG-CD1 3.85Å; L71-L75 HydrophobicContact CG-CG 4.4Å; L71-L75 WeakPolarHBondContact O-CB 3.46Å; L71-L75 VanDerWaalsContact O-CG 3.22Å; L71-L75 WeakPolarHBondContact O-CG 3.3Å; L71-L75 PolarHBondContact O-N 2.85Å; L71-F275 HydrophobicContact CB-CZ 4.48Å; L71-F275 HydrophobicContact CD2-CE1 4.48Å; L71-F275 HydrophobicContact CD2-CZ 3.93Å; L71-F275 HydrophobicContact CG-CE1 4.4Å; L71-F275 HydrophobicContact CG-CZ 4.31Å
72	A	86.3	Confident	80.3	Confident	4 Å²	4	64.4 Å²	64.4	3%	0.033	38%	0.384	C	S	.	.	H	α-helix	trans	-62.6	-40.8	175.9	0	0	0	0	0	112.8	K68 K69 T76 V90 F275	K68-A72 WeakPolarHBondContact O-CB 3.38Å; K68-A72 PolarHBondContact O-N 2.95Å; K68-A72 VanDerWaalsContact O-N 3.08Å; K69-A72 WeakPolarHBondContact O-CB 3.32Å; K69-A72 PolarHBondContact O-N 3.3Å; K69-A72 VanDerWaalsContact O-N 3.09Å; A72-T76 WeakPolarHBondContact O-CB 3.2Å; A72-T76 PolarHBondContact O-N 3.47Å; A72-T76 PolarHBondContact O-OG1 2.94Å; A72-V90 HydrophobicContact CB-CG1 4.33Å; A72-F275 HydrophobicContact CB-CD1 4.2Å; A72-F275 HydrophobicContact CB-CE1 3.95Å
73	S	85.8	Confident	81.2	Confident	83 Å²	83	63.3 Å²	63.3	58%	0.58	38%	0.378	S	S	*	.	H	α-helix	trans	-66.9	-40.7	176.1	-63.8	0	0	0	0	112.7	K69 T70 L71 T76 A77	K69-S73 PolarHBondContact O-N 3.43Å; K69-S73 PolarHBondContact O-OG 2.8Å; T70-S73 PolarHBondContact O-N 2.97Å; L71-S73 PolarHBondContact O-N 2.94Å; S73-T76 WeakPolarHBondContact O-CB 3.33Å; S73-T76 PolarHBondContact O-N 3.45Å; S73-A77 PolarHBondContact O-N 3.02Å
74	L	85.3	Confident	82.4	Confident	90 Å²	90	69.6 Å²	69.6	47%	0.471	40%	0.396	S	S	.	.	H	α-helix	trans	-70.9	-40.4	177.4	-73.7	166.1	0	0	0	112.1	I65 T70 L71 T76 A77 G78	I65-L74 HydrophobicContact CD1-CD1 3.54Å; I65-L74 HydrophobicContact CG1-CD1 4.39Å; T70-L74 HydrophobicContact CG2-CD1 3.85Å; T70-L74 WeakPolarHBondContact O-CB 3.47Å; T70-L74 WeakPolarHBondContact O-CG 3.43Å; T70-L74 PolarHBondContact O-N 3.36Å; L71-L74 PolarHBondContact O-N 2.78Å; L74-T76 VanDerWaalsContact C-N 3.29Å; L74-T76 PolarHBondContact O-N 3.36Å; L74-A77 PolarHBondContact O-N 2.89Å; L74-G78 PolarHBondContact O-N 2.98Å
75	L	84.9	Confident	83.5	Confident	14 Å²	14	61.7 Å²	61.7	7%	0.073	36%	0.359	C	S	.	.	H	α-helix	trans	-62.1	-37.2	171.5	-71.1	169	0	0	0	111.6	L28 I29 I32 I62 L71 G78 V79 V90	L28-L75 HydrophobicContact CD2-CD1 4.01Å; I29-L75 HydrophobicContact CG1-CD2 4.39Å; I32-L75 HydrophobicContact CD1-CD1 3.91Å; I32-L75 HydrophobicContact CD1-CD2 4.36Å; I62-L75 HydrophobicContact CD1-CD2 4.34Å; L71-L75 HydrophobicContact CD1-CD1 3.93Å; L71-L75 HydrophobicContact CD1-CG 4.03Å; L71-L75 HydrophobicContact CG-CD1 3.85Å; L71-L75 HydrophobicContact CG-CG 4.4Å; L71-L75 WeakPolarHBondContact O-CB 3.46Å; L71-L75 VanDerWaalsContact O-CG 3.22Å; L71-L75 WeakPolarHBondContact O-CG 3.3Å; L71-L75 PolarHBondContact O-N 2.85Å; L75-G78 PolarHBondContact O-N 3.17Å; L75-V79 WeakPolarHBondContact O-CG2 3.24Å; L75-V79 PolarHBondContact O-N 3.26Å; L75-V90 HydrophobicContact CB-CB 4.1Å; L75-V90 HydrophobicContact CB-CG1 4.11Å; L75-V90 HydrophobicContact CB-CG2 4.09Å; L75-V90 HydrophobicContact CD1-CG1 4.26Å
76	T	87.7	Confident	84.2	Confident	22 Å²	22	63.8 Å²	63.8	14%	0.135	38%	0.375	C	S	.	.	H	α-helix	trans	-60.3	-53.3	172.2	-62.4	0	0	0	0	111.3	A72 S73 L74 G78 V79 Q80 T89 V90	A72-T76 WeakPolarHBondContact O-CB 3.2Å; A72-T76 PolarHBondContact O-N 3.47Å; A72-T76 PolarHBondContact O-OG1 2.94Å; S73-T76 WeakPolarHBondContact O-CB 3.33Å; S73-T76 PolarHBondContact O-N 3.45Å; L74-T76 VanDerWaalsContact C-N 3.29Å; L74-T76 PolarHBondContact O-N 3.36Å; T76-G78 VanDerWaalsContact C-N 3.27Å; T76-G78 PolarHBondContact O-N 2.9Å; T76-V79 WeakPolarHBondContact O-CG2 3.28Å; T76-V79 PolarHBondContact O-N 2.88Å; T76-Q80 HydrophobicContact CG2-CG 4.19Å; T76-Q80 WeakPolarHBondContact O-CB 3.38Å; T76-Q80 VanDerWaalsContact O-CG 3.26Å; T76-Q80 WeakPolarHBondContact O-CG 3.5Å; T76-Q80 PolarHBondContact O-N 3.03Å; T76-T89 HydrophobicContact CG2-CG2 4.19Å; T76-V90 PolarHBondContact OG1-N 3.24Å; T76-V90 PolarHBondContact OG1-O 2.96Å
77	A	84.1	Confident	85	Confident	58 Å²	58	59.9 Å²	59.9	48%	0.479	34%	0.342	S	S	.	.	H	α-helix	trans	-58.9	-39.1	178.8	0	0	0	0	0	112	S73 L74 G81	S73-A77 PolarHBondContact O-N 3.02Å; L74-A77 PolarHBondContact O-N 2.89Å; A77-G81 PolarHBondContact O-N 3.42Å
78	G	82.6	Confident	85.4	Confident	44 Å²	44	55.9 Å²	55.9	45%	0.454	32%	0.321	S	S	.	.	H	α-helix	trans	-60.8	-54.4	175.1	0	0	0	0	0	113.3	L74 L75 T76 Q80 G81 A82	L74-G78 PolarHBondContact O-N 2.98Å; L75-G78 PolarHBondContact O-N 3.17Å; T76-G78 VanDerWaalsContact C-N 3.27Å; T76-G78 PolarHBondContact O-N 2.9Å; G78-Q80 PolarHBondContact O-N 2.86Å; G78-G81 PolarHBondContact O-N 2.81Å; G78-A82 WeakPolarHBondContact O-CB 3.26Å; G78-A82 PolarHBondContact O-N 3.46Å
79	V	84.2	Confident	85.8	Confident	16 Å²	16	53.9 Å²	53.9	10%	0.097	32%	0.316	C	S	.	.	H	α-helix	trans	-68.8	-35	-178.8	-59.4	0	0	0	0	112.6	I32 L36 L75 T76 L83 L88	I32-V79 HydrophobicContact CG2-CG1 4.33Å; L36-V79 HydrophobicContact CD1-CG1 4.16Å; L75-V79 WeakPolarHBondContact O-CG2 3.24Å; L75-V79 PolarHBondContact O-N 3.26Å; T76-V79 WeakPolarHBondContact O-CG2 3.28Å; T76-V79 PolarHBondContact O-N 2.88Å; V79-L83 WeakPolarHBondContact O-CB 3.36Å; V79-L83 PolarHBondContact O-N 3.46Å; V79-L83 VanDerWaalsContact O-N 3.12Å; V79-L88 HydrophobicContact CB-CD1 4.41Å; V79-L88 HydrophobicContact CG2-CB 3.81Å; V79-L88 HydrophobicContact CG2-CD1 4.5Å
80	Q	88.3	Confident	86	Confident	59 Å²	59	47.3 Å²	47.3	28%	0.276	29%	0.289	S	S	.	.	H	α-helix	trans	-66.9	-42.9	174.7	-71.3	-175.4	-7.7	0	0	111.7	T76 G78 R84 P86 L88	T76-Q80 HydrophobicContact CG2-CG 4.19Å; T76-Q80 WeakPolarHBondContact O-CB 3.38Å; T76-Q80 VanDerWaalsContact O-CG 3.26Å; T76-Q80 WeakPolarHBondContact O-CG 3.5Å; T76-Q80 PolarHBondContact O-N 3.03Å; G78-Q80 PolarHBondContact O-N 2.86Å; Q80-R84 WeakPolarHBondContact O-CA 3.29Å; Q80-R84 PolarHBondContact O-N 3.26Å; Q80-P86 PolarHBondContact NE2-O 3Å; Q80-P86 VanDerWaalsContact NE2-O 3.16Å; Q80-L88 HydrophobicContact CG-CB 4.42Å; Q80-L88 WeakPolarHBondContact CG-O 3.47Å; Q80-L88 PolarHBondContact NE2-O 3.2Å
81	G	81.1	Confident	86.3	Confident	53 Å²	53	45.1 Å²	45.1	55%	0.546	28%	0.276	S	S	.	.	H	α-helix	trans	-65.9	-45.5	177.9	0	0	0	0	0	112.8	A77 G78	A77-G81 PolarHBondContact O-N 3.42Å; G78-G81 PolarHBondContact O-N 2.81Å
82	A	80.7	Confident	86.5	Confident	62 Å²	62	47 Å²	47	51%	0.512	28%	0.283	S	S	.	.	H	α-helix	trans	-65.4	-45.5	-179.7	0	0	0	0	0	112.9	M49 G78	M49-A82 HydrophobicContact CE-CB 4.07Å; G78-A82 WeakPolarHBondContact O-CB 3.26Å; G78-A82 PolarHBondContact O-N 3.46Å
83	L	82.8	Confident	86.6	Confident	6 Å²	6	50.1 Å²	50.1	3%	0.031	30%	0.297	C	S	.	.	H	α-helix	trans	-97.9	-7.6	-173.6	-65.8	174.2	0	0	0	114.6	L36 Y40 K45 L46 M49 V79 D85 L88	L36-L83 HydrophobicContact CD1-CD1 4.32Å; Y40-L83 HydrophobicContact CD1-CD1 4.32Å; Y40-L83 HydrophobicContact CE1-CB 4.5Å; Y40-L83 HydrophobicContact CE1-CD1 3.89Å; Y40-L83 HydrophobicContact CE1-CD2 4.2Å; Y40-L83 HydrophobicContact CE1-CG 4.43Å; K45-L83 HydrophobicContact CB-CD2 4.22Å; K45-L83 WeakPolarHBondContact O-CD2 3.34Å; L46-L83 HydrophobicContact CD2-CD1 4.01Å; L46-L83 HydrophobicContact CD2-CD2 3.84Å; M49-L83 HydrophobicContact CE-CD1 3.9Å; M49-L83 HydrophobicContact CE-CD2 3.57Å; M49-L83 HydrophobicContact CE-CG 3.62Å; V79-L83 WeakPolarHBondContact O-CB 3.36Å; V79-L83 PolarHBondContact O-N 3.46Å; V79-L83 VanDerWaalsContact O-N 3.12Å; L83-D85 VanDerWaalsContact C-N 3.26Å; L83-D85 PolarHBondContact O-N 3.02Å; L83-L88 HydrophobicContact CB-CD1 3.94Å; L83-L88 HydrophobicContact CD1-CD1 3.54Å; L83-L88 HydrophobicContact CG-CD1 4.33Å
84	R	85.4	Confident	85.6	Confident	218 Å²	218	48.9 Å²	48.9	82%	0.823	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	44.5	-175.7	-56.3	-175.4	-176.9	-176.6	1.6	112.3	Q80	Q80-R84 WeakPolarHBondContact O-CA 3.29Å; Q80-R84 PolarHBondContact O-N 3.26Å
85	D	88	Confident	84.6	Confident	5 Å²	5	51.9 Å²	51.9	3%	0.027	31%	0.308	C	S	.	.			trans	-129.5	109.1	177	-170.5	-28.4	0	0	0	110.2	Y40 L83 R87 L88	Y40-D85 HydrophobicContact CE2-CB 4.43Å; Y40-D85 WeakPolarHBondContact OH-CB 3.28Å; L83-D85 VanDerWaalsContact C-N 3.26Å; L83-D85 PolarHBondContact O-N 3.02Å; D85-R87 PolarHBondContact O-N 3.43Å; D85-R87 WeakPolarHBondContact OD1-CB 3.17Å; D85-R87 WeakPolarHBondContact OD1-CG 3.38Å; D85-R87 IonicContact OD1-CZ 2.64Å; D85-R87 PolarHBondContact OD1-N 3.48Å; D85-R87 IonicContact OD1-NE 2.6Å; D85-R87 PolarHBondContact OD1-NE 2.97Å; D85-R87 IonicContact OD2-CZ 3.81Å; D85-R87 IonicContact OD2-NE 3.84Å; D85-R87 PolarHBondContact OD2-NE 3.29Å; D85-R87 VanDerWaalsContact OD2-NE 3.1Å; D85-R87 IonicContact OD2-NH2 3.85Å; D85-R87 PolarHBondContact OD2-NH2 3.37Å; D85-L88 HydrophobicContact CB-CD1 4.26Å; D85-L88 HydrophobicContact CB-CG 4.39Å; D85-L88 PolarHBondContact O-N 2.87Å
86	P	87.5	Confident	83.2	Confident	78 Å²	78	53.6 Å²	53.6	51%	0.506	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-7.1	-175.9	31.6	-36.6	0	0	0	113.8	Q80 L88 V295	Q80-P86 PolarHBondContact NE2-O 3Å; Q80-P86 VanDerWaalsContact NE2-O 3.16Å; P86-L88 VanDerWaalsContact C-N 3.32Å; P86-V295 HydrophobicContact CG-CG1 3.77Å
87	R	90	Very high	81.7	Confident	38 Å²	38	58.6 Å²	58.6	14%	0.143	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-23.8	178.9	-55.7	176	-70.3	180	2.8	112.2	D85 T89 S262 P280 E294 V295	D85-R87 PolarHBondContact O-N 3.43Å; D85-R87 WeakPolarHBondContact OD1-CB 3.17Å; D85-R87 WeakPolarHBondContact OD1-CG 3.38Å; D85-R87 IonicContact OD1-CZ 2.64Å; D85-R87 PolarHBondContact OD1-N 3.48Å; D85-R87 IonicContact OD1-NE 2.6Å; D85-R87 PolarHBondContact OD1-NE 2.97Å; D85-R87 IonicContact OD2-CZ 3.81Å; D85-R87 IonicContact OD2-NE 3.84Å; D85-R87 PolarHBondContact OD2-NE 3.29Å; D85-R87 VanDerWaalsContact OD2-NE 3.1Å; D85-R87 IonicContact OD2-NH2 3.85Å; D85-R87 PolarHBondContact OD2-NH2 3.37Å; R87-T89 PolarHBondContact O-N 2.9Å; R87-S262 WeakPolarHBondContact CD-OG 3.48Å; R87-S262 PolarHBondContact NH1-OG 3.21Å; R87-P280 HydrophobicContact CB-CG 4.31Å; R87-P280 VanDerWaalsContact CZ-CB 3.45Å; R87-E294 IonicContact NH1-OE1 2.69Å; R87-E294 PolarHBondContact NH1-OE1 2.6Å; R87-V295 HydrophobicContact CG-CG2 4Å
88	L	90.8	Very high	80.1	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	36%	0.36	C	S	.	.			trans	-68.5	120	175.9	-66.6	175.5	0	0	0	109.7	L36 Y40 V79 Q80 L83 D85 P86 T278 V279	L36-L88 HydrophobicContact CD2-CD1 4.42Å; L36-L88 HydrophobicContact CD2-CD2 3.68Å; Y40-L88 HydrophobicContact CD2-CD2 4.12Å; Y40-L88 HydrophobicContact CE2-CD1 4.07Å; Y40-L88 HydrophobicContact CE2-CD2 4.17Å; Y40-L88 HydrophobicContact CE2-CG 4.28Å; V79-L88 HydrophobicContact CB-CD1 4.41Å; V79-L88 HydrophobicContact CG2-CB 3.81Å; V79-L88 HydrophobicContact CG2-CD1 4.5Å; Q80-L88 HydrophobicContact CG-CB 4.42Å; Q80-L88 WeakPolarHBondContact CG-O 3.47Å; Q80-L88 PolarHBondContact NE2-O 3.2Å; L83-L88 HydrophobicContact CB-CD1 3.94Å; L83-L88 HydrophobicContact CD1-CD1 3.54Å; L83-L88 HydrophobicContact CG-CD1 4.33Å; D85-L88 HydrophobicContact CB-CD1 4.26Å; D85-L88 HydrophobicContact CB-CG 4.39Å; D85-L88 PolarHBondContact O-N 2.87Å; P86-L88 VanDerWaalsContact C-N 3.32Å; L88-T278 WeakPolarHBondContact CA-O 3.33Å; L88-V279 HydrophobicContact CD2-CG1 4.33Å; L88-V279 HydrophobicContact CD2-CG2 4.46Å
89	T	92.3	Very high	78.6	Confident	50 Å²	50	65.1 Å²	65.1	31%	0.307	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	134.5	178.8	47.1	0	0	0	0	110.9	T76 R87 I277 T278	T76-T89 HydrophobicContact CG2-CG2 4.19Å; R87-T89 PolarHBondContact O-N 2.9Å; T89-I277 CarbonylContact O-C 3.53Å; T89-I277 WeakPolarHBondContact O-CA 3.05Å; T89-T278 PolarHBondContact N-O 3.47Å; T89-T278 PolarHBondContact O-N 2.63Å; T89-T278 WeakPolarHBondContact OG1-CB 3.45Å; T89-T278 PolarHBondContact OG1-OG1 3.23Å
90	V	90.3	Very high	76.8	Confident	9 Å²	9	69.9 Å²	69.9	6%	0.055	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.8	173.3	-178.1	0	0	0	0	108.5	A72 L75 T76 I270 F275 Y276 I277	A72-V90 HydrophobicContact CB-CG1 4.33Å; L75-V90 HydrophobicContact CB-CB 4.1Å; L75-V90 HydrophobicContact CB-CG1 4.11Å; L75-V90 HydrophobicContact CB-CG2 4.09Å; L75-V90 HydrophobicContact CD1-CG1 4.26Å; T76-V90 PolarHBondContact OG1-N 3.24Å; T76-V90 PolarHBondContact OG1-O 2.96Å; V90-I270 HydrophobicContact CG1-CD1 4.48Å; V90-F275 HydrophobicContact CG1-CD1 4.18Å; V90-Y276 CarbonylContact C-O 3.59Å; V90-Y276 WeakPolarHBondContact CA-O 3.43Å; V90-I277 HydrophobicContact CG2-CB 4.35Å; V90-I277 HydrophobicContact CG2-CD1 4.11Å; V90-I277 HydrophobicContact CG2-CG1 4.08Å
91	S	91.1	Very high	74.6	Confident	27 Å²	27	72 Å²	72	19%	0.189	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	152.9	-173.7	51.2	0	0	0	0	110.7	F275 Y276	S91-F275 CarbonylContact O-C 3.55Å; S91-F275 VanDerWaalsContact O-CA 3.24Å; S91-F275 WeakPolarHBondContact O-CA 3.29Å; S91-Y276 PolarHBondContact N-O 3.37Å; S91-Y276 PolarHBondContact O-N 2.87Å; S91-Y276 PolarHBondContact OG-O 3.35Å
92	Y	88.4	Confident	73	Confident	50 Å²	50	75.1 Å²	75.1	20%	0.196	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	118.9	177.3	179.4	-104.9	0	0	0	110.9	K68 A94 D274 F275	K68-Y92 HydrophobicContact CB-CD1 3.72Å; K68-Y92 HydrophobicContact CB-CD2 4Å; K68-Y92 HydrophobicContact CB-CE1 4.02Å; K68-Y92 HydrophobicContact CB-CE2 4.31Å; K68-Y92 HydrophobicContact CB-CG 3.73Å; K68-Y92 HydrophobicContact CD-CD1 4.16Å; K68-Y92 HydrophobicContact CD-CD2 3.94Å; K68-Y92 HydrophobicContact CD-CE1 3.64Å; K68-Y92 HydrophobicContact CD-CE2 3.4Å; K68-Y92 VanDerWaalsContact CD-CE2 3.4Å; K68-Y92 HydrophobicContact CD-CG 4.31Å; K68-Y92 HydrophobicContact CG-CE1 4.49Å; K68-Y92 HydrophobicContact CG-CE2 4.48Å; K68-Y92 PolarHBondContact NZ-OH 3.04Å; Y92-A94 HydrophobicContact CE1-CB 3.97Å; Y92-D274 HydrophobicContact CD2-CB 4.21Å; Y92-D274 WeakPolarHBondContact CD2-O 3.44Å; Y92-D274 HydrophobicContact CE2-CB 3.48Å; Y92-D274 VanDerWaalsContact CE2-CB 3.48Å; Y92-D274 WeakPolarHBondContact CE2-OD2 3.43Å; Y92-D274 VanDerWaalsContact CZ-OD2 3.29Å; Y92-D274 PolarHBondContact OH-OD2 3.44Å; Y92-F275 HydrophobicContact CD2-CD1 4.14Å; Y92-F275 AromaticContact CD2-CD2 3.8Å; Y92-F275 HydrophobicContact CD2-CD2 3.8Å; Y92-F275 HydrophobicContact CD2-CE1 4.09Å; Y92-F275 AromaticContact CD2-CE2 3.73Å; Y92-F275 HydrophobicContact CD2-CE2 3.73Å; Y92-F275 AromaticContact CD2-CG 4Å; Y92-F275 HydrophobicContact CD2-CG 4Å; Y92-F275 AromaticContact CD2-CZ 3.88Å; Y92-F275 HydrophobicContact CD2-CZ 3.88Å; Y92-F275 HydrophobicContact CE2-CD2 4.33Å; Y92-F275 HydrophobicContact CE2-CE2 4.21Å; Y92-F275 HydrophobicContact CG-CE1 4.36Å; Y92-F275 HydrophobicContact CG-CZ 4.38Å
93	E	86.7	Confident	71.1	Confident	71 Å²	71	76.5 Å²	76.5	33%	0.332	45%	0.446	S	S	.	.			trans	-135.7	86.2	-169.3	-66.9	-175.6	173.8	0	0	111.3	N95 P96 K267 D274 Y276	E93-N95 PolarHBondContact O-N 2.72Å; E93-N95 VanDerWaalsContact O-N 3.14Å; E93-P96 WeakPolarHBondContact O-CD 3.18Å; E93-K267 IonicContact OE1-NZ 3.3Å; E93-K267 PolarHBondContact OE1-NZ 3.42Å; E93-K267 IonicContact OE2-NZ 3.34Å; E93-K267 PolarHBondContact OE2-NZ 3.16Å; E93-D274 PolarHBondContact N-O 3.17Å; E93-Y276 HydrophobicContact CB-CD2 4.2Å; E93-Y276 HydrophobicContact CB-CE2 4.16Å
94	A	65	Low	69.2	Low	56 Å²	56	84.7 Å²	84.7	46%	0.463	49%	0.489	S	S	.	.	S	Bend	trans	-63.5	-16.6	-175.7	0	0	0	0	0	115.6	Y92	Y92-A94 HydrophobicContact CE1-CB 3.97Å
95	N	65.9	Low	67.6	Low	153 Å²	153	82.4 Å²	82.4	82%	0.818	49%	0.488	S	S	*	.	S	Bend	trans	-138.8	79.1	177.5	-79.9	-48.6	0	0	0	109.7	E93 V97	E93-N95 PolarHBondContact O-N 2.72Å; E93-N95 VanDerWaalsContact O-N 3.14Å; N95-V97 PolarHBondContact O-N 2.89Å
96	P	54.7	Low	66.2	Low	51 Å²	51	88.4 Å²	88.4	33%	0.331	53%	0.525	S	S	.	.			trans	-75.5	110.9	-179.7	30.3	-32.4	0	0	0	110.2	E93 P98 Y276	E93-P96 WeakPolarHBondContact O-CD 3.18Å; P96-P98 VanDerWaalsContact O-CD 3.31Å; P96-P98 WeakPolarHBondContact O-CD 3.39Å; P96-Y276 HydrophobicContact CB-CE2 4.33Å; P96-Y276 VanDerWaalsContact CB-OH 3.24Å; P96-Y276 WeakPolarHBondContact CB-OH 3.31Å; P96-Y276 WeakPolarHBondContact CG-OH 3.18Å
97	V	56.5	Low	65.3	Low	126 Å²	126	88.8 Å²	88.8	76%	0.764	52%	0.522	S	S	*	.			trans	-75.4	118	167.8	179.4	0	0	0	0	108	N95 V99	N95-V97 PolarHBondContact O-N 2.89Å; V97-V99 PolarHBondContact O-N 3.32Å; V97-V99 VanDerWaalsContact O-N 3.08Å
98	P	50.1	Low	64.6	Low	106 Å²	106	89.8 Å²	89.8	69%	0.688	54%	0.535	S	S	*	.			trans	-69.3	110.1	177.4	-16.7	32	0	0	0	109.5	P96 V100	P96-P98 VanDerWaalsContact O-CD 3.31Å; P96-P98 WeakPolarHBondContact O-CD 3.39Å; P98-V100 HydrophobicContact CB-CG2 4.44Å; P98-V100 PolarHBondContact O-N 3.47Å
99	V	51.2	Low	63.6	Low	133 Å²	133	97.7 Å²	97.7	81%	0.806	57%	0.569	S	S	*	*			trans	-73.2	82.9	167.3	-176.8	0	0	0	0	107.4	V97 P101	V97-V99 PolarHBondContact O-N 3.32Å; V97-V99 VanDerWaalsContact O-N 3.08Å; V99-P101 VanDerWaalsContact O-CD 3.32Å; V99-P101 WeakPolarHBondContact O-CD 3.41Å
100	V	45.2	Very low	62.9	Low	116 Å²	116	99.4 Å²	99.4	70%	0.703	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-62.5	119.7	171.9	-178.8	0	0	0	0	107.4	P98	P98-V100 HydrophobicContact CB-CG2 4.44Å; P98-V100 PolarHBondContact O-N 3.47Å
101	P	43.9	Very low	62.3	Low	104 Å²	104	103.2 Å²	103.2	68%	0.675	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-59	131.3	175.9	-23.2	34.5	0	0	0	109.4	V99 A103	V99-P101 VanDerWaalsContact O-CD 3.32Å; V99-P101 WeakPolarHBondContact O-CD 3.41Å; P101-A103 PolarHBondContact O-N 2.99Å
102	P	45.6	Very low	61.4	Low	119 Å²	119	102.9 Å²	102.9	77%	0.773	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-59.9	132	176.6	25.3	-33.3	0	0	0	109.1	L104	P102-L104 PolarHBondContact O-N 3.08Å
103	A	41	Very low	60.7	Low	90 Å²	90	106.2 Å²	106.2	74%	0.744	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-55.5	129.9	-177.2	0	0	0	0	0	110.7	P101 Q105	P101-A103 PolarHBondContact O-N 2.99Å; A103-Q105 PolarHBondContact O-N 2.62Å
104	L	44.4	Very low	60.3	Low	179 Å²	179	111.3 Å²	111.3	94%	0.937	62%	0.618	S	S	*	*			trans	-63.9	91.7	-175.5	-80.5	165.8	0	0	0	111.3	P102	P102-L104 PolarHBondContact O-N 3.08Å
105	Q	51.6	Low	60.9	Low	169 Å²	169	110.8 Å²	110.8	79%	0.79	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-69.5	129.7	166.6	-67.2	-175.3	-7.2	0	0	109.2	A103 L107	A103-Q105 PolarHBondContact O-N 2.62Å; Q105-L107 PolarHBondContact O-N 2.8Å
106	T	58.5	Low	61.4	Low	132 Å²	132	104.2 Å²	104.2	81%	0.81	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-62.8	116.6	174.4	28.6	0	0	0	0	110.4	S108	T106-S108 PolarHBondContact O-N 2.92Å
107	L	67.3	Low	62.5	Low	85 Å²	85	111.5 Å²	111.5	45%	0.445	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-58.2	127.9	-177.3	-65	175	0	0	0	111.4	Q105 Q111 L112 L115	Q105-L107 PolarHBondContact O-N 2.8Å; L107-Q111 HydrophobicContact CB-CB 4.28Å; L107-Q111 HydrophobicContact CD2-CB 4.17Å; L107-L112 HydrophobicContact CB-CD2 3.9Å; L107-L112 HydrophobicContact CB-CG 3.99Å; L107-L112 HydrophobicContact CD1-CD2 3.95Å; L107-L115 HydrophobicContact CD1-CD2 4.47Å
108	S	76	Confident	63.7	Low	59 Å²	59	111.2 Å²	111.2	41%	0.413	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-66.4	158.9	173.7	66.9	0	0	0	0	111.8	T106 D110 Q111 L112	T106-S108 PolarHBondContact O-N 2.92Å; S108-D110 PolarHBondContact O-N 2.6Å; S108-D110 VanDerWaalsContact O-N 3.08Å; S108-Q111 PolarHBondContact O-N 3.16Å; S108-Q111 WeakPolarHBondContact OG-CG 3.2Å; S108-Q111 PolarHBondContact OG-N 2.81Å; S108-Q111 PolarHBondContact OG-OE1 2.9Å; S108-L112 WeakPolarHBondContact O-CG 3.26Å; S108-L112 PolarHBondContact O-N 3.3Å
109	K	70.9	Confident	65.4	Low	166 Å²	166	106.4 Å²	106.4	72%	0.722	56%	0.557	S	S	*	*	H	α-helix	trans	-54.3	-31.9	-180	-71	-177.9	177.2	178.9	0	113.3	R113	K109-R113 WeakPolarHBondContact O-CD 3.47Å; K109-R113 VanDerWaalsContact O-CG 3.28Å; K109-R113 WeakPolarHBondContact O-CG 3.44Å; K109-R113 PolarHBondContact O-N 2.95Å; K109-R113 VanDerWaalsContact O-N 3.08Å
110	D	76.8	Confident	67.2	Low	87 Å²	87	102 Å²	102	47%	0.465	53%	0.527	S	S	.	.	H	α-helix	trans	-84.8	-24.1	177.8	-66.8	-50.1	0	0	0	114.1	S108 R113 R114	S108-D110 PolarHBondContact O-N 2.6Å; S108-D110 VanDerWaalsContact O-N 3.08Å; D110-R113 WeakPolarHBondContact OD1-CD 3.35Å; D110-R113 IonicContact OD1-CZ 3.41Å; D110-R113 IonicContact OD1-NE 2.66Å; D110-R113 IonicContact OD1-NH1 2.69Å; D110-R113 PolarHBondContact OD1-NH1 3.49Å; D110-R114 VanDerWaalsContact O-CG 3.26Å; D110-R114 WeakPolarHBondContact O-CG 3.45Å; D110-R114 PolarHBondContact O-N 3.32Å; D110-R114 VanDerWaalsContact O-N 3.16Å
111	Q	76.6	Confident	69.4	Low	88 Å²	88	101.7 Å²	101.7	41%	0.411	52%	0.516	S	S	.	.	H	α-helix	trans	-69.3	-42.6	165.8	-73.6	162.6	-62.3	0	0	110.8	L107 S108 R113 R114 L115	L107-Q111 HydrophobicContact CB-CB 4.28Å; L107-Q111 HydrophobicContact CD2-CB 4.17Å; S108-Q111 PolarHBondContact O-N 3.16Å; S108-Q111 WeakPolarHBondContact OG-CG 3.2Å; S108-Q111 PolarHBondContact OG-N 2.81Å; S108-Q111 PolarHBondContact OG-OE1 2.9Å; Q111-R113 PolarHBondContact O-N 3.36Å; Q111-R114 PolarHBondContact O-N 2.88Å; Q111-R114 VanDerWaalsContact O-N 3.17Å; Q111-L115 PolarHBondContact O-N 3.46Å
112	L	72.8	Confident	71.7	Confident	21 Å²	21	98.5 Å²	98.5	11%	0.11	50%	0.495	C	S	.	.	H	α-helix	trans	-58.9	-44.8	174.1	-68	172.4	0	0	0	112.1	L107 S108 R114 L115 V116 T142	L107-L112 HydrophobicContact CB-CD2 3.9Å; L107-L112 HydrophobicContact CB-CG 3.99Å; L107-L112 HydrophobicContact CD1-CD2 3.95Å; S108-L112 WeakPolarHBondContact O-CG 3.26Å; S108-L112 PolarHBondContact O-N 3.3Å; L112-R114 VanDerWaalsContact C-N 3.34Å; L112-R114 PolarHBondContact O-N 3.34Å; L112-L115 PolarHBondContact O-N 2.97Å; L112-V116 WeakPolarHBondContact O-CG2 3.34Å; L112-V116 PolarHBondContact O-N 3.34Å; L112-T142 HydrophobicContact CD2-CG2 3.66Å
113	R	73.8	Confident	74	Confident	120 Å²	120	96.1 Å²	96.1	45%	0.453	48%	0.476	S	S	.	.	H	α-helix	trans	-58.2	-41.2	173.2	-79.2	160.7	168	174.1	-4.4	113.3	K109 D110 Q111 R117	K109-R113 WeakPolarHBondContact O-CD 3.47Å; K109-R113 VanDerWaalsContact O-CG 3.28Å; K109-R113 WeakPolarHBondContact O-CG 3.44Å; K109-R113 PolarHBondContact O-N 2.95Å; K109-R113 VanDerWaalsContact O-N 3.08Å; D110-R113 WeakPolarHBondContact OD1-CD 3.35Å; D110-R113 IonicContact OD1-CZ 3.41Å; D110-R113 IonicContact OD1-NE 2.66Å; D110-R113 IonicContact OD1-NH1 2.69Å; D110-R113 PolarHBondContact OD1-NH1 3.49Å; Q111-R113 PolarHBondContact O-N 3.36Å; R113-R117 VanDerWaalsContact O-CB 3.31Å; R113-R117 WeakPolarHBondContact O-CB 3.35Å; R113-R117 PolarHBondContact O-N 2.64Å
114	R	78.8	Confident	76.6	Confident	177 Å²	177	96.1 Å²	96.1	67%	0.668	46%	0.462	S	S	*	.	H	α-helix	trans	-69.8	-40.9	177.9	-72.8	171.1	-172.8	-170.3	3.2	111.7	D110 Q111 L112 R117 N118	D110-R114 VanDerWaalsContact O-CG 3.26Å; D110-R114 WeakPolarHBondContact O-CG 3.45Å; D110-R114 PolarHBondContact O-N 3.32Å; D110-R114 VanDerWaalsContact O-N 3.16Å; Q111-R114 PolarHBondContact O-N 2.88Å; Q111-R114 VanDerWaalsContact O-N 3.17Å; L112-R114 VanDerWaalsContact C-N 3.34Å; L112-R114 PolarHBondContact O-N 3.34Å; R114-R117 PolarHBondContact O-N 3.42Å; R114-N118 WeakPolarHBondContact O-CB 3.42Å; R114-N118 PolarHBondContact O-N 3.28Å; R114-N118 PolarHBondContact O-OD1 3.12Å
115	L	78.1	Confident	78.9	Confident	46 Å²	46	89.6 Å²	89.6	24%	0.241	43%	0.428	C	S	.	.	H	α-helix	trans	-57.4	-58	174	-176.6	65.7	0	0	0	110.2	L107 Q111 L112 R117 N118 S119 I138 T142	L107-L115 HydrophobicContact CD1-CD2 4.47Å; Q111-L115 PolarHBondContact O-N 3.46Å; L112-L115 PolarHBondContact O-N 2.97Å; L115-R117 VanDerWaalsContact C-N 3.32Å; L115-R117 PolarHBondContact O-N 2.84Å; L115-N118 PolarHBondContact O-N 2.57Å; L115-S119 WeakPolarHBondContact O-CB 3.48Å; L115-S119 PolarHBondContact O-N 3.05Å; L115-S119 PolarHBondContact O-OG 2.89Å; L115-I138 HydrophobicContact CD2-CD1 4.18Å; L115-I138 HydrophobicContact CG-CD1 4.07Å; L115-T142 HydrophobicContact CD2-CG2 4.19Å
116	V	75.1	Confident	80.5	Confident	15 Å²	15	87.8 Å²	87.8	9%	0.091	42%	0.419	C	S	.	.	H	α-helix	trans	-56.6	-41.6	179.2	170.6	0	0	0	0	112.5	L112 N118 F120 I138 A146 L150	L112-V116 WeakPolarHBondContact O-CG2 3.34Å; L112-V116 PolarHBondContact O-N 3.34Å; V116-N118 VanDerWaalsContact C-N 3.3Å; V116-N118 PolarHBondContact O-N 2.95Å; V116-F120 HydrophobicContact CG1-CD2 4.46Å; V116-F120 WeakPolarHBondContact O-CD2 3.37Å; V116-F120 PolarHBondContact O-N 2.82Å; V116-I138 HydrophobicContact CG2-CD1 4.3Å; V116-A146 HydrophobicContact CG2-CB 4.16Å; V116-L150 HydrophobicContact CB-CD2 4.39Å; V116-L150 HydrophobicContact CG1-CD2 3.56Å; V116-L150 HydrophobicContact CG1-CG 3.97Å; V116-L150 HydrophobicContact CG2-CD1 4.29Å; V116-L150 HydrophobicContact CG2-CD2 4Å; V116-L150 HydrophobicContact CG2-CG 3.99Å
117	R	78.4	Confident	81.7	Confident	204 Å²	204	88.2 Å²	88.2	77%	0.77	42%	0.417	S	S	*	.	H	α-helix	trans	-65.2	-32.4	177.4	-176.8	178.7	-66.2	-173.4	-1.4	113.2	R113 R114 L115	R113-R117 VanDerWaalsContact O-CB 3.31Å; R113-R117 WeakPolarHBondContact O-CB 3.35Å; R113-R117 PolarHBondContact O-N 2.64Å; R114-R117 PolarHBondContact O-N 3.42Å; L115-R117 VanDerWaalsContact C-N 3.32Å; L115-R117 PolarHBondContact O-N 2.84Å
118	N	82.2	Confident	82.9	Confident	120 Å²	120	87.7 Å²	87.7	64%	0.642	41%	0.414	S	S	*	.	H	α-helix	trans	-89.3	-29.1	-176.6	-67.1	1.3	0	0	0	112.4	R114 L115 V116	R114-N118 WeakPolarHBondContact O-CB 3.42Å; R114-N118 PolarHBondContact O-N 3.28Å; R114-N118 PolarHBondContact O-OD1 3.12Å; L115-N118 PolarHBondContact O-N 2.57Å; V116-N118 VanDerWaalsContact C-N 3.3Å; V116-N118 PolarHBondContact O-N 2.95Å
119	S	84.6	Confident	83.8	Confident	4 Å²	4	85.3 Å²	85.3	3%	0.028	40%	0.398	C	S	.	.	H	α-helix	trans	-80.4	-16	-178.9	-55.9	0	0	0	0	114.3	L115 I134 D135	L115-S119 WeakPolarHBondContact O-CB 3.48Å; L115-S119 PolarHBondContact O-N 3.05Å; L115-S119 PolarHBondContact O-OG 2.89Å; S119-I134 CarbonylContact O-C 3.58Å; S119-I134 WeakPolarHBondContact O-CA 3.15Å; S119-D135 PolarHBondContact O-N 3.37Å
120	F	89.3	Confident	85	Confident	42 Å²	42	77.4 Å²	77.4	18%	0.184	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	131.2	-174.3	-64.5	-87.4	0	0	0	113.2	V116 L132 R133 I134 I138 L150 V154	V116-F120 HydrophobicContact CG1-CD2 4.46Å; V116-F120 WeakPolarHBondContact O-CD2 3.37Å; V116-F120 PolarHBondContact O-N 2.82Å; F120-L132 HydrophobicContact CD1-CD1 4.13Å; F120-R133 WeakPolarHBondContact CA-O 3.39Å; F120-I134 HydrophobicContact CD1-CB 4.42Å; F120-I134 HydrophobicContact CD1-CD1 4.44Å; F120-I134 HydrophobicContact CD1-CG1 3.87Å; F120-I134 HydrophobicContact CD1-CG2 4.2Å; F120-I134 HydrophobicContact CE1-CB 4.28Å; F120-I134 HydrophobicContact CE1-CD1 3.87Å; F120-I134 HydrophobicContact CE1-CG1 3.76Å; F120-I134 HydrophobicContact CE1-CG2 3.74Å; F120-I134 HydrophobicContact CZ-CG2 4.18Å; F120-I138 HydrophobicContact CE2-CD1 3.8Å; F120-I138 HydrophobicContact CE2-CG1 4.38Å; F120-L150 HydrophobicContact CD2-CD2 3.88Å; F120-L150 HydrophobicContact CE2-CD2 3.48Å; F120-L150 VanDerWaalsContact CE2-CD2 3.48Å; F120-L150 HydrophobicContact CZ-CD2 3.97Å; F120-V154 HydrophobicContact CB-CG1 4.23Å; F120-V154 HydrophobicContact CB-CG2 4.13Å; F120-V154 HydrophobicContact CD1-CG1 3.99Å; F120-V154 HydrophobicContact CG-CG1 4.24Å; F120-V154 HydrophobicContact CG-CG2 4.39Å
121	K	91.9	Very high	85.9	Confident	109 Å²	109	74.4 Å²	74.4	47%	0.474	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	136.4	162.5	-177.3	-171.6	174.3	-161.3	0	109.7	D123 R133	K121-D123 IonicContact NZ-OD2 3.38Å; K121-R133 HydrophobicContact CB-CB 4.25Å; K121-R133 PolarHBondContact N-O 3.26Å; K121-R133 PolarHBondContact O-N 3.01Å
122	V	92.6	Very high	86.8	Confident	37 Å²	37	70.5 Å²	70.5	22%	0.224	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	140.2	179.4	177.6	0	0	0	0	110.4	Y131 L132 V154 K157 V158	V122-Y131 WeakPolarHBondContact CA-O 3.14Å; V122-L132 HydrophobicContact CG2-CD1 3.78Å; V122-V154 HydrophobicContact CG2-CB 4.23Å; V122-V154 HydrophobicContact CG2-CG1 3.59Å; V122-K157 HydrophobicContact CG1-CB 4.13Å; V122-K157 HydrophobicContact CG1-CD 4.19Å; V122-V158 HydrophobicContact CG1-CG1 3.79Å
123	D	94.2	Very high	87.9	Confident	69 Å²	69	72.2 Å²	72.2	37%	0.369	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	164.1	175.2	-132.5	-38.5	0	0	0	110.2	K121 Y131	K121-D123 IonicContact NZ-OD2 3.38Å; D123-Y131 HydrophobicContact CB-CD1 3.86Å; D123-Y131 HydrophobicContact CB-CG 4.4Å; D123-Y131 PolarHBondContact N-O 2.97Å; D123-Y131 PolarHBondContact O-N 3.03Å
124	I	93.9	Very high	88.8	Confident	89 Å²	89	66.8 Å²	66.8	46%	0.456	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	117.7	169.2	-57.4	179.1	0	0	0	107.9	T161	I124-T161 HydrophobicContact CD1-CG2 4.17Å; I124-T161 HydrophobicContact CG1-CG2 4.17Å; I124-T161 HydrophobicContact CG2-CG2 4.25Å
125	L	92.8	Very high	89.4	Confident	42 Å²	42	60.6 Å²	60.6	22%	0.22	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	177	-178.1	-46.5	177.5	0	0	0	110.7	N128 T129 I165	L125-N128 PolarHBondContact O-N 2.79Å; L125-T129 PolarHBondContact N-O 2.71Å; L125-T129 PolarHBondContact O-N 2.89Å; L125-I165 HydrophobicContact CD1-CD1 4.23Å
126	E	85.9	Confident	90	Very high	131 Å²	131	62.5 Å²	62.5	61%	0.612	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-49.7	156.4	175.5	-64.6	137.8	169.4	0	0	113.1	N128 T129 K314	E126-N128 PolarHBondContact O-N 3.07Å; E126-T129 WeakPolarHBondContact O-CB 3.18Å; E126-T129 PolarHBondContact O-N 3.41Å; E126-T129 PolarHBondContact O-OG1 3.04Å; E126-K314 IonicContact OE2-NZ 2.7Å; E126-K314 PolarHBondContact OE2-NZ 2.77Å
127	N	84.4	Confident	90.7	Very high	142 Å²	142	61.9 Å²	61.9	76%	0.759	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	56	28.3	-176.4	-57.9	-13.1	0	0	0	114	T129	N127-T129 VanDerWaalsContact C-N 3.31Å; N127-T129 PolarHBondContact O-N 3.01Å
128	N	92.3	Very high	91.2	Very high	73 Å²	73	52.7 Å²	52.7	39%	0.39	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	57.1	43	-177	-174	41.6	0	0	0	111.9	L125 E126 T161 S162	L125-N128 PolarHBondContact O-N 2.79Å; E126-N128 PolarHBondContact O-N 3.07Å; N128-T161 CarbonylContact O-C 3.47Å; N128-T161 VanDerWaalsContact O-CB 3.29Å; N128-T161 WeakPolarHBondContact O-CB 3.47Å; N128-S162 PolarHBondContact ND2-N 3.47Å; N128-S162 VanDerWaalsContact ND2-N 3.17Å; N128-S162 PolarHBondContact ND2-OG 2.99Å; N128-S162 PolarHBondContact O-N 3.34Å
129	T	94	Very high	91.5	Very high	10 Å²	10	49 Å²	49	6%	0.061	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	114.5	178.2	-56	0	0	0	0	109.7	L125 E126 N127 S163 I165 L317	L125-T129 PolarHBondContact N-O 2.71Å; L125-T129 PolarHBondContact O-N 2.89Å; E126-T129 WeakPolarHBondContact O-CB 3.18Å; E126-T129 PolarHBondContact O-N 3.41Å; E126-T129 PolarHBondContact O-OG1 3.04Å; N127-T129 VanDerWaalsContact C-N 3.31Å; N127-T129 PolarHBondContact O-N 3.01Å; T129-S163 CarbonylContact C-O 3.55Å; T129-S163 WeakPolarHBondContact CA-O 3.37Å; T129-S163 PolarHBondContact OG1-OG 3.27Å; T129-I165 HydrophobicContact CG2-CD1 4.09Å; T129-I165 HydrophobicContact CG2-CG1 4.08Å; T129-L317 HydrophobicContact CG2-CD1 3.61Å
130	G	95.8	Very high	91.6	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	144.8	173.6	0	0	0	0	0	111.9	T161 S163 L164 I165	G130-T161 PolarHBondContact N-OG1 3.24Å; G130-S163 PolarHBondContact N-O 3.42Å; G130-L164 WeakPolarHBondContact O-CA 3.09Å; G130-I165 PolarHBondContact O-N 3.29Å
131	Y	96.6	Very high	91.3	Very high	23 Å²	23	56.5 Å²	56.5	9%	0.09	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	120.1	168.9	172.6	-92.1	0	0	0	109.2	V122 D123 R133 I165 D167	V122-Y131 WeakPolarHBondContact CA-O 3.14Å; D123-Y131 HydrophobicContact CB-CD1 3.86Å; D123-Y131 HydrophobicContact CB-CG 4.4Å; D123-Y131 PolarHBondContact N-O 2.97Å; D123-Y131 PolarHBondContact O-N 3.03Å; Y131-R133 HydrophobicContact CE1-CB 3.96Å; Y131-I165 WeakPolarHBondContact CA-O 3.19Å; Y131-I165 HydrophobicContact CD2-CB 4.21Å; Y131-I165 HydrophobicContact CD2-CG2 3.93Å; Y131-I165 HydrophobicContact CE2-CG2 4.36Å; Y131-D167 HydrophobicContact CE2-CB 3.73Å; Y131-D167 PolarHBondContact OH-OD2 2.87Å
132	L	95.6	Very high	90.9	Very high	7 Å²	7	52.2 Å²	52.2	4%	0.037	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	110	179.2	175.8	61.3	0	0	0	108.6	F120 V122 I134 V154 W155 V158 L164 I165 L166 D167	F120-L132 HydrophobicContact CD1-CD1 4.13Å; V122-L132 HydrophobicContact CG2-CD1 3.78Å; L132-I134 HydrophobicContact CD1-CG1 4.46Å; L132-I134 HydrophobicContact CD2-CD1 4.3Å; L132-I134 HydrophobicContact CD2-CG1 4.5Å; L132-I134 HydrophobicContact CG-CD1 4.43Å; L132-I134 HydrophobicContact CG-CG1 4.1Å; L132-V154 HydrophobicContact CD1-CG1 3.58Å; L132-W155 HydrophobicContact CD2-CE3 4.41Å; L132-W155 HydrophobicContact CD2-CZ3 4.25Å; L132-V158 HydrophobicContact CB-CG1 4.5Å; L132-V158 HydrophobicContact CD2-CG2 4.46Å; L132-L164 HydrophobicContact CB-CD1 4Å; L132-I165 PolarHBondContact N-O 3.17Å; L132-L166 HydrophobicContact CB-CD1 4.38Å; L132-L166 HydrophobicContact CD2-CD1 4.06Å; L132-L166 HydrophobicContact CG-CD1 4.08Å; L132-L166 CarbonylContact O-C 3.53Å; L132-L166 WeakPolarHBondContact O-CA 3.45Å; L132-D167 PolarHBondContact O-N 2.93Å
133	R	94.9	Very high	90.4	Very high	56 Å²	56	51.3 Å²	51.3	21%	0.211	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	131.6	172	175.1	173.6	153.4	177.5	-8.3	109.7	F120 K121 Y131 D135 D167 Y170	F120-R133 WeakPolarHBondContact CA-O 3.39Å; K121-R133 HydrophobicContact CB-CB 4.25Å; K121-R133 PolarHBondContact N-O 3.26Å; K121-R133 PolarHBondContact O-N 3.01Å; Y131-R133 HydrophobicContact CE1-CB 3.96Å; R133-D135 WeakPolarHBondContact CG-OD1 3.49Å; R133-D135 IonicContact CZ-OD1 3.42Å; R133-D135 IonicContact CZ-OD2 3.1Å; R133-D135 IonicContact NE-OD1 3.15Å; R133-D135 PolarHBondContact NE-OD1 3.46Å; R133-D135 IonicContact NE-OD2 2.82Å; R133-D135 PolarHBondContact NE-OD2 2.87Å; R133-D135 IonicContact NH2-OD1 2.94Å; R133-D135 PolarHBondContact NH2-OD1 3.49Å; R133-D135 IonicContact NH2-OD2 3.18Å; R133-D135 PolarHBondContact NH2-OD2 3.3Å; R133-D167 WeakPolarHBondContact CA-O 3.42Å; R133-D167 HydrophobicContact CB-CB 3.92Å; R133-D167 HydrophobicContact CG-CB 4.2Å; R133-Y170 VanDerWaalsContact CZ-CD2 3.41Å; R133-Y170 VanDerWaalsContact CZ-CG 3.4Å
134	I	93.9	Very high	89.7	Confident	6 Å²	6	51.9 Å²	51.9	3%	0.031	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	111.1	178.3	-48.5	-177.5	0	0	0	108.8	S119 F120 L132 Q136 I137 L166 D167 L168 N171 I182	S119-I134 CarbonylContact O-C 3.58Å; S119-I134 WeakPolarHBondContact O-CA 3.15Å; F120-I134 HydrophobicContact CD1-CB 4.42Å; F120-I134 HydrophobicContact CD1-CD1 4.44Å; F120-I134 HydrophobicContact CD1-CG1 3.87Å; F120-I134 HydrophobicContact CD1-CG2 4.2Å; F120-I134 HydrophobicContact CE1-CB 4.28Å; F120-I134 HydrophobicContact CE1-CD1 3.87Å; F120-I134 HydrophobicContact CE1-CG1 3.76Å; F120-I134 HydrophobicContact CE1-CG2 3.74Å; F120-I134 HydrophobicContact CZ-CG2 4.18Å; L132-I134 HydrophobicContact CD1-CG1 4.46Å; L132-I134 HydrophobicContact CD2-CD1 4.3Å; L132-I134 HydrophobicContact CD2-CG1 4.5Å; L132-I134 HydrophobicContact CG-CD1 4.43Å; L132-I134 HydrophobicContact CG-CG1 4.1Å; I134-Q136 WeakPolarHBondContact CG2-O 3.47Å; I134-I137 HydrophobicContact CG2-CD1 4.01Å; I134-L166 HydrophobicContact CD1-CD1 3.65Å; I134-L166 HydrophobicContact CG1-CD1 3.93Å; I134-D167 PolarHBondContact N-O 3.45Å; I134-D167 VanDerWaalsContact N-O 3.07Å; I134-L168 HydrophobicContact CB-CD2 3.98Å; I134-L168 HydrophobicContact CG1-CD2 4.46Å; I134-N171 WeakPolarHBondContact O-CB 3.38Å; I134-N171 PolarHBondContact O-ND2 3.33Å; I134-I182 HydrophobicContact CD1-CD1 4.34Å
135	D	90.9	Very high	89.1	Confident	48 Å²	48	53.6 Å²	53.6	26%	0.257	27%	0.274	S	S	.	.	S	Bend	trans	-90	-17.7	-176.9	-76.6	10.2	0	0	0	113.3	S119 R133 Y170 N171	S119-D135 PolarHBondContact O-N 3.37Å; R133-D135 WeakPolarHBondContact CG-OD1 3.49Å; R133-D135 IonicContact CZ-OD1 3.42Å; R133-D135 IonicContact CZ-OD2 3.1Å; R133-D135 IonicContact NE-OD1 3.15Å; R133-D135 PolarHBondContact NE-OD1 3.46Å; R133-D135 IonicContact NE-OD2 2.82Å; R133-D135 PolarHBondContact NE-OD2 2.87Å; R133-D135 IonicContact NH2-OD1 2.94Å; R133-D135 PolarHBondContact NH2-OD1 3.49Å; R133-D135 IonicContact NH2-OD2 3.18Å; R133-D135 PolarHBondContact NH2-OD2 3.3Å; D135-Y170 WeakPolarHBondContact OD1-CB 3.45Å; D135-N171 WeakPolarHBondContact O-CA 3.31Å
136	Q	89.8	Confident	88.1	Confident	86 Å²	86	52 Å²	52	40%	0.402	27%	0.267	S	S	.	.	S	Bend	trans	-148.1	134.5	174.1	-172.5	178.6	5.8	0	0	110.4	I134 I138 N171 G173	I134-Q136 WeakPolarHBondContact CG2-O 3.47Å; Q136-I138 PolarHBondContact O-N 3.3Å; Q136-N171 PolarHBondContact N-ND2 3.38Å; Q136-G173 WeakPolarHBondContact CA-O 3.46Å
137	I	91.3	Very high	87.3	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-79.9	115.6	171.6	-48.6	-55	0	0	0	108.9	I134 N171 G173 G174 E175 I182 A237 A238	I134-I137 HydrophobicContact CG2-CD1 4.01Å; I137-N171 WeakPolarHBondContact CD1-ND2 3.37Å; I137-G173 PolarHBondContact N-O 2.87Å; I137-G174 CarbonylContact O-C 3.54Å; I137-G174 WeakPolarHBondContact O-CA 3.42Å; I137-E175 PolarHBondContact O-N 3.05Å; I137-I182 HydrophobicContact CD1-CD1 3.81Å; I137-I182 HydrophobicContact CG2-CD1 4.01Å; I137-A237 HydrophobicContact CB-CB 3.83Å; I137-A237 HydrophobicContact CG1-CB 3.76Å; I137-A237 HydrophobicContact CG2-CB 4.08Å; I137-A238 HydrophobicContact CD1-CB 4.35Å; I137-A238 HydrophobicContact CG1-CB 4.32Å
138	I	88.8	Confident	86.6	Confident	12 Å²	12	43.1 Å²	43.1	6%	0.062	23%	0.232	C	C	.	.			trans	-85.6	142.1	-179.5	-55.3	-174.2	0	0	0	110	L115 V116 F120 Q136 T142 V143 G178	L115-I138 HydrophobicContact CD2-CD1 4.18Å; L115-I138 HydrophobicContact CG-CD1 4.07Å; V116-I138 HydrophobicContact CG2-CD1 4.3Å; F120-I138 HydrophobicContact CE2-CD1 3.8Å; F120-I138 HydrophobicContact CE2-CG1 4.38Å; Q136-I138 PolarHBondContact O-N 3.3Å; I138-T142 HydrophobicContact CG2-CG2 3.43Å; I138-T142 VanDerWaalsContact CG2-CG2 3.43Å; I138-V143 HydrophobicContact CB-CG2 3.97Å; I138-V143 HydrophobicContact CG2-CG2 3.88Å; I138-G178 VanDerWaalsContact O-CA 3.23Å; I138-G178 WeakPolarHBondContact O-CA 3.33Å
139	D	87.4	Confident	85.6	Confident	42 Å²	42	43 Å²	43	23%	0.225	23%	0.229	C	C	.	.			trans	-66.2	158.1	179.4	74	88	0	0	0	113.9	E141 T142 V143 E175 S177	D139-E141 VanDerWaalsContact C-N 3.32Å; D139-E141 PolarHBondContact O-N 3.31Å; D139-E141 WeakPolarHBondContact OD1-CA 3.48Å; D139-E141 WeakPolarHBondContact OD1-CB 3.1Å; D139-E141 PolarHBondContact OD1-N 2.92Å; D139-T142 VanDerWaalsContact CG-OG1 3.32Å; D139-T142 PolarHBondContact O-N 2.95Å; D139-T142 PolarHBondContact OD1-N 3.45Å; D139-T142 PolarHBondContact OD1-OG1 3.3Å; D139-T142 WeakPolarHBondContact OD2-CB 3.3Å; D139-T142 PolarHBondContact OD2-OG1 3.32Å; D139-V143 WeakPolarHBondContact O-CB 3.13Å; D139-V143 VanDerWaalsContact O-CG2 3.3Å; D139-V143 WeakPolarHBondContact O-CG2 3.36Å; D139-V143 PolarHBondContact O-N 3.39Å; D139-E175 HydrophobicContact CB-CB 3.74Å; D139-E175 HydrophobicContact CB-CG 3.98Å; D139-S177 WeakPolarHBondContact CA-OG 3.43Å; D139-S177 WeakPolarHBondContact CB-OG 3.27Å
140	Q	86.3	Confident	84.7	Confident	80 Å²	80	42.9 Å²	42.9	37%	0.374	23%	0.228	S	C	.	.	H	α-helix	trans	-60.4	-34.4	-176.4	-165.4	177.3	7.2	0	0	114.2	A144 S177 V181	Q140-A144 WeakPolarHBondContact O-CB 3.47Å; Q140-A144 PolarHBondContact O-N 2.95Å; Q140-S177 PolarHBondContact N-OG 2.95Å; Q140-V181 HydrophobicContact CG-CG2 4.13Å
141	E	84.7	Confident	83.9	Confident	123 Å²	123	44.4 Å²	44.4	58%	0.575	23%	0.234	S	C	*	.	H	α-helix	trans	-78.1	-41.1	-176.1	-158.8	-164.1	160.2	0	0	111	D139 A144 K145	D139-E141 VanDerWaalsContact C-N 3.32Å; D139-E141 PolarHBondContact O-N 3.31Å; D139-E141 WeakPolarHBondContact OD1-CA 3.48Å; D139-E141 WeakPolarHBondContact OD1-CB 3.1Å; D139-E141 PolarHBondContact OD1-N 2.92Å; E141-A144 PolarHBondContact O-N 3.1Å; E141-K145 VanDerWaalsContact O-CG 3.31Å; E141-K145 WeakPolarHBondContact O-CG 3.43Å; E141-K145 PolarHBondContact O-N 2.98Å; E141-K145 WeakPolarHBondContact OE1-CE 3.23Å; E141-K145 IonicContact OE1-NZ 2.63Å; E141-K145 PolarHBondContact OE1-NZ 2.94Å; E141-K145 IonicContact OE2-NZ 2.72Å
142	T	82.5	Confident	83	Confident	20 Å²	20	48 Å²	48	12%	0.123	26%	0.255	C	S	.	.	H	α-helix	trans	-64.2	-41	171.3	-62.7	0	0	0	0	111.2	L112 L115 I138 D139 K145 A146	L112-T142 HydrophobicContact CD2-CG2 3.66Å; L115-T142 HydrophobicContact CD2-CG2 4.19Å; I138-T142 HydrophobicContact CG2-CG2 3.43Å; I138-T142 VanDerWaalsContact CG2-CG2 3.43Å; D139-T142 VanDerWaalsContact CG-OG1 3.32Å; D139-T142 PolarHBondContact O-N 2.95Å; D139-T142 PolarHBondContact OD1-N 3.45Å; D139-T142 PolarHBondContact OD1-OG1 3.3Å; D139-T142 WeakPolarHBondContact OD2-CB 3.3Å; D139-T142 PolarHBondContact OD2-OG1 3.32Å; T142-K145 PolarHBondContact O-N 3.17Å; T142-A146 VanDerWaalsContact O-CB 3.27Å; T142-A146 WeakPolarHBondContact O-CB 3.41Å; T142-A146 PolarHBondContact O-N 3.04Å
143	V	81.9	Confident	82.2	Confident	18 Å²	18	52.2 Å²	52.2	11%	0.109	28%	0.277	C	S	.	.	H	α-helix	trans	-63.1	-41.2	173	171.5	0	0	0	0	111.3	I138 D139 K145 A146 G147 L150 W151 V181	I138-V143 HydrophobicContact CB-CG2 3.97Å; I138-V143 HydrophobicContact CG2-CG2 3.88Å; D139-V143 WeakPolarHBondContact O-CB 3.13Å; D139-V143 VanDerWaalsContact O-CG2 3.3Å; D139-V143 WeakPolarHBondContact O-CG2 3.36Å; D139-V143 PolarHBondContact O-N 3.39Å; V143-K145 PolarHBondContact O-N 2.97Å; V143-A146 PolarHBondContact O-N 3.21Å; V143-G147 WeakPolarHBondContact O-CA 3.34Å; V143-G147 PolarHBondContact O-N 3.2Å; V143-L150 HydrophobicContact CB-CD1 4.43Å; V143-L150 HydrophobicContact CG1-CD1 4.14Å; V143-L150 HydrophobicContact CG2-CD1 4.17Å; V143-W151 HydrophobicContact CG1-CZ2 4.05Å; V143-V181 HydrophobicContact CG1-CG1 4.23Å
144	A	80.9	Confident	81.8	Confident	81 Å²	81	50.3 Å²	50.3	67%	0.669	27%	0.272	S	S	*	.	H	α-helix	trans	-61.2	-42.5	174.7	0	0	0	0	0	112.1	Q140 E141	Q140-A144 WeakPolarHBondContact O-CB 3.47Å; Q140-A144 PolarHBondContact O-N 2.95Å; E141-A144 PolarHBondContact O-N 3.1Å
145	K	79.4	Confident	81.6	Confident	124 Å²	124	50.7 Å²	50.7	54%	0.539	27%	0.272	S	S	.	.	H	α-helix	trans	-71.2	-30.6	178.3	-69.8	165.8	-174.4	167.9	0	114	E141 T142 V143	E141-K145 VanDerWaalsContact O-CG 3.31Å; E141-K145 WeakPolarHBondContact O-CG 3.43Å; E141-K145 PolarHBondContact O-N 2.98Å; E141-K145 WeakPolarHBondContact OE1-CE 3.23Å; E141-K145 IonicContact OE1-NZ 2.63Å; E141-K145 PolarHBondContact OE1-NZ 2.94Å; E141-K145 IonicContact OE2-NZ 2.72Å; T142-K145 PolarHBondContact O-N 3.17Å; V143-K145 PolarHBondContact O-N 2.97Å
146	A	73.1	Confident	81.4	Confident	8 Å²	8	51.2 Å²	51.2	7%	0.066	28%	0.275	C	S	.	.	H	α-helix	trans	-97.7	-1.7	-179.7	0	0	0	0	0	113.9	V116 T142 V143 S148 Q149 L150	V116-A146 HydrophobicContact CG2-CB 4.16Å; T142-A146 VanDerWaalsContact O-CB 3.27Å; T142-A146 WeakPolarHBondContact O-CB 3.41Å; T142-A146 PolarHBondContact O-N 3.04Å; V143-A146 PolarHBondContact O-N 3.21Å; A146-S148 PolarHBondContact O-N 2.86Å; A146-Q149 PolarHBondContact O-N 3.07Å; A146-Q149 VanDerWaalsContact O-N 3.1Å; A146-L150 HydrophobicContact CB-CD1 4.17Å; A146-L150 PolarHBondContact O-N 2.9Å
147	G	67.8	Low	81.3	Confident	9 Å²	9	52.2 Å²	52.2	9%	0.093	28%	0.278	C	S	.	.	H	α-helix	trans	-45.7	-62.4	-158.9	0	0	0	0	0	115.9	V143 Q149 L150 W151	V143-G147 WeakPolarHBondContact O-CA 3.34Å; V143-G147 PolarHBondContact O-N 3.2Å; G147-Q149 PolarHBondContact O-N 3.38Å; G147-Q149 VanDerWaalsContact O-N 3.11Å; G147-L150 WeakPolarHBondContact O-CA 3.3Å; G147-L150 WeakPolarHBondContact O-CB 3.33Å; G147-L150 PolarHBondContact O-N 3.34Å; G147-W151 PolarHBondContact O-N 2.76Å; G147-W151 PolarHBondContact O-NE1 2.96Å
148	S	71.4	Confident	81.3	Confident	78 Å²	78	52.1 Å²	52.1	55%	0.545	28%	0.278	S	S	.	.	H	α-helix	trans	-53.4	-38.5	-176	51.2	0	0	0	0	113.3	A146 L150 W151 D152	A146-S148 PolarHBondContact O-N 2.86Å; S148-L150 VanDerWaalsContact C-N 3.35Å; S148-L150 PolarHBondContact O-N 2.74Å; S148-W151 PolarHBondContact O-N 3.22Å; S148-D152 WeakPolarHBondContact O-CB 3.41Å; S148-D152 VanDerWaalsContact O-CG 3.27Å; S148-D152 PolarHBondContact O-N 3.18Å
149	Q	70.8	Confident	81.3	Confident	70 Å²	70	52 Å²	52	33%	0.327	28%	0.279	S	S	.	.	H	α-helix	trans	-69.8	-31.3	179.3	-64	175.2	30.9	0	0	112.5	A146 G147 N153	A146-Q149 PolarHBondContact O-N 3.07Å; A146-Q149 VanDerWaalsContact O-N 3.1Å; G147-Q149 PolarHBondContact O-N 3.38Å; G147-Q149 VanDerWaalsContact O-N 3.11Å; Q149-N153 VanDerWaalsContact O-CB 3.31Å; Q149-N153 WeakPolarHBondContact O-CB 3.28Å; Q149-N153 PolarHBondContact O-N 3.03Å; Q149-N153 PolarHBondContact O-ND2 3.21Å
150	L	75.9	Confident	81.4	Confident	9 Å²	9	57.7 Å²	57.7	5%	0.047	30%	0.304	C	S	.	.	H	α-helix	trans	-69.3	-47.9	169.6	-78	158.9	0	0	0	111.1	V116 F120 V143 A146 G147 S148 V154 W155	V116-L150 HydrophobicContact CB-CD2 4.39Å; V116-L150 HydrophobicContact CG1-CD2 3.56Å; V116-L150 HydrophobicContact CG1-CG 3.97Å; V116-L150 HydrophobicContact CG2-CD1 4.29Å; V116-L150 HydrophobicContact CG2-CD2 4Å; V116-L150 HydrophobicContact CG2-CG 3.99Å; F120-L150 HydrophobicContact CD2-CD2 3.88Å; F120-L150 HydrophobicContact CE2-CD2 3.48Å; F120-L150 VanDerWaalsContact CE2-CD2 3.48Å; F120-L150 HydrophobicContact CZ-CD2 3.97Å; V143-L150 HydrophobicContact CB-CD1 4.43Å; V143-L150 HydrophobicContact CG1-CD1 4.14Å; V143-L150 HydrophobicContact CG2-CD1 4.17Å; A146-L150 HydrophobicContact CB-CD1 4.17Å; A146-L150 PolarHBondContact O-N 2.9Å; G147-L150 WeakPolarHBondContact O-CA 3.3Å; G147-L150 WeakPolarHBondContact O-CB 3.33Å; G147-L150 PolarHBondContact O-N 3.34Å; S148-L150 VanDerWaalsContact C-N 3.35Å; S148-L150 PolarHBondContact O-N 2.74Å; L150-V154 HydrophobicContact CD2-CG2 4.48Å; L150-V154 WeakPolarHBondContact O-CA 3.25Å; L150-V154 VanDerWaalsContact O-CB 3.24Å; L150-V154 WeakPolarHBondContact O-CB 3.47Å; L150-V154 PolarHBondContact O-N 2.98Å; L150-W155 PolarHBondContact O-N 2.96Å; L150-W155 VanDerWaalsContact O-N 3.17Å
151	W	77.4	Confident	81.8	Confident	32 Å²	32	53.9 Å²	53.9	12%	0.121	29%	0.286	C	S	.	.	I	π-helix	trans	-64	-48.4	-176.4	-53.7	125.2	0	0	0	111.9	V143 G147 S148 W155 N156 V181 Y185 P216	V143-W151 HydrophobicContact CG1-CZ2 4.05Å; G147-W151 PolarHBondContact O-N 2.76Å; G147-W151 PolarHBondContact O-NE1 2.96Å; S148-W151 PolarHBondContact O-N 3.22Å; W151-W155 HydrophobicContact CE3-CB 3.55Å; W151-W155 AromaticContact CE3-CG 3.87Å; W151-W155 HydrophobicContact CE3-CG 3.87Å; W151-W155 HydrophobicContact CZ3-CB 3.92Å; W151-W155 HydrophobicContact CZ3-CG 4.04Å; W151-W155 PolarHBondContact O-N 3.03Å; W151-N156 VanDerWaalsContact O-CB 3.26Å; W151-N156 WeakPolarHBondContact O-CB 2.94Å; W151-N156 PolarHBondContact O-N 3.19Å; W151-N156 PolarHBondContact O-ND2 3.04Å; W151-V181 HydrophobicContact CH2-CG1 4.24Å; W151-Y185 HydrophobicContact CE3-CE1 4.29Å; W151-Y185 HydrophobicContact CE3-CE2 4.47Å; W151-Y185 AromaticContact CE3-CZ 3.86Å; W151-Y185 HydrophobicContact CH2-CD2 4.32Å; W151-Y185 HydrophobicContact CH2-CE1 4.48Å; W151-Y185 AromaticContact CH2-CE2 3.3Å; W151-Y185 HydrophobicContact CH2-CE2 3.3Å; W151-Y185 AromaticContact CH2-CZ 3.41Å; W151-Y185 VanDerWaalsContact CH2-CZ 3.41Å; W151-Y185 WeakPolarHBondContact CH2-OH 3.21Å; W151-Y185 HydrophobicContact CZ2-CE2 4.2Å; W151-Y185 WeakPolarHBondContact CZ2-OH 3.3Å; W151-Y185 HydrophobicContact CZ3-CD2 4.26Å; W151-Y185 AromaticContact CZ3-CE1 3.92Å; W151-Y185 HydrophobicContact CZ3-CE1 3.92Å; W151-Y185 AromaticContact CZ3-CE2 3.44Å; W151-Y185 HydrophobicContact CZ3-CE2 3.44Å; W151-Y185 VanDerWaalsContact CZ3-CE2 3.44Å; W151-Y185 AromaticContact CZ3-CZ 3.24Å; W151-Y185 VanDerWaalsContact CZ3-OH 3.22Å; W151-Y185 WeakPolarHBondContact CZ3-OH 3.17Å; W151-P216 HydrophobicContact CD2-CB 4.32Å; W151-P216 HydrophobicContact CG-CB 4.11Å
152	D	77.7	Confident	82.1	Confident	99 Å²	99	51.2 Å²	51.2	53%	0.529	28%	0.281	S	S	.	.	I	π-helix	trans	-71.9	-39.9	-175.8	-62.8	-29.9	0	0	0	113.2	S148 N156	S148-D152 WeakPolarHBondContact O-CB 3.41Å; S148-D152 VanDerWaalsContact O-CG 3.27Å; S148-D152 PolarHBondContact O-N 3.18Å; D152-N156 PolarHBondContact OD1-ND2 2.7Å
153	N	79.3	Confident	82.7	Confident	95 Å²	95	50.9 Å²	50.9	51%	0.508	28%	0.28	S	S	.	.	I	π-helix	trans	-94.5	-24.9	-172.1	-61.6	-83.7	0	0	0	114.1	Q149 K157	Q149-N153 VanDerWaalsContact O-CB 3.31Å; Q149-N153 WeakPolarHBondContact O-CB 3.28Å; Q149-N153 PolarHBondContact O-N 3.03Å; Q149-N153 PolarHBondContact O-ND2 3.21Å; N153-K157 WeakPolarHBondContact O-CD 3.07Å; N153-K157 VanDerWaalsContact O-CE 3.26Å; N153-K157 WeakPolarHBondContact O-CE 3.31Å; N153-K157 PolarHBondContact O-NZ 3.19Å
154	V	86.3	Confident	83.3	Confident	16 Å²	16	50 Å²	50	10%	0.097	27%	0.274	C	S	.	.	I	π-helix	trans	-112.3	-66.2	-175.6	-176.6	0	0	0	0	110.5	F120 V122 L132 L150	F120-V154 HydrophobicContact CB-CG1 4.23Å; F120-V154 HydrophobicContact CB-CG2 4.13Å; F120-V154 HydrophobicContact CD1-CG1 3.99Å; F120-V154 HydrophobicContact CG-CG1 4.24Å; F120-V154 HydrophobicContact CG-CG2 4.39Å; V122-V154 HydrophobicContact CG2-CB 4.23Å; V122-V154 HydrophobicContact CG2-CG1 3.59Å; L132-V154 HydrophobicContact CD1-CG1 3.58Å; L150-V154 HydrophobicContact CD2-CG2 4.48Å; L150-V154 WeakPolarHBondContact O-CA 3.25Å; L150-V154 VanDerWaalsContact O-CB 3.24Å; L150-V154 WeakPolarHBondContact O-CB 3.47Å; L150-V154 PolarHBondContact O-N 2.98Å
155	W	89.5	Confident	84.1	Confident	13 Å²	13	46.1 Å²	46.1	5%	0.049	24%	0.242	C	C	.	.	I	π-helix	trans	-73.1	-46.4	-166	-174.5	-108.7	0	0	0	114.1	L132 L150 W151 K157 V158 A159 Y185 F186 K218 Y220	L132-W155 HydrophobicContact CD2-CE3 4.41Å; L132-W155 HydrophobicContact CD2-CZ3 4.25Å; L150-W155 PolarHBondContact O-N 2.96Å; L150-W155 VanDerWaalsContact O-N 3.17Å; W151-W155 HydrophobicContact CE3-CB 3.55Å; W151-W155 AromaticContact CE3-CG 3.87Å; W151-W155 HydrophobicContact CE3-CG 3.87Å; W151-W155 HydrophobicContact CZ3-CB 3.92Å; W151-W155 HydrophobicContact CZ3-CG 4.04Å; W151-W155 PolarHBondContact O-N 3.03Å; W155-K157 PolarHBondContact O-N 3.35Å; W155-V158 HydrophobicContact CD2-CG2 4.37Å; W155-V158 HydrophobicContact CE3-CG2 3.81Å; W155-V158 HydrophobicContact CZ3-CG2 4.05Å; W155-V158 WeakPolarHBondContact O-CG2 3.43Å; W155-V158 PolarHBondContact O-N 3.38Å; W155-A159 HydrophobicContact CZ2-CB 4.46Å; W155-A159 WeakPolarHBondContact O-CB 3.44Å; W155-A159 PolarHBondContact O-N 3Å; W155-Y185 AromaticContact CD1-CE1 3.93Å; W155-Y185 HydrophobicContact CD2-CD1 4.07Å; W155-Y185 HydrophobicContact CD2-CG 4.42Å; W155-Y185 AromaticContact CE2-CD1 3.37Å; W155-Y185 AromaticContact CE2-CG 3.96Å; W155-Y185 HydrophobicContact CG-CD1 4.5Å; W155-Y185 HydrophobicContact CG-CE1 4.48Å; W155-Y185 HydrophobicContact CH2-CD1 4.37Å; W155-Y185 HydrophobicContact CH2-CG 4.24Å; W155-Y185 AromaticContact CZ2-CD1 3.57Å; W155-Y185 HydrophobicContact CZ2-CD1 3.57Å; W155-Y185 AromaticContact CZ2-CG 3.88Å; W155-Y185 HydrophobicContact CZ2-CG 3.88Å; W155-Y185 AromaticContact NE1-CD1 3.36Å; W155-Y185 AromaticContact NE1-CE1 3.6Å; W155-F186 HydrophobicContact CH2-CE1 4.04Å; W155-F186 AromaticContact CH2-CZ 3.97Å; W155-F186 HydrophobicContact CH2-CZ 3.97Å; W155-F186 HydrophobicContact CZ3-CZ 4.18Å; W155-K218 PolarHBondContact NE1-O 3.07Å; W155-Y220 HydrophobicContact CH2-CD2 4.36Å; W155-Y220 HydrophobicContact CH2-CG 4.38Å; W155-Y220 HydrophobicContact CZ2-CD2 4.36Å
156	N	87	Confident	84.9	Confident	59 Å²	59	40.3 Å²	40.3	32%	0.316	22%	0.217	S	C	.	.	H	α-helix	trans	-60.3	-23.3	-175	-76.3	-21.2	0	0	0	113.2	W151 D152	W151-N156 VanDerWaalsContact O-CB 3.26Å; W151-N156 WeakPolarHBondContact O-CB 2.94Å; W151-N156 PolarHBondContact O-N 3.19Å; W151-N156 PolarHBondContact O-ND2 3.04Å; D152-N156 PolarHBondContact OD1-ND2 2.7Å
157	K	87.9	Confident	86.1	Confident	107 Å²	107	39.9 Å²	39.9	47%	0.465	21%	0.214	S	C	.	.	H	α-helix	trans	-71	-46.9	173	-65	176.9	-177.1	160.8	0	112.5	V122 N153 W155	V122-K157 HydrophobicContact CG1-CB 4.13Å; V122-K157 HydrophobicContact CG1-CD 4.19Å; N153-K157 WeakPolarHBondContact O-CD 3.07Å; N153-K157 VanDerWaalsContact O-CE 3.26Å; N153-K157 WeakPolarHBondContact O-CE 3.31Å; N153-K157 PolarHBondContact O-NZ 3.19Å; W155-K157 PolarHBondContact O-N 3.35Å
158	V	91.8	Very high	87.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-83	-28.2	-178.5	-65.6	0	0	0	0	112.9	V122 L132 W155 Q160 T161 L164 Y220	V122-V158 HydrophobicContact CG1-CG1 3.79Å; L132-V158 HydrophobicContact CB-CG1 4.5Å; L132-V158 HydrophobicContact CD2-CG2 4.46Å; W155-V158 HydrophobicContact CD2-CG2 4.37Å; W155-V158 HydrophobicContact CE3-CG2 3.81Å; W155-V158 HydrophobicContact CZ3-CG2 4.05Å; W155-V158 WeakPolarHBondContact O-CG2 3.43Å; W155-V158 PolarHBondContact O-N 3.38Å; V158-Q160 PolarHBondContact O-N 2.7Å; V158-T161 WeakPolarHBondContact O-CB 3.34Å; V158-T161 PolarHBondContact O-N 3.36Å; V158-T161 PolarHBondContact O-OG1 3.39Å; V158-L164 HydrophobicContact CB-CD1 4.11Å; V158-L164 HydrophobicContact CG1-CD1 4.25Å; V158-Y220 WeakPolarHBondContact O-CE2 3.12Å
159	A	89.4	Confident	88.7	Confident	10 Å²	10	36.6 Å²	36.6	8%	0.083	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-28	-177.3	0	0	0	0	0	114.1	W155 K224	W155-A159 HydrophobicContact CZ2-CB 4.46Å; W155-A159 WeakPolarHBondContact O-CB 3.44Å; W155-A159 PolarHBondContact O-N 3Å; A159-K224 PolarHBondContact O-NZ 2.55Å
160	Q	88.7	Confident	89.8	Confident	160 Å²	160	37.2 Å²	37.2	75%	0.748	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-19.9	-179.5	-55.5	-167.9	18.7	0	0	113.8	V158 K224	V158-Q160 PolarHBondContact O-N 2.7Å; Q160-K224 PolarHBondContact O-NZ 2.78Å
161	T	94.3	Very high	90.6	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.006	18%	0.184	C	C	.	.	S	Bend	trans	-61.7	155.3	-176.5	62.2	0	0	0	0	113.4	I124 N128 G130 V158 S163 Y220 K224	I124-T161 HydrophobicContact CD1-CG2 4.17Å; I124-T161 HydrophobicContact CG1-CG2 4.17Å; I124-T161 HydrophobicContact CG2-CG2 4.25Å; N128-T161 CarbonylContact O-C 3.47Å; N128-T161 VanDerWaalsContact O-CB 3.29Å; N128-T161 WeakPolarHBondContact O-CB 3.47Å; G130-T161 PolarHBondContact N-OG1 3.24Å; V158-T161 WeakPolarHBondContact O-CB 3.34Å; V158-T161 PolarHBondContact O-N 3.36Å; V158-T161 PolarHBondContact O-OG1 3.39Å; T161-S163 PolarHBondContact OG1-O 2.7Å; T161-Y220 PolarHBondContact O-OH 3.27Å; T161-Y220 PolarHBondContact OG1-OH 3.19Å; T161-K224 WeakPolarHBondContact O-CD 3.42Å; T161-K224 VanDerWaalsContact O-CE 3.29Å; T161-K224 WeakPolarHBondContact O-CE 3.36Å; T161-K224 PolarHBondContact O-NZ 2.88Å
162	S	91.4	Very high	91	Very high	66 Å²	66	39.3 Å²	39.3	46%	0.462	20%	0.204	S	C	.	.	S	Bend	trans	-72.7	-38.1	-175.4	-59.7	0	0	0	0	112.4	N128	N128-S162 PolarHBondContact ND2-N 3.47Å; N128-S162 VanDerWaalsContact ND2-N 3.17Å; N128-S162 PolarHBondContact ND2-OG 2.99Å; N128-S162 PolarHBondContact O-N 3.34Å
163	S	94.1	Very high	90.9	Very high	13 Å²	13	35.8 Å²	35.8	9%	0.091	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	156.5	-177.6	54.6	0	0	0	0	109.1	T129 G130 T161 Y220 D225	T129-S163 CarbonylContact C-O 3.55Å; T129-S163 WeakPolarHBondContact CA-O 3.37Å; T129-S163 PolarHBondContact OG1-OG 3.27Å; G130-S163 PolarHBondContact N-O 3.42Å; T161-S163 PolarHBondContact OG1-O 2.7Å; S163-Y220 WeakPolarHBondContact CA-OH 3.31Å; S163-Y220 PolarHBondContact N-OH 2.93Å; S163-Y220 PolarHBondContact O-OH 2.7Å; S163-D225 CarbonylContact C-O 3.57Å; S163-D225 WeakPolarHBondContact CA-O 3.4Å
164	L	95.8	Very high	91.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	133.2	-175.3	179.9	66.1	0	0	0	112.4	G130 L132 V158 F186 Y220 D225 V226 I227	G130-L164 WeakPolarHBondContact O-CA 3.09Å; L132-L164 HydrophobicContact CB-CD1 4Å; V158-L164 HydrophobicContact CB-CD1 4.11Å; V158-L164 HydrophobicContact CG1-CD1 4.25Å; L164-F186 HydrophobicContact CD2-CE1 3.64Å; L164-F186 HydrophobicContact CD2-CZ 3.69Å; L164-Y220 HydrophobicContact CB-CE1 3.69Å; L164-Y220 HydrophobicContact CD2-CE1 4.45Å; L164-Y220 PolarHBondContact N-OH 2.84Å; L164-D225 PolarHBondContact N-O 3.07Å; L164-V226 HydrophobicContact CB-CG2 4.36Å; L164-V226 CarbonylContact O-C 3.58Å; L164-V226 WeakPolarHBondContact O-CA 3.45Å; L164-I227 PolarHBondContact O-N 2.95Å
165	I	97.2	Very high	91.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	110.7	165.2	-61.5	177.3	0	0	0	108.3	L125 T129 G130 Y131 L132 I227 L229 A313 L317	L125-I165 HydrophobicContact CD1-CD1 4.23Å; T129-I165 HydrophobicContact CG2-CD1 4.09Å; T129-I165 HydrophobicContact CG2-CG1 4.08Å; G130-I165 PolarHBondContact O-N 3.29Å; Y131-I165 WeakPolarHBondContact CA-O 3.19Å; Y131-I165 HydrophobicContact CD2-CB 4.21Å; Y131-I165 HydrophobicContact CD2-CG2 3.93Å; Y131-I165 HydrophobicContact CE2-CG2 4.36Å; L132-I165 PolarHBondContact N-O 3.17Å; I165-I227 CarbonylContact C-O 3.53Å; I165-I227 WeakPolarHBondContact CA-O 3.33Å; I165-L229 HydrophobicContact CG2-CD1 3.63Å; I165-L229 HydrophobicContact CG2-CD2 4.11Å; I165-L229 HydrophobicContact CG2-CG 3.73Å; I165-A313 HydrophobicContact CD1-CB 3.89Å; I165-A313 HydrophobicContact CG1-CB 4.34Å; I165-L317 HydrophobicContact CD1-CD1 4.25Å; I165-L317 HydrophobicContact CG1-CD1 4.14Å
166	L	97	Very high	91.2	Very high	1 Å²	1	38 Å²	38	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	101.7	176.5	178.7	60.9	0	0	0	109.8	L132 I134 L168 F186 I227 I228 L229 V241	L132-L166 HydrophobicContact CB-CD1 4.38Å; L132-L166 HydrophobicContact CD2-CD1 4.06Å; L132-L166 HydrophobicContact CG-CD1 4.08Å; L132-L166 CarbonylContact O-C 3.53Å; L132-L166 WeakPolarHBondContact O-CA 3.45Å; I134-L166 HydrophobicContact CD1-CD1 3.65Å; I134-L166 HydrophobicContact CG1-CD1 3.93Å; L166-L168 HydrophobicContact CD1-CD2 4.33Å; L166-L168 HydrophobicContact CG-CD2 4.26Å; L166-L168 HydrophobicContact CG-CG 4.3Å; L166-F186 HydrophobicContact CD2-CE2 4.37Å; L166-I227 PolarHBondContact N-O 2.98Å; L166-I228 HydrophobicContact CB-CG1 4.26Å; L166-I228 HydrophobicContact CD2-CD1 4.36Å; L166-I228 HydrophobicContact CD2-CG1 4.16Å; L166-I228 CarbonylContact O-C 3.48Å; L166-I228 VanDerWaalsContact O-CA 3.29Å; L166-I228 WeakPolarHBondContact O-CA 3.37Å; L166-L229 PolarHBondContact O-N 3.01Å; L166-V241 HydrophobicContact CD2-CG1 4.46Å
167	D	97.4	Very high	91.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	109.4	-174.5	-175.5	9.5	0	0	0	112.2	Y131 L132 R133 I134 R169 L229	Y131-D167 HydrophobicContact CE2-CB 3.73Å; Y131-D167 PolarHBondContact OH-OD2 2.87Å; L132-D167 PolarHBondContact O-N 2.93Å; R133-D167 WeakPolarHBondContact CA-O 3.42Å; R133-D167 HydrophobicContact CB-CB 3.92Å; R133-D167 HydrophobicContact CG-CB 4.2Å; I134-D167 PolarHBondContact N-O 3.45Å; I134-D167 VanDerWaalsContact N-O 3.07Å; D167-R169 VanDerWaalsContact OD1-CB 3.25Å; D167-R169 WeakPolarHBondContact OD1-CB 3.44Å; D167-R169 VanDerWaalsContact OD1-CG 3.24Å; D167-R169 WeakPolarHBondContact OD1-CG 3.24Å; D167-R169 IonicContact OD1-CZ 3.88Å; D167-R169 PolarHBondContact OD1-N 3.41Å; D167-R169 IonicContact OD1-NE 2.87Å; D167-R169 PolarHBondContact OD1-NE 3.1Å; D167-R169 IonicContact OD1-NH2 2.7Å; D167-R169 IonicContact OD2-CZ 3.22Å; D167-R169 IonicContact OD2-NE 2.86Å; D167-R169 PolarHBondContact OD2-NE 2.92Å; D167-R169 IonicContact OD2-NH2 2.7Å; D167-R169 PolarHBondContact OD2-NH2 3.09Å; D167-L229 HydrophobicContact CB-CB 4.48Å; D167-L229 HydrophobicContact CB-CD1 4.22Å
168	L	97.1	Very high	91.5	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	18%	0.177	C	C	.	.			trans	-110.3	9.1	177.1	-54.3	-179.5	0	0	0	112.2	I134 L166 Y170 N171 I228 L229 T234 A238 V241 A242	I134-L168 HydrophobicContact CB-CD2 3.98Å; I134-L168 HydrophobicContact CG1-CD2 4.46Å; L166-L168 HydrophobicContact CD1-CD2 4.33Å; L166-L168 HydrophobicContact CG-CD2 4.26Å; L166-L168 HydrophobicContact CG-CG 4.3Å; L168-Y170 PolarHBondContact O-N 2.88Å; L168-N171 HydrophobicContact CB-CB 4.41Å; L168-N171 WeakPolarHBondContact O-CB 3.39Å; L168-N171 PolarHBondContact O-N 3.44Å; L168-N171 VanDerWaalsContact O-N 3.08Å; L168-I228 HydrophobicContact CD1-CG2 3.65Å; L168-I228 HydrophobicContact CG-CG2 4.02Å; L168-L229 CarbonylContact C-O 3.55Å; L168-L229 WeakPolarHBondContact CA-O 3.24Å; L168-L229 PolarHBondContact N-O 3.19Å; L168-T234 HydrophobicContact CB-CG2 4.06Å; L168-T234 PolarHBondContact O-OG1 3.13Å; L168-A238 HydrophobicContact CB-CB 4.44Å; L168-A238 HydrophobicContact CD1-CB 4.21Å; L168-V241 HydrophobicContact CD1-CG1 4.29Å; L168-A242 HydrophobicContact CD1-CB 4.49Å
169	R	96.4	Very high	91.6	Very high	16 Å²	16	31.5 Å²	31.5	6%	0.06	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-12.1	-176.8	-66.1	176	-65	169.7	1.1	114.6	D167 L229 S231 R233 A306 V310	D167-R169 VanDerWaalsContact OD1-CB 3.25Å; D167-R169 WeakPolarHBondContact OD1-CB 3.44Å; D167-R169 VanDerWaalsContact OD1-CG 3.24Å; D167-R169 WeakPolarHBondContact OD1-CG 3.24Å; D167-R169 IonicContact OD1-CZ 3.88Å; D167-R169 PolarHBondContact OD1-N 3.41Å; D167-R169 IonicContact OD1-NE 2.87Å; D167-R169 PolarHBondContact OD1-NE 3.1Å; D167-R169 IonicContact OD1-NH2 2.7Å; D167-R169 IonicContact OD2-CZ 3.22Å; D167-R169 IonicContact OD2-NE 2.86Å; D167-R169 PolarHBondContact OD2-NE 2.92Å; D167-R169 IonicContact OD2-NH2 2.7Å; D167-R169 PolarHBondContact OD2-NH2 3.09Å; R169-L229 HydrophobicContact CG-CB 3.7Å; R169-L229 PolarHBondContact N-O 3.33Å; R169-S231 PolarHBondContact O-OG 3.11Å; R169-R233 PolarHBondContact O-NH2 3.13Å; R169-A306 WeakPolarHBondContact CD-O 3.33Å; R169-A306 PolarHBondContact NH1-O 3.45Å; R169-V310 VanDerWaalsContact NH2-CG2 3.31Å
170	Y	93.6	Very high	91.8	Very high	83 Å²	83	31.4 Å²	31.4	33%	0.325	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-1.7	-177.1	-58.3	-91.9	0	0	0	112.5	R133 D135 L168 T172 R233	R133-Y170 VanDerWaalsContact CZ-CD2 3.41Å; R133-Y170 VanDerWaalsContact CZ-CG 3.4Å; D135-Y170 WeakPolarHBondContact OD1-CB 3.45Å; L168-Y170 PolarHBondContact O-N 2.88Å; Y170-T172 PolarHBondContact O-N 2.93Å; Y170-R233 VanDerWaalsContact CD1-NH2 3.3Å
171	N	93.8	Very high	91.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.144	C	C	.	.			trans	-84.3	97.4	-173	-163.6	-58.3	0	0	0	111.6	I134 D135 Q136 I137 L168 G173 T234 M235 A238	I134-N171 WeakPolarHBondContact O-CB 3.38Å; I134-N171 PolarHBondContact O-ND2 3.33Å; D135-N171 WeakPolarHBondContact O-CA 3.31Å; Q136-N171 PolarHBondContact N-ND2 3.38Å; I137-N171 WeakPolarHBondContact CD1-ND2 3.37Å; L168-N171 HydrophobicContact CB-CB 4.41Å; L168-N171 WeakPolarHBondContact O-CB 3.39Å; L168-N171 PolarHBondContact O-N 3.44Å; L168-N171 VanDerWaalsContact O-N 3.08Å; N171-G173 PolarHBondContact OD1-N 2.93Å; N171-G173 PolarHBondContact OD1-O 2.73Å; N171-T234 CarbonylContact O-C 3.53Å; N171-T234 VanDerWaalsContact O-CA 3.3Å; N171-T234 WeakPolarHBondContact O-CA 3.38Å; N171-M235 PolarHBondContact O-N 3.45Å; N171-A238 HydrophobicContact CB-CB 3.73Å; N171-A238 VanDerWaalsContact CG-CB 3.44Å; N171-A238 WeakPolarHBondContact OD1-CB 3.47Å
172	T	85.3	Confident	91.9	Very high	86 Å²	86	25.7 Å²	25.7	53%	0.528	15%	0.151	S	C	.	.			trans	-95.7	11.7	-178.1	58.9	0	0	0	0	113.5	Y170 R233 M235	Y170-T172 PolarHBondContact O-N 2.93Å; T172-R233 HydrophobicContact CG2-CB 4.22Å; T172-M235 WeakPolarHBondContact O-CE 3.22Å
173	G	75.1	Confident	92	Very high	24 Å²	24	22.6 Å²	22.6	25%	0.247	13%	0.129	C	C	.	.			trans	164.2	174	179	0	0	0	0	0	115.4	Q136 I137 N171	Q136-G173 WeakPolarHBondContact CA-O 3.46Å; I137-G173 PolarHBondContact N-O 2.87Å; N171-G173 PolarHBondContact OD1-N 2.93Å; N171-G173 PolarHBondContact OD1-O 2.73Å
174	G	84.5	Confident	91.9	Very high	25 Å²	25	22 Å²	22	26%	0.258	13%	0.125	S	C	.	.	B	Isolated β-bridge	trans	148.7	174.5	-177.2	0	0	0	0	0	111.7	I137 A237	I137-G174 CarbonylContact O-C 3.54Å; I137-G174 WeakPolarHBondContact O-CA 3.42Å; G174-A237 WeakPolarHBondContact O-CB 3.3Å
175	E	88.3	Confident	91.7	Very high	118 Å²	118	22.3 Å²	22.3	55%	0.551	13%	0.126	S	C	*	.			trans	-93.4	134.4	-168.4	-68.7	-60.2	151.2	0	0	113	I137 D139 S177 G178	I137-E175 PolarHBondContact O-N 3.05Å; D139-E175 HydrophobicContact CB-CB 3.74Å; D139-E175 HydrophobicContact CB-CG 3.98Å; E175-S177 PolarHBondContact O-N 3.28Å; E175-G178 PolarHBondContact O-N 2.9Å
176	L	89.6	Confident	91.5	Very high	27 Å²	27	22.6 Å²	22.6	14%	0.141	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-65.3	-22.1	-178.1	-71.4	167.7	0	0	0	113.1	G178 V179 P180 I198 A237 A240 V263 W293	L176-G178 PolarHBondContact O-N 3.08Å; L176-V179 HydrophobicContact CD2-CG2 4.24Å; L176-V179 WeakPolarHBondContact O-CB 3.4Å; L176-V179 WeakPolarHBondContact O-CG2 3.42Å; L176-V179 PolarHBondContact O-N 3.03Å; L176-P180 WeakPolarHBondContact O-CD 3.47Å; L176-I198 HydrophobicContact CB-CD1 4.23Å; L176-I198 HydrophobicContact CD1-CD1 3.9Å; L176-A237 HydrophobicContact CD2-CB 4.04Å; L176-A240 HydrophobicContact CD2-CB 4.1Å; L176-V263 HydrophobicContact CD1-CB 4.25Å; L176-V263 HydrophobicContact CD1-CG1 3.75Å; L176-V263 HydrophobicContact CD1-CG2 4.03Å; L176-W293 HydrophobicContact CD2-CZ2 4.3Å
177	S	90.3	Very high	91.2	Very high	29 Å²	29	22.8 Å²	22.8	20%	0.203	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-65	-21.6	171.3	60.6	0	0	0	0	113.5	D139 Q140 E175 V179 P180	D139-S177 WeakPolarHBondContact CA-OG 3.43Å; D139-S177 WeakPolarHBondContact CB-OG 3.27Å; Q140-S177 PolarHBondContact N-OG 2.95Å; E175-S177 PolarHBondContact O-N 3.28Å; S177-V179 VanDerWaalsContact C-N 3.34Å; S177-P180 WeakPolarHBondContact O-CD 3.37Å
178	G	91	Very high	90.7	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.01	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-75.2	-20	173.9	0	0	0	0	0	114.2	I138 E175 L176 V181 I182	I138-G178 VanDerWaalsContact O-CA 3.23Å; I138-G178 WeakPolarHBondContact O-CA 3.33Å; E175-G178 PolarHBondContact O-N 2.9Å; L176-G178 PolarHBondContact O-N 3.08Å; G178-V181 PolarHBondContact O-N 3.41Å; G178-I182 PolarHBondContact O-N 2.85Å
179	V	94.1	Very high	90.2	Very high	1 Å²	1	28 Å²	28	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-62.4	-48.6	-177.2	-177.7	0	0	0	0	111.8	L176 S177 V181 I182 I183 I195 A237 A240 V241	L176-V179 HydrophobicContact CD2-CG2 4.24Å; L176-V179 WeakPolarHBondContact O-CB 3.4Å; L176-V179 WeakPolarHBondContact O-CG2 3.42Å; L176-V179 PolarHBondContact O-N 3.03Å; S177-V179 VanDerWaalsContact C-N 3.34Å; V179-V181 VanDerWaalsContact C-N 3.25Å; V179-V181 PolarHBondContact O-N 3.27Å; V179-I182 PolarHBondContact O-N 3.34Å; V179-I182 VanDerWaalsContact O-N 3.15Å; V179-I183 HydrophobicContact CG1-CG1 3.93Å; V179-I183 WeakPolarHBondContact O-CG1 3.32Å; V179-I183 PolarHBondContact O-N 3.07Å; V179-I195 HydrophobicContact CG1-CG2 3.95Å; V179-A237 HydrophobicContact CG2-CB 4.03Å; V179-A240 HydrophobicContact CG1-CB 4.4Å; V179-A240 HydrophobicContact CG2-CB 4.15Å; V179-V241 HydrophobicContact CB-CG2 4.42Å; V179-V241 HydrophobicContact CG1-CG2 3.97Å; V179-V241 HydrophobicContact CG2-CG2 4.16Å
180	P	94	Very high	89.7	Confident	7 Å²	7	32.6 Å²	32.6	5%	0.045	18%	0.182	C	C	.	.	H	α-helix	trans	-43.1	-46.4	169	-35.9	37.4	0	0	0	115.3	L176 S177 S184 I195 L209	L176-P180 WeakPolarHBondContact O-CD 3.47Å; S177-P180 WeakPolarHBondContact O-CD 3.37Å; P180-S184 WeakPolarHBondContact O-CB 3.36Å; P180-S184 PolarHBondContact O-N 3.1Å; P180-S184 VanDerWaalsContact O-N 3.13Å; P180-S184 PolarHBondContact O-OG 3.25Å; P180-I195 HydrophobicContact CB-CD1 4.35Å; P180-I195 HydrophobicContact CG-CD1 4.4Å; P180-L209 HydrophobicContact CG-CB 4.12Å; P180-L209 HydrophobicContact CG-CD2 4.04Å; P180-L209 HydrophobicContact CG-CG 4.48Å
181	V	90.8	Very high	89.5	Confident	14 Å²	14	33.6 Å²	33.6	9%	0.085	20%	0.199	C	C	.	.	H	α-helix	trans	-64.5	-49.4	-177.7	-174.7	0	0	0	0	110.2	Q140 V143 W151 G178 V179 S184 Y185 M212	Q140-V181 HydrophobicContact CG-CG2 4.13Å; V143-V181 HydrophobicContact CG1-CG1 4.23Å; W151-V181 HydrophobicContact CH2-CG1 4.24Å; G178-V181 PolarHBondContact O-N 3.41Å; V179-V181 VanDerWaalsContact C-N 3.25Å; V179-V181 PolarHBondContact O-N 3.27Å; V181-S184 PolarHBondContact O-N 2.9Å; V181-Y185 HydrophobicContact CG1-CE2 3.95Å; V181-Y185 WeakPolarHBondContact O-CD2 3.35Å; V181-M212 HydrophobicContact CG2-SD 4.24Å
182	I	92.4	Very high	89.3	Confident	28 Å²	28	36.4 Å²	36.4	14%	0.144	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-46.8	-176.8	-63.9	174.3	0	0	0	111.4	I134 I137 G178 V179 S184 Y185 F186 V241	I134-I182 HydrophobicContact CD1-CD1 4.34Å; I137-I182 HydrophobicContact CD1-CD1 3.81Å; I137-I182 HydrophobicContact CG2-CD1 4.01Å; G178-I182 PolarHBondContact O-N 2.85Å; V179-I182 PolarHBondContact O-N 3.34Å; V179-I182 VanDerWaalsContact O-N 3.15Å; I182-S184 VanDerWaalsContact C-N 3.26Å; I182-S184 PolarHBondContact O-N 2.87Å; I182-Y185 PolarHBondContact O-N 2.83Å; I182-F186 HydrophobicContact CG2-CE2 4.12Å; I182-F186 VanDerWaalsContact O-CD2 3.26Å; I182-F186 WeakPolarHBondContact O-CD2 3.3Å; I182-V241 HydrophobicContact CB-CG2 4.34Å; I182-V241 HydrophobicContact CD1-CG2 4.25Å; I182-V241 HydrophobicContact CG2-CG1 3.92Å; I182-V241 HydrophobicContact CG2-CG2 4.2Å
183	I	94.2	Very high	89.6	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-61.6	-37.2	180	-58.1	-62.1	0	0	0	111	V179 Y185 F186 S187 I195 T211 V241 T244 L245 L248	V179-I183 HydrophobicContact CG1-CG1 3.93Å; V179-I183 WeakPolarHBondContact O-CG1 3.32Å; V179-I183 PolarHBondContact O-N 3.07Å; I183-Y185 VanDerWaalsContact C-N 3.25Å; I183-Y185 PolarHBondContact O-N 3.21Å; I183-F186 PolarHBondContact O-N 2.8Å; I183-S187 PolarHBondContact O-N 2.87Å; I183-I195 HydrophobicContact CB-CD1 3.84Å; I183-I195 HydrophobicContact CB-CG1 4.37Å; I183-I195 HydrophobicContact CG1-CD1 4.08Å; I183-I195 HydrophobicContact CG1-CG1 4.48Å; I183-I195 HydrophobicContact CG1-CG2 4.24Å; I183-I195 HydrophobicContact CG2-CD1 4.11Å; I183-I195 HydrophobicContact CG2-CG1 4.13Å; I183-T211 HydrophobicContact CB-CG2 4.4Å; I183-T211 HydrophobicContact CG2-CG2 3.82Å; I183-V241 HydrophobicContact CD1-CG1 4.47Å; I183-T244 HydrophobicContact CD1-CG2 4.07Å; I183-T244 HydrophobicContact CG1-CG2 4.44Å; I183-T244 HydrophobicContact CG2-CG2 4.49Å; I183-L245 HydrophobicContact CD1-CD1 4.12Å; I183-L245 HydrophobicContact CD1-CD2 3.76Å; I183-L245 HydrophobicContact CD1-CG 3.58Å; I183-L248 HydrophobicContact CG2-CD1 4.29Å
184	S	92.6	Very high	90.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60	-30.8	178.7	-57.5	0	0	0	0	113.2	P180 V181 I182 F186 S187 T211 M212 R219	P180-S184 WeakPolarHBondContact O-CB 3.36Å; P180-S184 PolarHBondContact O-N 3.1Å; P180-S184 VanDerWaalsContact O-N 3.13Å; P180-S184 PolarHBondContact O-OG 3.25Å; V181-S184 PolarHBondContact O-N 2.9Å; I182-S184 VanDerWaalsContact C-N 3.26Å; I182-S184 PolarHBondContact O-N 2.87Å; S184-F186 PolarHBondContact O-N 3.02Å; S184-S187 PolarHBondContact O-N 3.46Å; S184-T211 WeakPolarHBondContact OG-CA 3.36Å; S184-M212 PolarHBondContact OG-N 3.35Å; S184-R219 PolarHBondContact O-NH1 3.29Å
185	Y	91.8	Very high	91	Very high	6 Å²	6	33.7 Å²	33.7	2%	0.024	19%	0.186	C	C	.	.	H	α-helix	trans	-70	-18.3	175.4	-77.3	-76.9	0	0	0	113.9	W151 W155 V181 I182 I183 I215 P216 Y220	W151-Y185 HydrophobicContact CE3-CE1 4.29Å; W151-Y185 HydrophobicContact CE3-CE2 4.47Å; W151-Y185 AromaticContact CE3-CZ 3.86Å; W151-Y185 HydrophobicContact CH2-CD2 4.32Å; W151-Y185 HydrophobicContact CH2-CE1 4.48Å; W151-Y185 AromaticContact CH2-CE2 3.3Å; W151-Y185 HydrophobicContact CH2-CE2 3.3Å; W151-Y185 AromaticContact CH2-CZ 3.41Å; W151-Y185 VanDerWaalsContact CH2-CZ 3.41Å; W151-Y185 WeakPolarHBondContact CH2-OH 3.21Å; W151-Y185 HydrophobicContact CZ2-CE2 4.2Å; W151-Y185 WeakPolarHBondContact CZ2-OH 3.3Å; W151-Y185 HydrophobicContact CZ3-CD2 4.26Å; W151-Y185 AromaticContact CZ3-CE1 3.92Å; W151-Y185 HydrophobicContact CZ3-CE1 3.92Å; W151-Y185 AromaticContact CZ3-CE2 3.44Å; W151-Y185 HydrophobicContact CZ3-CE2 3.44Å; W151-Y185 VanDerWaalsContact CZ3-CE2 3.44Å; W151-Y185 AromaticContact CZ3-CZ 3.24Å; W151-Y185 VanDerWaalsContact CZ3-OH 3.22Å; W151-Y185 WeakPolarHBondContact CZ3-OH 3.17Å; W155-Y185 AromaticContact CD1-CE1 3.93Å; W155-Y185 HydrophobicContact CD2-CD1 4.07Å; W155-Y185 HydrophobicContact CD2-CG 4.42Å; W155-Y185 AromaticContact CE2-CD1 3.37Å; W155-Y185 AromaticContact CE2-CG 3.96Å; W155-Y185 HydrophobicContact CG-CD1 4.5Å; W155-Y185 HydrophobicContact CG-CE1 4.48Å; W155-Y185 HydrophobicContact CH2-CD1 4.37Å; W155-Y185 HydrophobicContact CH2-CG 4.24Å; W155-Y185 AromaticContact CZ2-CD1 3.57Å; W155-Y185 HydrophobicContact CZ2-CD1 3.57Å; W155-Y185 AromaticContact CZ2-CG 3.88Å; W155-Y185 HydrophobicContact CZ2-CG 3.88Å; W155-Y185 AromaticContact NE1-CD1 3.36Å; W155-Y185 AromaticContact NE1-CE1 3.6Å; V181-Y185 HydrophobicContact CG1-CE2 3.95Å; V181-Y185 WeakPolarHBondContact O-CD2 3.35Å; I182-Y185 PolarHBondContact O-N 2.83Å; I183-Y185 VanDerWaalsContact C-N 3.25Å; I183-Y185 PolarHBondContact O-N 3.21Å; Y185-I215 HydrophobicContact CD1-CD1 3.6Å; Y185-I215 HydrophobicContact CD1-CG1 4.48Å; Y185-I215 HydrophobicContact CD2-CD1 4.03Å; Y185-I215 HydrophobicContact CE1-CD1 3.46Å; Y185-I215 VanDerWaalsContact CE1-CD1 3.46Å; Y185-I215 HydrophobicContact CE1-CG1 3.88Å; Y185-I215 HydrophobicContact CE2-CB 4.41Å; Y185-I215 HydrophobicContact CE2-CD1 3.86Å; Y185-I215 HydrophobicContact CE2-CG1 4.46Å; Y185-I215 HydrophobicContact CG-CD1 3.87Å; Y185-P216 WeakPolarHBondContact CE1-O 3.45Å; Y185-P216 WeakPolarHBondContact OH-CD 3.46Å; Y185-P216 PolarHBondContact OH-O 2.81Å; Y185-Y220 VanDerWaalsContact O-CB 3.31Å; Y185-Y220 WeakPolarHBondContact O-CB 3.37Å; Y185-Y220 PolarHBondContact O-N 2.71Å
186	F	93.1	Very high	91.2	Very high	6 Å²	6	28.2 Å²	28.2	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-107	-8.3	179.6	-58.5	-67.5	0	0	0	113.9	W155 L164 L166 I182 I183 S184 Y220 V226 L245 R250	W155-F186 HydrophobicContact CH2-CE1 4.04Å; W155-F186 AromaticContact CH2-CZ 3.97Å; W155-F186 HydrophobicContact CH2-CZ 3.97Å; W155-F186 HydrophobicContact CZ3-CZ 4.18Å; L164-F186 HydrophobicContact CD2-CE1 3.64Å; L164-F186 HydrophobicContact CD2-CZ 3.69Å; L166-F186 HydrophobicContact CD2-CE2 4.37Å; I182-F186 HydrophobicContact CG2-CE2 4.12Å; I182-F186 VanDerWaalsContact O-CD2 3.26Å; I182-F186 WeakPolarHBondContact O-CD2 3.3Å; I183-F186 PolarHBondContact O-N 2.8Å; S184-F186 PolarHBondContact O-N 3.02Å; F186-Y220 HydrophobicContact CD1-CD1 4.04Å; F186-Y220 HydrophobicContact CD1-CG 4.32Å; F186-Y220 AromaticContact CE1-CD1 3.89Å; F186-Y220 HydrophobicContact CE1-CD1 3.89Å; F186-Y220 HydrophobicContact CE1-CG 4.1Å; F186-V226 HydrophobicContact CD1-CG2 3.89Å; F186-V226 HydrophobicContact CE1-CG1 4.46Å; F186-V226 HydrophobicContact CE1-CG2 3.89Å; F186-L245 HydrophobicContact CB-CD2 3.94Å; F186-L245 HydrophobicContact CD2-CD1 3.93Å; F186-L245 HydrophobicContact CD2-CD2 4.39Å; F186-L245 HydrophobicContact CE2-CD1 4.4Å; F186-L245 HydrophobicContact CG-CD2 4.45Å; F186-R250 HydrophobicContact CB-CG 4.03Å; F186-R250 PolarHBondContact O-NE 2.9Å
187	S	89.3	Confident	91.4	Very high	5 Å²	5	28 Å²	28	4%	0.035	16%	0.16	C	C	.	.	S	Bend	trans	-96.1	165.5	172.3	82.5	0	0	0	0	112.6	I183 S184 R219	I183-S187 PolarHBondContact O-N 2.87Å; S184-S187 PolarHBondContact O-N 3.46Å; S187-R219 WeakPolarHBondContact O-CD 3.43Å; S187-R219 PolarHBondContact O-NH1 2.86Å; S187-R219 PolarHBondContact OG-NH1 3.39Å; S187-R219 VanDerWaalsContact OG-NH1 3.13Å
188	D	87.9	Confident	91.5	Very high	56 Å²	56	27.7 Å²	27.7	30%	0.299	16%	0.156	S	C	.	.			trans	-74.1	162.4	160.8	-67.3	-15.3	0	0	0	109.8	R219 K222	D188-R219 VanDerWaalsContact C-NH1 3.29Å; D188-R219 PolarHBondContact O-NH1 3.28Å; D188-K222 VanDerWaalsContact CG-CE 3.44Å; D188-K222 VanDerWaalsContact OD2-CD 3.27Å; D188-K222 WeakPolarHBondContact OD2-CD 3.48Å; D188-K222 WeakPolarHBondContact OD2-CE 3.38Å; D188-K222 IonicContact OD2-NZ 2.67Å; D188-K222 PolarHBondContact OD2-NZ 2.67Å
189	P	86.5	Confident	91.5	Very high	56 Å²	56	29.1 Å²	29.1	36%	0.364	16%	0.161	S	C	.	.	S	Bend	trans	-72.3	-33.7	-179.3	28.3	-34.7	0	0	0	113.8	S213 R219	P189-S213 WeakPolarHBondContact CB-O 3.35Å; P189-R219 VanDerWaalsContact CA-CZ 3.41Å
190	E	86.5	Confident	91.4	Very high	111 Å²	111	30.1 Å²	30.1	52%	0.519	17%	0.166	S	C	.	.	S	Bend	trans	-137.6	146.4	-177.5	-62.5	-59.7	157.9	0	0	109.6	P192 S213	E190-P192 VanDerWaalsContact OE2-CD 3.28Å; E190-P192 WeakPolarHBondContact OE2-CD 3.28Å; E190-S213 WeakPolarHBondContact OE1-CB 3.49Å
191	P	89.3	Confident	91.2	Very high	105 Å²	105	32.5 Å²	32.5	68%	0.682	18%	0.175	S	C	*	.	S	Bend	cis	-67.4	159	-12.6	31.4	-36.1	0	0	0	111.4	I193	P191-I193 PolarHBondContact O-N 3.18Å
192	P	89.4	Confident	90.8	Very high	58 Å²	58	34.5 Å²	34.5	38%	0.377	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-68.5	133.6	179.3	-17.5	33.7	0	0	0	110.5	E190 W210	E190-P192 VanDerWaalsContact OE2-CD 3.28Å; E190-P192 WeakPolarHBondContact OE2-CD 3.28Å; P192-W210 HydrophobicContact CB-CE3 4.07Å; P192-W210 WeakPolarHBondContact O-CZ3 3.39Å
193	I	91.6	Very high	90.6	Very high	42 Å²	42	36.4 Å²	36.4	22%	0.215	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-89	127.7	179	-57	-179.1	0	0	0	109.2	P191 I195 W210 T211 L248	P191-I193 PolarHBondContact O-N 3.18Å; I193-I195 PolarHBondContact O-N 2.74Å; I193-W210 WeakPolarHBondContact O-CA 3.16Å; I193-T211 HydrophobicContact CB-CG2 3.91Å; I193-T211 PolarHBondContact N-OG1 3.19Å; I193-T211 PolarHBondContact O-N 3.48Å; I193-L248 HydrophobicContact CD1-CD1 4.39Å; I193-L248 HydrophobicContact CD1-CD2 4.37Å; I193-L248 HydrophobicContact CG2-CD1 4.31Å; I193-L248 HydrophobicContact CG2-CD2 3.94Å
194	H	94.5	Very high	90.2	Very high	36 Å²	36	41.1 Å²	41.1	17%	0.167	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	114.4	166.5	-160.6	164.9	0	0	0	108.9	T197 E208 L209 W210 P287	H194-T197 PolarHBondContact CE1-OG1 2.96Å; H194-T197 VanDerWaalsContact CE1-OG1 3.26Å; H194-T197 PolarHBondContact NE2-OG1 2.67Å; H194-T197 VanDerWaalsContact NE2-OG1 3.13Å; H194-E208 VanDerWaalsContact CE1-CD 3.46Å; H194-E208 IonicContact CE1-OE1 2.72Å; H194-E208 PolarHBondContact CE1-OE1 3.32Å; H194-E208 WeakPolarHBondContact NE2-CB 3.37Å; H194-L209 PolarHBondContact CD2-O 2.94Å; H194-W210 HydrophobicContact CB-CD2 4.23Å; H194-W210 HydrophobicContact CB-CE3 3.92Å; H194-W210 HydrophobicContact CB-CH2 3.71Å; H194-W210 HydrophobicContact CB-CZ2 4Å; H194-W210 HydrophobicContact CB-CZ3 3.66Å; H194-W210 AromaticContact CG-CE2 3.9Å; H194-W210 AromaticContact CG-CH2 3.96Å; H194-W210 AromaticContact CG-CZ2 3.73Å; H194-W210 AromaticContact ND1-CH2 3.94Å; H194-W210 AromaticContact ND1-CZ2 3.54Å; H194-P287 HydrophobicContact CB-CB 4.31Å; H194-P287 HydrophobicContact CB-CG 3.9Å; H194-P287 VanDerWaalsContact CG-CG 3.44Å
195	I	93.2	Very high	90	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	-51.9	-173	-63.3	171.6	0	0	0	111	V179 P180 I183 I193 L209 T211 T244 N286	V179-I195 HydrophobicContact CG1-CG2 3.95Å; P180-I195 HydrophobicContact CB-CD1 4.35Å; P180-I195 HydrophobicContact CG-CD1 4.4Å; I183-I195 HydrophobicContact CB-CD1 3.84Å; I183-I195 HydrophobicContact CB-CG1 4.37Å; I183-I195 HydrophobicContact CG1-CD1 4.08Å; I183-I195 HydrophobicContact CG1-CG1 4.48Å; I183-I195 HydrophobicContact CG1-CG2 4.24Å; I183-I195 HydrophobicContact CG2-CD1 4.11Å; I183-I195 HydrophobicContact CG2-CG1 4.13Å; I193-I195 PolarHBondContact O-N 2.74Å; I195-L209 HydrophobicContact CB-CB 4.1Å; I195-L209 VanDerWaalsContact CB-O 3.27Å; I195-L209 WeakPolarHBondContact CB-O 3.28Å; I195-L209 HydrophobicContact CG2-CB 4.41Å; I195-L209 PolarHBondContact N-O 2.81Å; I195-T211 HydrophobicContact CD1-CG2 3.94Å; I195-T211 HydrophobicContact CG1-CG2 4.13Å; I195-T244 HydrophobicContact CG2-CG2 4.08Å; I195-N286 PolarHBondContact O-ND2 2.82Å; I195-N286 VanDerWaalsContact O-ND2 3.1Å
196	D	93.1	Very high	89.9	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.021	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	140.2	-170.1	-168.7	13	0	0	0	110.2	L209 S284 I285	D196-L209 HydrophobicContact CB-CB 4.45Å; D196-L209 HydrophobicContact CB-CD1 4.3Å; D196-L209 PolarHBondContact O-N 3.14Å; D196-S284 WeakPolarHBondContact OD1-CB 3.48Å; D196-S284 PolarHBondContact OD1-OG 2.99Å; D196-S284 WeakPolarHBondContact OD2-CB 3.3Å; D196-S284 PolarHBondContact OD2-OG 2.83Å; D196-I285 PolarHBondContact OD1-N 3.4Å
197	T	93.7	Very high	89.8	Confident	22 Å²	22	54.3 Å²	54.3	14%	0.135	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	112	169.6	-55.4	0	0	0	0	109.4	H194 T206 E208 I285	H194-T197 PolarHBondContact CE1-OG1 2.96Å; H194-T197 VanDerWaalsContact CE1-OG1 3.26Å; H194-T197 PolarHBondContact NE2-OG1 2.67Å; H194-T197 VanDerWaalsContact NE2-OG1 3.13Å; T197-T206 HydrophobicContact CG2-CG2 3.81Å; T197-E208 HydrophobicContact CG2-CG 4.48Å; T197-I285 PolarHBondContact N-O 3.41Å; T197-I285 PolarHBondContact O-N 2.79Å
198	I	92.6	Very high	90	Very high	23 Å²	23	58.8 Å²	58.8	12%	0.118	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	114.6	173.8	-64.8	170.6	0	0	0	109	L176 T206 K207 L209 V263 A282 R283	L176-I198 HydrophobicContact CB-CD1 4.23Å; L176-I198 HydrophobicContact CD1-CD1 3.9Å; I198-T206 CarbonylContact O-C 3.54Å; I198-T206 VanDerWaalsContact O-CA 3.31Å; I198-T206 WeakPolarHBondContact O-CA 3.41Å; I198-K207 PolarHBondContact N-O 2.89Å; I198-K207 PolarHBondContact O-N 2.84Å; I198-L209 HydrophobicContact CD1-CD1 3.96Å; I198-L209 HydrophobicContact CD1-CG 4.3Å; I198-V263 HydrophobicContact CG2-CG1 3.85Å; I198-A282 HydrophobicContact CG2-CB 4.37Å; I198-R283 WeakPolarHBondContact CA-O 3.28Å
199	Y	91.9	Very high	90.2	Very high	30 Å²	30	56.5 Å²	56.5	12%	0.118	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	118.3	170.6	172.4	-111.7	0	0	0	110.1	R201 N204 T206 A282 R283	Y199-R201 HydrophobicContact CE1-CB 3.94Å; Y199-R201 WeakPolarHBondContact OH-CD 3.47Å; Y199-N204 PolarHBondContact OH-OD1 2.91Å; Y199-T206 HydrophobicContact CD2-CG2 4.06Å; Y199-A282 CarbonylContact O-C 3.47Å; Y199-A282 WeakPolarHBondContact O-CA 3.41Å; Y199-A282 VanDerWaalsContact O-CB 3.28Å; Y199-A282 WeakPolarHBondContact O-CB 3Å; Y199-R283 HydrophobicContact CD1-CG 4.36Å; Y199-R283 PolarHBondContact N-O 2.95Å; Y199-R283 PolarHBondContact O-N 3.47Å
200	D	90.6	Very high	90.6	Very high	22 Å²	22	59.2 Å²	59.2	12%	0.118	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	118	169.3	-167.5	-49.3	0	0	0	110.3	S202 N204 T205 K264 A282	D200-S202 WeakPolarHBondContact OD1-CB 3.43Å; D200-S202 PolarHBondContact OD1-N 2.87Å; D200-S202 PolarHBondContact OD1-OG 2.72Å; D200-N204 CarbonylContact O-C 3.56Å; D200-N204 WeakPolarHBondContact O-CA 3.49Å; D200-N204 PolarHBondContact O-N 2.85Å; D200-T205 PolarHBondContact N-O 2.85Å; D200-T205 PolarHBondContact O-N 2.86Å; D200-K264 IonicContact OD1-NZ 2.72Å; D200-K264 WeakPolarHBondContact OD2-CD 3.29Å; D200-K264 IonicContact OD2-NZ 3.67Å; D200-K264 PolarHBondContact OD2-NZ 2.86Å; D200-A282 HydrophobicContact CB-CB 4Å
201	R	90.1	Very high	90.9	Very high	57 Å²	57	54.3 Å²	54.3	22%	0.215	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-29	-177.7	175.7	65.2	-170.2	94.5	-5.9	113	M37 Q38 N39 Y40 Y199 N204 V281	M37-R201 PolarHBondContact O-NH2 2.64Å; Q38-R201 PolarHBondContact O-NH1 3.33Å; N39-R201 VanDerWaalsContact C-CG 3.43Å; Y40-R201 WeakPolarHBondContact O-CG 3.41Å; Y199-R201 HydrophobicContact CE1-CB 3.94Å; Y199-R201 WeakPolarHBondContact OH-CD 3.47Å; R201-N204 PolarHBondContact O-N 2.7Å; R201-V281 WeakPolarHBondContact CB-O 3.43Å; R201-V281 PolarHBondContact N-O 3.08Å
202	S	82.9	Confident	91	Very high	56 Å²	56	52.4 Å²	52.4	39%	0.392	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-36.1	-173.3	68.1	0	0	0	0	112.6	D200	D200-S202 WeakPolarHBondContact OD1-CB 3.43Å; D200-S202 PolarHBondContact OD1-N 2.87Å; D200-S202 PolarHBondContact OD1-OG 2.72Å
203	S	86.9	Confident	90.8	Very high	69 Å²	69	52.6 Å²	52.6	48%	0.483	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-13.9	165.8	49.2	0	0	0	0	113.3	T205	S203-T205 VanDerWaalsContact C-N 3.35Å; S203-T205 PolarHBondContact OG-OG1 2.85Å
204	N	85.8	Confident	90.6	Very high	100 Å²	100	55.2 Å²	55.2	54%	0.535	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	46.5	-169.9	-165.1	55.8	0	0	0	112.8	Y199 D200 R201	Y199-N204 PolarHBondContact OH-OD1 2.91Å; D200-N204 CarbonylContact O-C 3.56Å; D200-N204 WeakPolarHBondContact O-CA 3.49Å; D200-N204 PolarHBondContact O-N 2.85Å; R201-N204 PolarHBondContact O-N 2.7Å
205	T	89.3	Confident	90.2	Very high	74 Å²	74	54.4 Å²	54.4	45%	0.454	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137	-177.4	54.7	0	0	0	0	111.2	D200 S203	D200-T205 PolarHBondContact N-O 2.85Å; D200-T205 PolarHBondContact O-N 2.86Å; S203-T205 VanDerWaalsContact C-N 3.35Å; S203-T205 PolarHBondContact OG-OG1 2.85Å
206	T	89.3	Confident	89.6	Confident	92 Å²	92	57.9 Å²	57.9	56%	0.564	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	146	161.2	44.3	0	0	0	0	111	T197 I198 Y199	T197-T206 HydrophobicContact CG2-CG2 3.81Å; I198-T206 CarbonylContact O-C 3.54Å; I198-T206 VanDerWaalsContact O-CA 3.31Å; I198-T206 WeakPolarHBondContact O-CA 3.41Å; Y199-T206 HydrophobicContact CD2-CG2 4.06Å
207	K	91.8	Very high	88.9	Confident	123 Å²	123	60 Å²	60	54%	0.535	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	116.7	165.7	177.9	-179.3	176.7	179.4	0	108.3	I198	I198-K207 PolarHBondContact N-O 2.89Å; I198-K207 PolarHBondContact O-N 2.84Å
208	E	92.8	Very high	88.5	Confident	98 Å²	98	66.7 Å²	66.7	46%	0.458	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	147.3	177.2	-58.3	-177.1	153.4	0	0	111.3	H194 T197 W210	H194-E208 VanDerWaalsContact CE1-CD 3.46Å; H194-E208 IonicContact CE1-OE1 2.72Å; H194-E208 PolarHBondContact CE1-OE1 3.32Å; H194-E208 WeakPolarHBondContact NE2-CB 3.37Å; T197-E208 HydrophobicContact CG2-CG 4.48Å; E208-W210 VanDerWaalsContact CB-NE1 3.33Å; E208-W210 PolarHBondContact OE2-NE1 2.73Å
209	L	93.2	Very high	88.4	Confident	9 Å²	9	67.5 Å²	67.5	5%	0.047	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	122.6	170.6	-61.7	-174.3	0	0	0	108.6	P180 H194 I195 D196 I198	P180-L209 HydrophobicContact CG-CB 4.12Å; P180-L209 HydrophobicContact CG-CD2 4.04Å; P180-L209 HydrophobicContact CG-CG 4.48Å; H194-L209 PolarHBondContact CD2-O 2.94Å; I195-L209 HydrophobicContact CB-CB 4.1Å; I195-L209 VanDerWaalsContact CB-O 3.27Å; I195-L209 WeakPolarHBondContact CB-O 3.28Å; I195-L209 HydrophobicContact CG2-CB 4.41Å; I195-L209 PolarHBondContact N-O 2.81Å; D196-L209 HydrophobicContact CB-CB 4.45Å; D196-L209 HydrophobicContact CB-CD1 4.3Å; D196-L209 PolarHBondContact O-N 3.14Å; I198-L209 HydrophobicContact CD1-CD1 3.96Å; I198-L209 HydrophobicContact CD1-CG 4.3Å
210	W	94.4	Very high	88.4	Confident	113 Å²	113	66.4 Å²	66.4	43%	0.428	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	150.8	-177.7	-69.8	90	0	0	0	110.8	P192 I193 H194 E208	P192-W210 HydrophobicContact CB-CE3 4.07Å; P192-W210 WeakPolarHBondContact O-CZ3 3.39Å; I193-W210 WeakPolarHBondContact O-CA 3.16Å; H194-W210 HydrophobicContact CB-CD2 4.23Å; H194-W210 HydrophobicContact CB-CE3 3.92Å; H194-W210 HydrophobicContact CB-CH2 3.71Å; H194-W210 HydrophobicContact CB-CZ2 4Å; H194-W210 HydrophobicContact CB-CZ3 3.66Å; H194-W210 AromaticContact CG-CE2 3.9Å; H194-W210 AromaticContact CG-CH2 3.96Å; H194-W210 AromaticContact CG-CZ2 3.73Å; H194-W210 AromaticContact ND1-CH2 3.94Å; H194-W210 AromaticContact ND1-CZ2 3.54Å; E208-W210 VanDerWaalsContact CB-NE1 3.33Å; E208-W210 PolarHBondContact OE2-NE1 2.73Å
211	T	93.4	Very high	88	Confident	7 Å²	7	66.3 Å²	66.3	4%	0.043	37%	0.37	C	S	.	.			trans	-67	140.8	169.1	54.2	0	0	0	0	111	I183 S184 I193 I195	I183-T211 HydrophobicContact CB-CG2 4.4Å; I183-T211 HydrophobicContact CG2-CG2 3.82Å; S184-T211 WeakPolarHBondContact OG-CA 3.36Å; I193-T211 HydrophobicContact CB-CG2 3.91Å; I193-T211 PolarHBondContact N-OG1 3.19Å; I193-T211 PolarHBondContact O-N 3.48Å; I195-T211 HydrophobicContact CD1-CG2 3.94Å; I195-T211 HydrophobicContact CG1-CG2 4.13Å
212	M	90	Very high	87.7	Confident	65 Å²	65	69.4 Å²	69.4	32%	0.32	38%	0.384	S	S	.	.			trans	-78.8	134.6	174.6	-60.3	172.7	63.9	0	0	109.4	V181 S184 I215 R219	V181-M212 HydrophobicContact CG2-SD 4.24Å; S184-M212 PolarHBondContact OG-N 3.35Å; M212-I215 HydrophobicContact CB-CG2 3.69Å; M212-R219 PolarHBondContact O-NH2 3.43Å
213	S	86.6	Confident	87.6	Confident	62 Å²	62	76.9 Å²	76.9	43%	0.434	41%	0.41	S	S	.	.	S	Bend	trans	-73.2	-45.5	176.1	55.2	0	0	0	0	112	P189 E190 R219	P189-S213 WeakPolarHBondContact CB-O 3.35Å; E190-S213 WeakPolarHBondContact OE1-CB 3.49Å; S213-R219 PolarHBondContact O-NH2 3.02Å
214	S	86.2	Confident	87.8	Confident	97 Å²	97	76.4 Å²	76.4	68%	0.678	40%	0.399	S	S	*	.			trans	-95.6	124.4	170.5	-171.8	0	0	0	0	111.6
215	I	86.1	Confident	88	Confident	20 Å²	20	73.6 Å²	73.6	10%	0.103	38%	0.384	C	S	.	.			trans	-138.2	149	172.4	67.3	-175.2	0	0	0	109.7	Y185 M212 R219	Y185-I215 HydrophobicContact CD1-CD1 3.6Å; Y185-I215 HydrophobicContact CD1-CG1 4.48Å; Y185-I215 HydrophobicContact CD2-CD1 4.03Å; Y185-I215 HydrophobicContact CE1-CD1 3.46Å; Y185-I215 VanDerWaalsContact CE1-CD1 3.46Å; Y185-I215 HydrophobicContact CE1-CG1 3.88Å; Y185-I215 HydrophobicContact CE2-CB 4.41Å; Y185-I215 HydrophobicContact CE2-CD1 3.86Å; Y185-I215 HydrophobicContact CE2-CG1 4.46Å; Y185-I215 HydrophobicContact CG-CD1 3.87Å; M212-I215 HydrophobicContact CB-CG2 3.69Å; I215-R219 HydrophobicContact CD1-CG 3.66Å; I215-R219 HydrophobicContact CG1-CG 4.31Å
216	P	80.4	Confident	88.2	Confident	72 Å²	72	70.2 Å²	70.2	47%	0.468	36%	0.363	S	S	.	.	S	Bend	trans	-71.3	138.2	-178.8	-19.7	33.5	0	0	0	113.2	W151 Y185	W151-P216 HydrophobicContact CD2-CB 4.32Å; W151-P216 HydrophobicContact CG-CB 4.11Å; Y185-P216 WeakPolarHBondContact CE1-O 3.45Å; Y185-P216 WeakPolarHBondContact OH-CD 3.46Å; Y185-P216 PolarHBondContact OH-O 2.81Å
217	G	78.2	Confident	88.5	Confident	50 Å²	50	65.9 Å²	65.9	52%	0.515	34%	0.337	S	S	.	.	S	Bend	trans	76.7	-173.1	179.7	0	0	0	0	0	113.6
218	K	86.2	Confident	88.8	Confident	162 Å²	162	60 Å²	60	70%	0.704	31%	0.311	S	S	*	.			trans	-89	129.4	-171.9	-166.4	174.3	179.5	174	0	111.8	W155	W155-K218 PolarHBondContact NE1-O 3.07Å
219	R	91.2	Very high	89	Confident	40 Å²	40	55.4 Å²	55.4	15%	0.151	29%	0.29	C	S	.	.			trans	-57.6	148.7	167.5	-71.4	166.1	-175.8	-92.9	-3.8	110.9	S184 S187 D188 P189 M212 S213 I215 G221	S184-R219 PolarHBondContact O-NH1 3.29Å; S187-R219 WeakPolarHBondContact O-CD 3.43Å; S187-R219 PolarHBondContact O-NH1 2.86Å; S187-R219 PolarHBondContact OG-NH1 3.39Å; S187-R219 VanDerWaalsContact OG-NH1 3.13Å; D188-R219 VanDerWaalsContact C-NH1 3.29Å; D188-R219 PolarHBondContact O-NH1 3.28Å; P189-R219 VanDerWaalsContact CA-CZ 3.41Å; M212-R219 PolarHBondContact O-NH2 3.43Å; S213-R219 PolarHBondContact O-NH2 3.02Å; I215-R219 HydrophobicContact CD1-CG 3.66Å; I215-R219 HydrophobicContact CG1-CG 4.31Å; R219-G221 PolarHBondContact O-N 2.81Å
220	Y	91.9	Very high	89.3	Confident	7 Å²	7	55 Å²	55	3%	0.027	29%	0.287	C	S	.	.			trans	-69.4	-24.5	173.9	-152.1	-122.7	0	0	0	112.1	W155 V158 T161 S163 L164 Y185 F186 K224 V226	W155-Y220 HydrophobicContact CH2-CD2 4.36Å; W155-Y220 HydrophobicContact CH2-CG 4.38Å; W155-Y220 HydrophobicContact CZ2-CD2 4.36Å; V158-Y220 WeakPolarHBondContact O-CE2 3.12Å; T161-Y220 PolarHBondContact O-OH 3.27Å; T161-Y220 PolarHBondContact OG1-OH 3.19Å; S163-Y220 WeakPolarHBondContact CA-OH 3.31Å; S163-Y220 PolarHBondContact N-OH 2.93Å; S163-Y220 PolarHBondContact O-OH 2.7Å; L164-Y220 HydrophobicContact CB-CE1 3.69Å; L164-Y220 HydrophobicContact CD2-CE1 4.45Å; L164-Y220 PolarHBondContact N-OH 2.84Å; Y185-Y220 VanDerWaalsContact O-CB 3.31Å; Y185-Y220 WeakPolarHBondContact O-CB 3.37Å; Y185-Y220 PolarHBondContact O-N 2.71Å; F186-Y220 HydrophobicContact CD1-CD1 4.04Å; F186-Y220 HydrophobicContact CD1-CG 4.32Å; F186-Y220 AromaticContact CE1-CD1 3.89Å; F186-Y220 HydrophobicContact CE1-CD1 3.89Å; F186-Y220 HydrophobicContact CE1-CG 4.1Å; Y220-K224 HydrophobicContact CD1-CB 3.85Å; Y220-K224 HydrophobicContact CD1-CD 4.22Å; Y220-K224 HydrophobicContact CD2-CD 3.99Å; Y220-K224 HydrophobicContact CE1-CB 3.38Å; Y220-K224 HydrophobicContact CE1-CD 3.85Å; Y220-K224 HydrophobicContact CE1-CG 4.28Å; Y220-K224 HydrophobicContact CE2-CD 3.57Å; Y220-K224 HydrophobicContact CG-CD 4.26Å; Y220-K224 VanDerWaalsContact CZ-CD 3.47Å; Y220-V226 HydrophobicContact CD1-CG2 3.75Å; Y220-V226 HydrophobicContact CE1-CG2 3.75Å
221	G	81.6	Confident	89.4	Confident	20 Å²	20	49.7 Å²	49.7	21%	0.206	27%	0.268	C	S	.	.			trans	74.4	171.7	-179.3	0	0	0	0	0	112.5	R219 R250	R219-G221 PolarHBondContact O-N 2.81Å; G221-R250 PolarHBondContact O-NH2 2.84Å
222	K	82.8	Confident	89.5	Confident	121 Å²	121	58.1 Å²	58.1	53%	0.526	30%	0.299	S	S	.	.	S	Bend	trans	-77.9	-29.9	-176.3	-69.5	174.9	176.3	160	0	114.9	D188	D188-K222 VanDerWaalsContact CG-CE 3.44Å; D188-K222 VanDerWaalsContact OD2-CD 3.27Å; D188-K222 WeakPolarHBondContact OD2-CD 3.48Å; D188-K222 WeakPolarHBondContact OD2-CE 3.38Å; D188-K222 IonicContact OD2-NZ 2.67Å; D188-K222 PolarHBondContact OD2-NZ 2.67Å
223	K	82.5	Confident	89.6	Confident	214 Å²	214	61.5 Å²	61.5	93%	0.93	31%	0.308	S	S	*	.	S	Bend	trans	-76.1	-22.6	-169.6	-65.8	-168.3	176.7	-170.5	0	116.2
224	K	89.9	Confident	90.1	Very high	58 Å²	58	58.6 Å²	58.6	25%	0.252	29%	0.288	S	S	.	.	S	Bend	trans	-82	133.1	-177.4	-65.8	-174.4	175.1	-167.4	0	110.9	A159 Q160 T161 Y220 R250	A159-K224 PolarHBondContact O-NZ 2.55Å; Q160-K224 PolarHBondContact O-NZ 2.78Å; T161-K224 WeakPolarHBondContact O-CD 3.42Å; T161-K224 VanDerWaalsContact O-CE 3.29Å; T161-K224 WeakPolarHBondContact O-CE 3.36Å; T161-K224 PolarHBondContact O-NZ 2.88Å; Y220-K224 HydrophobicContact CD1-CB 3.85Å; Y220-K224 HydrophobicContact CD1-CD 4.22Å; Y220-K224 HydrophobicContact CD2-CD 3.99Å; Y220-K224 HydrophobicContact CE1-CB 3.38Å; Y220-K224 HydrophobicContact CE1-CD 3.85Å; Y220-K224 HydrophobicContact CE1-CG 4.28Å; Y220-K224 HydrophobicContact CE2-CD 3.57Å; Y220-K224 HydrophobicContact CG-CD 4.26Å; Y220-K224 VanDerWaalsContact CZ-CD 3.47Å; K224-R250 VanDerWaalsContact O-CZ 3.28Å; K224-R250 PolarHBondContact O-NH1 3.09Å; K224-R250 PolarHBondContact O-NH2 3.49Å
225	D	90.3	Very high	90.4	Very high	41 Å²	41	57.8 Å²	57.8	22%	0.219	27%	0.274	C	S	.	.			trans	-61.2	139.3	177.9	-90.2	-20	0	0	0	112.2	S163 L164 L317 R320	S163-D225 CarbonylContact C-O 3.57Å; S163-D225 WeakPolarHBondContact CA-O 3.4Å; L164-D225 PolarHBondContact N-O 3.07Å; D225-L317 HydrophobicContact CB-CD2 3.67Å; D225-R320 VanDerWaalsContact CG-NE 3.26Å; D225-R320 IonicContact OD1-CZ 2.81Å; D225-R320 IonicContact OD1-NE 2.68Å; D225-R320 PolarHBondContact OD1-NE 3.07Å; D225-R320 VanDerWaalsContact OD1-NE 3.12Å; D225-R320 IonicContact OD1-NH2 2.81Å; D225-R320 PolarHBondContact OD1-NH2 3Å; D225-R320 IonicContact OD2-CZ 3.35Å; D225-R320 IonicContact OD2-NE 2.6Å; D225-R320 PolarHBondContact OD2-NE 3.2Å; D225-R320 IonicContact OD2-NH2 3.36Å
226	V	94	Very high	90.6	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.018	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	125.3	174.4	178.3	0	0	0	0	108.6	L164 F186 Y220 I228 A251 I252	L164-V226 HydrophobicContact CB-CG2 4.36Å; L164-V226 CarbonylContact O-C 3.58Å; L164-V226 WeakPolarHBondContact O-CA 3.45Å; F186-V226 HydrophobicContact CD1-CG2 3.89Å; F186-V226 HydrophobicContact CE1-CG1 4.46Å; F186-V226 HydrophobicContact CE1-CG2 3.89Å; Y220-V226 HydrophobicContact CD1-CG2 3.75Å; Y220-V226 HydrophobicContact CE1-CG2 3.75Å; V226-I228 HydrophobicContact CG1-CG1 4.4Å; V226-A251 HydrophobicContact CB-CB 4.03Å; V226-A251 HydrophobicContact CG1-CB 3.78Å; V226-A251 VanDerWaalsContact O-CA 3.24Å; V226-A251 WeakPolarHBondContact O-CA 3.26Å; V226-A251 WeakPolarHBondContact O-CB 3.4Å; V226-I252 PolarHBondContact O-N 3.01Å; V226-I252 VanDerWaalsContact O-N 3.14Å
227	I	95.6	Very high	91.2	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	134.4	170.5	-65.1	174.1	0	0	0	108	L164 I165 L166 L229 I252 V254 A313 L316 L317	L164-I227 PolarHBondContact O-N 2.95Å; I165-I227 CarbonylContact C-O 3.53Å; I165-I227 WeakPolarHBondContact CA-O 3.33Å; L166-I227 PolarHBondContact N-O 2.98Å; I227-L229 HydrophobicContact CG2-CD2 3.8Å; I227-I252 CarbonylContact C-O 3.5Å; I227-I252 WeakPolarHBondContact CA-O 3.44Å; I227-V254 HydrophobicContact CG2-CB 3.99Å; I227-V254 HydrophobicContact CG2-CG2 3.59Å; I227-A313 HydrophobicContact CD1-CB 3.88Å; I227-A313 WeakPolarHBondContact CD1-O 3.39Å; I227-A313 HydrophobicContact CG2-CB 3.85Å; I227-L316 HydrophobicContact CD1-CB 4.27Å; I227-L316 HydrophobicContact CD1-CD2 3.83Å; I227-L316 HydrophobicContact CD1-CG 4.28Å; I227-L316 HydrophobicContact CG1-CD2 4.39Å; I227-L317 HydrophobicContact CD1-CD1 4.17Å; I227-L317 HydrophobicContact CD1-CD2 3.86Å; I227-L317 HydrophobicContact CD1-CG 3.65Å; I227-L317 HydrophobicContact CG1-CD2 4.4Å
228	I	97.4	Very high	92	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	129.8	174.8	-57.6	176.9	0	0	0	108.9	L166 L168 V226 T230 A242 L245 A251 I252 I253 V254	L166-I228 HydrophobicContact CB-CG1 4.26Å; L166-I228 HydrophobicContact CD2-CD1 4.36Å; L166-I228 HydrophobicContact CD2-CG1 4.16Å; L166-I228 CarbonylContact O-C 3.48Å; L166-I228 VanDerWaalsContact O-CA 3.29Å; L166-I228 WeakPolarHBondContact O-CA 3.37Å; L168-I228 HydrophobicContact CD1-CG2 3.65Å; L168-I228 HydrophobicContact CG-CG2 4.02Å; V226-I228 HydrophobicContact CG1-CG1 4.4Å; I228-T230 HydrophobicContact CG2-CG2 4.37Å; I228-A242 HydrophobicContact CG2-CB 4.2Å; I228-L245 HydrophobicContact CD1-CB 3.76Å; I228-L245 HydrophobicContact CD1-CD1 3.69Å; I228-L245 HydrophobicContact CD1-CG 4.34Å; I228-A251 HydrophobicContact CD1-CB 3.71Å; I228-A251 HydrophobicContact CG1-CB 3.78Å; I228-I252 PolarHBondContact N-O 3.29Å; I228-I253 HydrophobicContact CB-CD1 3.73Å; I228-I253 HydrophobicContact CD1-CD1 3.83Å; I228-I253 HydrophobicContact CG1-CD1 4.13Å; I228-I253 HydrophobicContact CG2-CD1 4.36Å; I228-I253 WeakPolarHBondContact O-CA 3.21Å; I228-V254 PolarHBondContact O-N 3.47Å
229	L	98.1	Very high	92.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.7	176.7	-46.4	-175.2	0	0	0	111.3	I165 L166 D167 L168 R169 I227 V254 A309 V310 A313	I165-L229 HydrophobicContact CG2-CD1 3.63Å; I165-L229 HydrophobicContact CG2-CD2 4.11Å; I165-L229 HydrophobicContact CG2-CG 3.73Å; L166-L229 PolarHBondContact O-N 3.01Å; D167-L229 HydrophobicContact CB-CB 4.48Å; D167-L229 HydrophobicContact CB-CD1 4.22Å; L168-L229 CarbonylContact C-O 3.55Å; L168-L229 WeakPolarHBondContact CA-O 3.24Å; L168-L229 PolarHBondContact N-O 3.19Å; R169-L229 HydrophobicContact CG-CB 3.7Å; R169-L229 PolarHBondContact N-O 3.33Å; I227-L229 HydrophobicContact CG2-CD2 3.8Å; L229-V254 VanDerWaalsContact CA-O 3.29Å; L229-V254 WeakPolarHBondContact CA-O 3.36Å; L229-V254 HydrophobicContact CD2-CB 4.08Å; L229-A309 HydrophobicContact CD1-CB 4.5Å; L229-A309 HydrophobicContact CD2-CB 4.16Å; L229-V310 HydrophobicContact CD1-CB 4.45Å; L229-V310 HydrophobicContact CD1-CG2 3.49Å; L229-V310 VanDerWaalsContact CD1-CG2 3.49Å; L229-A313 HydrophobicContact CD2-CB 3.97Å
230	T	97.7	Very high	92.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	151	179.9	53.5	0	0	0	0	112.2	I228 T234 A242 I253 V254 E256	I228-T230 HydrophobicContact CG2-CG2 4.37Å; T230-T234 HydrophobicContact CG2-CG2 4.4Å; T230-A242 HydrophobicContact CG2-CB 4.28Å; T230-I253 HydrophobicContact CG2-CG2 3.65Å; T230-V254 PolarHBondContact N-O 3.15Å; T230-E256 WeakPolarHBondContact CB-O 3.25Å; T230-E256 PolarHBondContact O-N 3.37Å; T230-E256 PolarHBondContact OG1-O 3.27Å
231	S	97.1	Very high	92.7	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.021	19%	0.189	C	C	.	.			trans	-132.7	170.3	169	82.5	0	0	0	0	110.4	R169 R233 T234 E256 S258	R169-S231 PolarHBondContact O-OG 3.11Å; S231-R233 PolarHBondContact O-N 3.04Å; S231-R233 PolarHBondContact OG-N 3.45Å; S231-R233 VanDerWaalsContact OG-N 3.09Å; S231-T234 PolarHBondContact N-OG1 3.19Å; S231-T234 WeakPolarHBondContact O-CB 3.38Å; S231-T234 PolarHBondContact O-N 2.78Å; S231-T234 PolarHBondContact O-OG1 3.22Å; S231-E256 WeakPolarHBondContact CA-OE2 3.33Å; S231-S258 WeakPolarHBondContact O-CA 3.33Å
232	R	95.1	Very high	93.3	Very high	184 Å²	184	41 Å²	41	69%	0.694	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-7.5	170.1	-65.8	171.8	-166.7	-158.8	3	115.1	E256 R257	R232-E256 HydrophobicContact CG-CB 4.19Å; R232-E256 WeakPolarHBondContact CG-OE2 3.48Å; R232-E256 PolarHBondContact N-OE2 3.5Å; R232-R257 WeakPolarHBondContact CA-O 3.26Å; R232-R257 PolarHBondContact N-O 2.78Å
233	R	93.6	Very high	93.9	Very high	136 Å²	136	36.1 Å²	36.1	51%	0.513	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-10.4	176	-56.7	179.6	-58.7	-174.3	4.5	114	R169 Y170 T172 S231 M235	R169-R233 PolarHBondContact O-NH2 3.13Å; Y170-R233 VanDerWaalsContact CD1-NH2 3.3Å; T172-R233 HydrophobicContact CG2-CB 4.22Å; S231-R233 PolarHBondContact O-N 3.04Å; S231-R233 PolarHBondContact OG-N 3.45Å; S231-R233 VanDerWaalsContact OG-N 3.09Å; R233-M235 PolarHBondContact O-N 2.97Å
234	T	95.6	Very high	94.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	11%	0.114	C	C	.	.			trans	-63.9	121	175.4	-57	0	0	0	0	108.3	L168 N171 T230 S231 A238 E239 S258 A259	L168-T234 HydrophobicContact CB-CG2 4.06Å; L168-T234 PolarHBondContact O-OG1 3.13Å; N171-T234 CarbonylContact O-C 3.53Å; N171-T234 VanDerWaalsContact O-CA 3.3Å; N171-T234 WeakPolarHBondContact O-CA 3.38Å; T230-T234 HydrophobicContact CG2-CG2 4.4Å; S231-T234 PolarHBondContact N-OG1 3.19Å; S231-T234 WeakPolarHBondContact O-CB 3.38Å; S231-T234 PolarHBondContact O-N 2.78Å; S231-T234 PolarHBondContact O-OG1 3.22Å; T234-A238 HydrophobicContact CG2-CB 3.89Å; T234-E239 HydrophobicContact CG2-CG 4.39Å; T234-S258 WeakPolarHBondContact O-CB 3.38Å; T234-A259 VanDerWaalsContact O-CB 3.3Å; T234-A259 WeakPolarHBondContact O-CB 3.34Å; T234-A259 PolarHBondContact O-N 2.76Å
235	M	92.9	Very high	94.6	Very high	81 Å²	81	23.4 Å²	23.4	40%	0.399	10%	0.102	S	C	.	.			trans	-144.3	145.3	-169.8	-165.6	170.6	63.6	0	0	113.8	N171 T172 R233 E239 A259	N171-M235 PolarHBondContact O-N 3.45Å; T172-M235 WeakPolarHBondContact O-CE 3.22Å; R233-M235 PolarHBondContact O-N 2.97Å; M235-E239 WeakPolarHBondContact CA-OE2 3.44Å; M235-A259 HydrophobicContact CB-CB 3.92Å; M235-A259 HydrophobicContact CG-CB 3.97Å; M235-A259 HydrophobicContact SD-CB 4.22Å
236	G	90.9	Very high	94.7	Very high	15 Å²	15	24.4 Å²	24.4	16%	0.155	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	-128.2	169.9	0	0	0	0	0	113.3	A238 E239 A240	G236-A238 PolarHBondContact O-N 3.1Å; G236-A238 VanDerWaalsContact O-N 3.07Å; G236-E239 PolarHBondContact N-OE2 2.63Å; G236-E239 WeakPolarHBondContact O-CA 3.42Å; G236-E239 VanDerWaalsContact O-CB 3.28Å; G236-E239 WeakPolarHBondContact O-CB 3.42Å; G236-E239 PolarHBondContact O-N 3.37Å; G236-A240 PolarHBondContact O-N 2.79Å
237	A	92.2	Very high	94.6	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.008	12%	0.119	C	C	.	.	H	α-helix	trans	-57.6	-26.3	-176.3	0	0	0	0	0	114.3	I137 G174 L176 V179 A240 V241	I137-A237 HydrophobicContact CB-CB 3.83Å; I137-A237 HydrophobicContact CG1-CB 3.76Å; I137-A237 HydrophobicContact CG2-CB 4.08Å; G174-A237 WeakPolarHBondContact O-CB 3.3Å; L176-A237 HydrophobicContact CD2-CB 4.04Å; V179-A237 HydrophobicContact CG2-CB 4.03Å; A237-A240 PolarHBondContact O-N 2.92Å; A237-V241 WeakPolarHBondContact O-CG2 3.16Å; A237-V241 PolarHBondContact O-N 3.04Å; A237-V241 VanDerWaalsContact O-N 3.1Å
238	A	94.9	Very high	94.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-72.1	-29.5	172.2	0	0	0	0	0	113.5	I137 L168 N171 T234 G236 A242	I137-A238 HydrophobicContact CD1-CB 4.35Å; I137-A238 HydrophobicContact CG1-CB 4.32Å; L168-A238 HydrophobicContact CB-CB 4.44Å; L168-A238 HydrophobicContact CD1-CB 4.21Å; N171-A238 HydrophobicContact CB-CB 3.73Å; N171-A238 VanDerWaalsContact CG-CB 3.44Å; N171-A238 WeakPolarHBondContact OD1-CB 3.47Å; T234-A238 HydrophobicContact CG2-CB 3.89Å; G236-A238 PolarHBondContact O-N 3.1Å; G236-A238 VanDerWaalsContact O-N 3.07Å; A238-A242 WeakPolarHBondContact O-CB 3.4Å; A238-A242 PolarHBondContact O-N 3.05Å
239	E	95.3	Very high	93.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-69.4	-41.7	171.3	-59.1	-175.4	99.7	0	0	110.3	T234 M235 G236 V241 A242 Y243 S258 A259 G260 G261 W293 V298	T234-E239 HydrophobicContact CG2-CG 4.39Å; M235-E239 WeakPolarHBondContact CA-OE2 3.44Å; G236-E239 PolarHBondContact N-OE2 2.63Å; G236-E239 WeakPolarHBondContact O-CA 3.42Å; G236-E239 VanDerWaalsContact O-CB 3.28Å; G236-E239 WeakPolarHBondContact O-CB 3.42Å; G236-E239 PolarHBondContact O-N 3.37Å; E239-V241 PolarHBondContact O-N 2.97Å; E239-A242 PolarHBondContact O-N 2.99Å; E239-Y243 WeakPolarHBondContact O-CB 3.26Å; E239-Y243 PolarHBondContact O-N 3.13Å; E239-S258 VanDerWaalsContact OE1-CB 3.28Å; E239-S258 WeakPolarHBondContact OE1-CB 3.46Å; E239-S258 PolarHBondContact OE1-OG 3.3Å; E239-A259 PolarHBondContact OE1-N 3.5Å; E239-G260 PolarHBondContact OE1-N 3.16Å; E239-G261 WeakPolarHBondContact OE2-CA 3.33Å; E239-G261 PolarHBondContact OE2-N 2.88Å; E239-W293 HydrophobicContact CB-CB 4.44Å; E239-W293 HydrophobicContact CB-CD2 3.91Å; E239-W293 HydrophobicContact CB-CE3 3.48Å; E239-W293 VanDerWaalsContact CB-CE3 3.48Å; E239-W293 HydrophobicContact CB-CG 4.31Å; E239-W293 HydrophobicContact CB-CZ3 4.07Å; E239-W293 HydrophobicContact CG-CE3 4.28Å; E239-W293 WeakPolarHBondContact OE2-CZ3 3.21Å; E239-V298 HydrophobicContact CB-CG2 4.01Å; E239-V298 VanDerWaalsContact O-CG2 3.32Å; E239-V298 WeakPolarHBondContact O-CG2 3.46Å
240	A	93.3	Very high	93.6	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-58.3	-45.1	172.9	0	0	0	0	0	112.1	L176 V179 G236 A237 Y243 T244 W293	L176-A240 HydrophobicContact CD2-CB 4.1Å; V179-A240 HydrophobicContact CG1-CB 4.4Å; V179-A240 HydrophobicContact CG2-CB 4.15Å; G236-A240 PolarHBondContact O-N 2.79Å; A237-A240 PolarHBondContact O-N 2.92Å; A240-Y243 PolarHBondContact O-N 3.26Å; A240-T244 WeakPolarHBondContact O-CB 3.28Å; A240-T244 PolarHBondContact O-N 3.03Å; A240-T244 PolarHBondContact O-OG1 3.43Å; A240-T244 VanDerWaalsContact O-OG1 3.13Å; A240-W293 HydrophobicContact CB-CZ2 4.3Å
241	V	95.1	Very high	93.3	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.1	-49.7	174.5	170.6	0	0	0	0	111.7	L166 L168 V179 I182 I183 A237 E239 L245	L166-V241 HydrophobicContact CD2-CG1 4.46Å; L168-V241 HydrophobicContact CD1-CG1 4.29Å; V179-V241 HydrophobicContact CB-CG2 4.42Å; V179-V241 HydrophobicContact CG1-CG2 3.97Å; V179-V241 HydrophobicContact CG2-CG2 4.16Å; I182-V241 HydrophobicContact CB-CG2 4.34Å; I182-V241 HydrophobicContact CD1-CG2 4.25Å; I182-V241 HydrophobicContact CG2-CG1 3.92Å; I182-V241 HydrophobicContact CG2-CG2 4.2Å; I183-V241 HydrophobicContact CD1-CG1 4.47Å; A237-V241 WeakPolarHBondContact O-CG2 3.16Å; A237-V241 PolarHBondContact O-N 3.04Å; A237-V241 VanDerWaalsContact O-N 3.1Å; E239-V241 PolarHBondContact O-N 2.97Å; V241-L245 HydrophobicContact CG1-CD1 3.88Å; V241-L245 WeakPolarHBondContact O-CB 3.21Å; V241-L245 WeakPolarHBondContact O-CG 3.44Å; V241-L245 PolarHBondContact O-N 3.45Å
242	A	95.6	Very high	93.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65.5	-39.7	-178.8	0	0	0	0	0	112.3	L168 I228 T230 A238 E239 K246 I253 V298	L168-A242 HydrophobicContact CD1-CB 4.49Å; I228-A242 HydrophobicContact CG2-CB 4.2Å; T230-A242 HydrophobicContact CG2-CB 4.28Å; A238-A242 WeakPolarHBondContact O-CB 3.4Å; A238-A242 PolarHBondContact O-N 3.05Å; E239-A242 PolarHBondContact O-N 2.99Å; A242-K246 VanDerWaalsContact O-CB 3.29Å; A242-K246 WeakPolarHBondContact O-CB 3.39Å; A242-K246 PolarHBondContact O-N 3.01Å; A242-I253 HydrophobicContact CB-CD1 4.4Å; A242-V298 HydrophobicContact CB-CG1 4.27Å; A242-V298 HydrophobicContact CB-CG2 4.25Å
243	Y	94.9	Very high	93.1	Very high	19 Å²	19	29.5 Å²	29.5	8%	0.075	14%	0.135	C	C	.	.	H	α-helix	trans	-64.5	-52.3	177.3	-169	-93.7	0	0	0	111.1	E239 A240 L245 K246 K247 N286 T289 Q291 W293 V298	E239-Y243 WeakPolarHBondContact O-CB 3.26Å; E239-Y243 PolarHBondContact O-N 3.13Å; A240-Y243 PolarHBondContact O-N 3.26Å; Y243-L245 PolarHBondContact O-N 3.13Å; Y243-K246 PolarHBondContact O-N 2.85Å; Y243-K247 HydrophobicContact CD1-CG 3.98Å; Y243-K247 HydrophobicContact CE1-CD 4.49Å; Y243-K247 HydrophobicContact CE1-CG 3.72Å; Y243-K247 WeakPolarHBondContact O-CG 3.18Å; Y243-K247 PolarHBondContact O-N 3.04Å; Y243-K247 WeakPolarHBondContact OH-CE 3.37Å; Y243-N286 HydrophobicContact CD1-CB 4.31Å; Y243-N286 HydrophobicContact CE1-CB 3.69Å; Y243-T289 PolarHBondContact OH-OG1 2.8Å; Y243-Q291 WeakPolarHBondContact OH-CB 3.47Å; Y243-W293 HydrophobicContact CD2-CB 3.79Å; Y243-W293 HydrophobicContact CE2-CB 4.47Å; Y243-W293 HydrophobicContact CG-CB 3.9Å; Y243-V298 HydrophobicContact CD2-CG2 4.3Å
244	T	93.6	Very high	93.2	Very high	4 Å²	4	23 Å²	23	3%	0.025	11%	0.11	C	C	.	.	H	α-helix	trans	-63.6	-44.2	-178.3	-60.3	0	0	0	0	111.6	I183 I195 A240 K246 K247 L248	I183-T244 HydrophobicContact CD1-CG2 4.07Å; I183-T244 HydrophobicContact CG1-CG2 4.44Å; I183-T244 HydrophobicContact CG2-CG2 4.49Å; I195-T244 HydrophobicContact CG2-CG2 4.08Å; A240-T244 WeakPolarHBondContact O-CB 3.28Å; A240-T244 PolarHBondContact O-N 3.03Å; A240-T244 PolarHBondContact O-OG1 3.43Å; A240-T244 VanDerWaalsContact O-OG1 3.13Å; T244-K246 VanDerWaalsContact C-N 3.31Å; T244-K246 PolarHBondContact O-N 2.92Å; T244-K247 PolarHBondContact O-N 3.44Å; T244-L248 HydrophobicContact CG2-CD1 3.7Å; T244-L248 HydrophobicContact CG2-CG 4.15Å; T244-L248 WeakPolarHBondContact O-CB 3.36Å; T244-L248 WeakPolarHBondContact O-CG 3.32Å; T244-L248 PolarHBondContact O-N 3.36Å
245	L	93.4	Very high	93.3	Very high	1 Å²	1	23 Å²	23	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-68.9	-27.3	177.9	-65.8	175	0	0	0	112.9	I183 F186 I228 V241 Y243 R250 A251	I183-L245 HydrophobicContact CD1-CD1 4.12Å; I183-L245 HydrophobicContact CD1-CD2 3.76Å; I183-L245 HydrophobicContact CD1-CG 3.58Å; F186-L245 HydrophobicContact CB-CD2 3.94Å; F186-L245 HydrophobicContact CD2-CD1 3.93Å; F186-L245 HydrophobicContact CD2-CD2 4.39Å; F186-L245 HydrophobicContact CE2-CD1 4.4Å; F186-L245 HydrophobicContact CG-CD2 4.45Å; I228-L245 HydrophobicContact CD1-CB 3.76Å; I228-L245 HydrophobicContact CD1-CD1 3.69Å; I228-L245 HydrophobicContact CD1-CG 4.34Å; V241-L245 HydrophobicContact CG1-CD1 3.88Å; V241-L245 WeakPolarHBondContact O-CB 3.21Å; V241-L245 WeakPolarHBondContact O-CG 3.44Å; V241-L245 PolarHBondContact O-N 3.45Å; Y243-L245 PolarHBondContact O-N 3.13Å; L245-R250 HydrophobicContact CD2-CB 4.07Å; L245-R250 HydrophobicContact CD2-CG 3.9Å; L245-R250 PolarHBondContact O-N 2.84Å; L245-A251 HydrophobicContact CB-CB 4.01Å; L245-A251 PolarHBondContact O-N 2.86Å
246	K	92.4	Very high	93.4	Very high	62 Å²	62	20.7 Å²	20.7	27%	0.27	10%	0.098	S	C	.	.	H	α-helix	trans	-68.5	-48.5	168.6	-166	-177.1	-166.2	-179.2	0	111.7	A242 Y243 T244 K249 I253 S299 P300 T301	A242-K246 VanDerWaalsContact O-CB 3.29Å; A242-K246 WeakPolarHBondContact O-CB 3.39Å; A242-K246 PolarHBondContact O-N 3.01Å; Y243-K246 PolarHBondContact O-N 2.85Å; T244-K246 VanDerWaalsContact C-N 3.31Å; T244-K246 PolarHBondContact O-N 2.92Å; K246-K249 PolarHBondContact O-N 3.28Å; K246-K249 VanDerWaalsContact O-N 3.07Å; K246-I253 HydrophobicContact CB-CD1 4.09Å; K246-I253 HydrophobicContact CB-CG1 3.85Å; K246-I253 HydrophobicContact CD-CG1 3.82Å; K246-I253 HydrophobicContact CG-CG1 3.88Å; K246-S299 PolarHBondContact NZ-O 3.37Å; K246-P300 VanDerWaalsContact NZ-C 3.34Å; K246-P300 PolarHBondContact NZ-O 3.47Å; K246-T301 VanDerWaalsContact CE-OG1 3.29Å; K246-T301 WeakPolarHBondContact CE-OG1 3.3Å
247	K	91.8	Very high	93.7	Very high	75 Å²	75	25.9 Å²	25.9	33%	0.326	11%	0.113	S	C	.	.	H	α-helix	trans	-70.5	-31.3	-176.7	-66.1	-61.8	-168.9	161.2	0	113.2	Y243 T244 K249 I288 T289	Y243-K247 HydrophobicContact CD1-CG 3.98Å; Y243-K247 HydrophobicContact CE1-CD 4.49Å; Y243-K247 HydrophobicContact CE1-CG 3.72Å; Y243-K247 WeakPolarHBondContact O-CG 3.18Å; Y243-K247 PolarHBondContact O-N 3.04Å; Y243-K247 WeakPolarHBondContact OH-CE 3.37Å; T244-K247 PolarHBondContact O-N 3.44Å; K247-K249 PolarHBondContact O-N 2.97Å; K247-I288 HydrophobicContact CB-CD1 4.24Å; K247-T289 HydrophobicContact CD-CG2 3.71Å; K247-T289 HydrophobicContact CG-CG2 4.22Å
248	L	88.9	Confident	93.9	Very high	54 Å²	54	26.2 Å²	26.2	28%	0.283	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	4.7	168.9	-71.4	173.9	0	0	0	113.9	I183 I193 T244 R250 I288	I183-L248 HydrophobicContact CG2-CD1 4.29Å; I193-L248 HydrophobicContact CD1-CD1 4.39Å; I193-L248 HydrophobicContact CD1-CD2 4.37Å; I193-L248 HydrophobicContact CG2-CD1 4.31Å; I193-L248 HydrophobicContact CG2-CD2 3.94Å; T244-L248 HydrophobicContact CG2-CD1 3.7Å; T244-L248 HydrophobicContact CG2-CG 4.15Å; T244-L248 WeakPolarHBondContact O-CB 3.36Å; T244-L248 WeakPolarHBondContact O-CG 3.32Å; T244-L248 PolarHBondContact O-N 3.36Å; L248-R250 HydrophobicContact CB-CB 4.16Å; L248-R250 PolarHBondContact O-N 2.79Å; L248-I288 HydrophobicContact CD2-CD1 3.59Å; L248-I288 HydrophobicContact CG-CD1 4Å
249	K	89.7	Confident	93.7	Very high	130 Å²	130	28.4 Å²	28.4	57%	0.565	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	23.6	-169.9	-67.8	-163.1	-179.8	-168.1	0	113.6	K246 K247 D355 L357	K246-K249 PolarHBondContact O-N 3.28Å; K246-K249 VanDerWaalsContact O-N 3.07Å; K247-K249 PolarHBondContact O-N 2.97Å; K249-D355 IonicContact NZ-OD2 2.69Å; K249-D355 PolarHBondContact NZ-OD2 3.23Å; K249-L357 HydrophobicContact CB-CD1 3.75Å; K249-L357 HydrophobicContact CD-CD1 4.21Å; K249-L357 HydrophobicContact CG-CD1 4.34Å; K249-L357 WeakPolarHBondContact O-CD1 3.48Å
250	R	91.3	Very high	93.4	Very high	28 Å²	28	29.1 Å²	29.1	11%	0.106	14%	0.141	C	C	.	.			trans	-87.7	-27.4	-172.7	-179	58.9	-165.3	100.1	-11.6	112.9	F186 G221 K224 L245 L248	F186-R250 HydrophobicContact CB-CG 4.03Å; F186-R250 PolarHBondContact O-NE 2.9Å; G221-R250 PolarHBondContact O-NH2 2.84Å; K224-R250 VanDerWaalsContact O-CZ 3.28Å; K224-R250 PolarHBondContact O-NH1 3.09Å; K224-R250 PolarHBondContact O-NH2 3.49Å; L245-R250 HydrophobicContact CD2-CB 4.07Å; L245-R250 HydrophobicContact CD2-CG 3.9Å; L245-R250 PolarHBondContact O-N 2.84Å; L248-R250 HydrophobicContact CB-CB 4.16Å; L248-R250 PolarHBondContact O-N 2.79Å
251	A	92.6	Very high	93.1	Very high	7 Å²	7	29.5 Å²	29.5	6%	0.058	15%	0.145	C	C	.	.			trans	-142.3	145.6	179.6	0	0	0	0	0	113.4	V226 I228 L245	V226-A251 HydrophobicContact CB-CB 4.03Å; V226-A251 HydrophobicContact CG1-CB 3.78Å; V226-A251 VanDerWaalsContact O-CA 3.24Å; V226-A251 WeakPolarHBondContact O-CA 3.26Å; V226-A251 WeakPolarHBondContact O-CB 3.4Å; I228-A251 HydrophobicContact CD1-CB 3.71Å; I228-A251 HydrophobicContact CG1-CB 3.78Å; L245-A251 HydrophobicContact CB-CB 4.01Å; L245-A251 PolarHBondContact O-N 2.86Å
252	I	92.2	Very high	92.8	Very high	6 Å²	6	31.3 Å²	31.3	3%	0.031	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	130.9	173.6	-55.9	174.8	0	0	0	108.3	V226 I227 I228 V254 T301 L316 L357	V226-I252 PolarHBondContact O-N 3.01Å; V226-I252 VanDerWaalsContact O-N 3.14Å; I227-I252 CarbonylContact C-O 3.5Å; I227-I252 WeakPolarHBondContact CA-O 3.44Å; I228-I252 PolarHBondContact N-O 3.29Å; I252-V254 HydrophobicContact CG2-CG2 4.14Å; I252-T301 HydrophobicContact CG2-CG2 4.08Å; I252-L316 HydrophobicContact CB-CD2 4.41Å; I252-L316 HydrophobicContact CD1-CD2 3.89Å; I252-L316 HydrophobicContact CG2-CD2 3.94Å; I252-L357 HydrophobicContact CD1-CD2 4.26Å; I252-L357 HydrophobicContact CG1-CD2 4.19Å
253	I	95.6	Very high	92.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	125.3	-179.7	-43.6	-55.6	0	0	0	109.1	I228 T230 A242 K246 P300 T301 I302	I228-I253 HydrophobicContact CB-CD1 3.73Å; I228-I253 HydrophobicContact CD1-CD1 3.83Å; I228-I253 HydrophobicContact CG1-CD1 4.13Å; I228-I253 HydrophobicContact CG2-CD1 4.36Å; I228-I253 WeakPolarHBondContact O-CA 3.21Å; T230-I253 HydrophobicContact CG2-CG2 3.65Å; A242-I253 HydrophobicContact CB-CD1 4.4Å; K246-I253 HydrophobicContact CB-CD1 4.09Å; K246-I253 HydrophobicContact CB-CG1 3.85Å; K246-I253 HydrophobicContact CD-CG1 3.82Å; K246-I253 HydrophobicContact CG-CG1 3.88Å; I253-P300 HydrophobicContact CG2-CB 4.36Å; I253-T301 PolarHBondContact N-OG1 2.78Å; I253-T301 WeakPolarHBondContact O-CA 3.32Å; I253-T301 WeakPolarHBondContact O-CB 3.27Å; I253-T301 PolarHBondContact O-N 3.01Å; I253-I302 PolarHBondContact O-N 3.02Å
254	V	95.9	Very high	92.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	127.6	-175.2	-178.6	0	0	0	0	110.1	I227 I228 L229 T230 I252 I302 V304 A309 K312 L316	I227-V254 HydrophobicContact CG2-CB 3.99Å; I227-V254 HydrophobicContact CG2-CG2 3.59Å; I228-V254 PolarHBondContact O-N 3.47Å; L229-V254 VanDerWaalsContact CA-O 3.29Å; L229-V254 WeakPolarHBondContact CA-O 3.36Å; L229-V254 HydrophobicContact CD2-CB 4.08Å; T230-V254 PolarHBondContact N-O 3.15Å; I252-V254 HydrophobicContact CG2-CG2 4.14Å; V254-I302 WeakPolarHBondContact CA-O 3.46Å; V254-I302 HydrophobicContact CG1-CB 4.49Å; V254-I302 HydrophobicContact CG2-CB 4.26Å; V254-I302 HydrophobicContact CG2-CD1 4.4Å; V254-V304 HydrophobicContact CG1-CG2 3.84Å; V254-A309 HydrophobicContact CG1-CB 4.32Å; V254-K312 HydrophobicContact CG1-CB 4.2Å; V254-K312 HydrophobicContact CG1-CG 4.26Å; V254-L316 HydrophobicContact CG2-CD2 4.36Å
255	G	95.8	Very high	92.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	130.8	-139.6	-176.1	0	0	0	0	0	111.6	P300 I302 N303 V304	G255-P300 WeakPolarHBondContact O-CG 3.43Å; G255-I302 PolarHBondContact N-O 3.07Å; G255-N303 WeakPolarHBondContact O-CA 3.48Å; G255-V304 CarbonylContact C-O 3.49Å; G255-V304 WeakPolarHBondContact CA-O 3.48Å; G255-V304 PolarHBondContact O-N 3.43Å; G255-V304 VanDerWaalsContact O-O 3.08Å
256	E	96.4	Very high	92	Very high	31 Å²	31	42.6 Å²	42.6	15%	0.145	22%	0.217	C	C	.	.	S	Bend	trans	-104.1	162.9	-175.5	-51.9	162.8	170.2	0	0	111.1	T230 S231 R232 S258 A306	T230-E256 WeakPolarHBondContact CB-O 3.25Å; T230-E256 PolarHBondContact O-N 3.37Å; T230-E256 PolarHBondContact OG1-O 3.27Å; S231-E256 WeakPolarHBondContact CA-OE2 3.33Å; R232-E256 HydrophobicContact CG-CB 4.19Å; R232-E256 WeakPolarHBondContact CG-OE2 3.48Å; R232-E256 PolarHBondContact N-OE2 3.5Å; E256-S258 PolarHBondContact O-N 2.77Å; E256-A306 VanDerWaalsContact CD-CB 3.45Å; E256-A306 HydrophobicContact CG-CB 4.04Å; E256-A306 WeakPolarHBondContact OE1-CB 3.46Å; E256-A306 PolarHBondContact OE1-N 2.87Å
257	R	96.4	Very high	91.9	Very high	125 Å²	125	44 Å²	44	47%	0.472	22%	0.223	S	C	.	.			trans	-57.2	135.2	165.8	-178.5	-172.5	-75	-99.7	5.3	109.8	R232 S296 V298 S299	R232-R257 WeakPolarHBondContact CA-O 3.26Å; R232-R257 PolarHBondContact N-O 2.78Å; R257-S296 WeakPolarHBondContact CD-O 3.17Å; R257-S296 PolarHBondContact NH1-O 2.87Å; R257-V298 WeakPolarHBondContact CA-O 3.23Å; R257-S299 PolarHBondContact NH1-OG 2.87Å; R257-S299 PolarHBondContact NH2-OG 2.83Å; R257-S299 VanDerWaalsContact NH2-OG 3.16Å
258	S	96.1	Very high	91.8	Very high	7 Å²	7	41.9 Å²	41.9	5%	0.049	21%	0.214	C	C	.	.			trans	-73.5	175.2	178.3	71.8	0	0	0	0	113	S231 T234 E239 E256 G260 G297 V298	S231-S258 WeakPolarHBondContact O-CA 3.33Å; T234-S258 WeakPolarHBondContact O-CB 3.38Å; E239-S258 VanDerWaalsContact OE1-CB 3.28Å; E239-S258 WeakPolarHBondContact OE1-CB 3.46Å; E239-S258 PolarHBondContact OE1-OG 3.3Å; E256-S258 PolarHBondContact O-N 2.77Å; S258-G260 PolarHBondContact O-N 2.97Å; S258-G297 WeakPolarHBondContact OG-CA 3.48Å; S258-V298 PolarHBondContact N-O 3.03Å; S258-V298 VanDerWaalsContact N-O 3.09Å; S258-V298 PolarHBondContact OG-N 3.24Å
259	A	92	Very high	91.8	Very high	46 Å²	46	45 Å²	45	38%	0.38	22%	0.223	S	C	.	.			trans	-68.1	-25.5	-165.6	0	0	0	0	0	115.4	T234 M235 E239	T234-A259 VanDerWaalsContact O-CB 3.3Å; T234-A259 WeakPolarHBondContact O-CB 3.34Å; T234-A259 PolarHBondContact O-N 2.76Å; M235-A259 HydrophobicContact CB-CB 3.92Å; M235-A259 HydrophobicContact CG-CB 3.97Å; M235-A259 HydrophobicContact SD-CB 4.22Å; E239-A259 PolarHBondContact OE1-N 3.5Å
260	G	88.9	Confident	91.8	Very high	15 Å²	15	38.9 Å²	38.9	16%	0.155	20%	0.196	C	C	.	.			trans	77.4	53.4	-175.1	0	0	0	0	0	112.7	E239 S258 V295	E239-G260 PolarHBondContact OE1-N 3.16Å; S258-G260 PolarHBondContact O-N 2.97Å; G260-V295 VanDerWaalsContact O-CA 3.3Å; G260-V295 WeakPolarHBondContact O-CA 3.41Å; G260-V295 PolarHBondContact O-N 3.26Å
261	G	87.4	Confident	91.3	Very high	10 Å²	10	40 Å²	40	10%	0.103	21%	0.212	C	C	.	.			trans	-66.9	-159.7	-179.2	0	0	0	0	0	114.9	E239 E294 V295	E239-G261 WeakPolarHBondContact OE2-CA 3.33Å; E239-G261 PolarHBondContact OE2-N 2.88Å; G261-E294 VanDerWaalsContact O-CA 3.25Å; G261-E294 WeakPolarHBondContact O-CA 3.33Å; G261-E294 WeakPolarHBondContact O-CB 3.42Å; G261-V295 PolarHBondContact O-N 3.4Å
262	S	88.8	Confident	90.6	Very high	37 Å²	37	48.7 Å²	48.7	26%	0.259	25%	0.251	S	S	.	.			trans	-149.1	150.8	175.2	-72.1	0	0	0	0	111.6	R87 E294	R87-S262 WeakPolarHBondContact CD-OG 3.48Å; R87-S262 PolarHBondContact NH1-OG 3.21Å; S262-E294 VanDerWaalsContact CA-OE1 3.3Å; S262-E294 WeakPolarHBondContact CA-OE1 3.32Å
263	V	88.8	Confident	90.2	Very high	29 Å²	29	49.2 Å²	49.2	18%	0.176	26%	0.255	C	S	.	.	S	Bend	trans	-66.1	-50.1	-179.7	168	0	0	0	0	111.2	L176 I198 A282 W293 E294	L176-V263 HydrophobicContact CD1-CB 4.25Å; L176-V263 HydrophobicContact CD1-CG1 3.75Å; L176-V263 HydrophobicContact CD1-CG2 4.03Å; I198-V263 HydrophobicContact CG2-CG1 3.85Å; V263-A282 HydrophobicContact CG1-CB 3.89Å; V263-W293 HydrophobicContact CG2-CH2 4.3Å; V263-W293 HydrophobicContact CG2-CZ2 3.76Å; V263-E294 HydrophobicContact CG2-CG 4.36Å; V263-E294 PolarHBondContact N-OE1 3.48Å
264	K	89.9	Confident	89.8	Confident	79 Å²	79	51.4 Å²	51.4	34%	0.343	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	118.1	178.1	-170.4	-179.4	159	-164.6	0	111.3	D200 V281 A282	D200-K264 IonicContact OD1-NZ 2.72Å; D200-K264 WeakPolarHBondContact OD2-CD 3.29Å; D200-K264 IonicContact OD2-NZ 3.67Å; D200-K264 PolarHBondContact OD2-NZ 2.86Å; K264-V281 HydrophobicContact CB-CG2 4.16Å; K264-V281 HydrophobicContact CD-CG2 3.67Å; K264-V281 HydrophobicContact CG-CG2 3.65Å; K264-V281 PolarHBondContact O-N 3.03Å; K264-A282 HydrophobicContact CB-CB 3.79Å; K264-A282 HydrophobicContact CD-CB 4.43Å; K264-A282 PolarHBondContact O-N 3.48Å
265	V	90.3	Very high	89.5	Confident	79 Å²	79	52 Å²	52	48%	0.479	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	142.5	166.9	-66.2	0	0	0	0	109.9	T278 V279 P280	V265-T278 HydrophobicContact CB-CG2 4.23Å; V265-V279 CarbonylContact C-O 3.3Å; V265-V279 WeakPolarHBondContact CA-O 3.5Å; V265-P280 HydrophobicContact CG1-CB 4.26Å
266	Q	91.1	Very high	89.3	Confident	75 Å²	75	53.5 Å²	53.5	35%	0.35	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	132.4	180	-173	172.6	-23.5	0	0	110.2	I268 T278 V279 V281	Q266-I268 HydrophobicContact CG-CG1 4.03Å; Q266-T278 WeakPolarHBondContact O-CA 3.29Å; Q266-V279 PolarHBondContact N-O 3.07Å; Q266-V279 PolarHBondContact O-N 2.99Å; Q266-V281 HydrophobicContact CB-CG1 3.71Å; Q266-V281 HydrophobicContact CB-CG2 3.94Å
267	K	90.4	Very high	89	Confident	92 Å²	92	52 Å²	52	40%	0.4	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	114.5	175.2	-164.6	-175.7	-169.3	-177	0	109.4	E93 Y276	E93-K267 IonicContact OE1-NZ 3.3Å; E93-K267 PolarHBondContact OE1-NZ 3.42Å; E93-K267 IonicContact OE2-NZ 3.34Å; E93-K267 PolarHBondContact OE2-NZ 3.16Å; K267-Y276 HydrophobicContact CD-CD1 4.33Å; K267-Y276 HydrophobicContact CG-CD1 4.1Å; K267-Y276 HydrophobicContact CG-CG 4.47Å
268	I	89.9	Confident	88.9	Confident	29 Å²	29	47.4 Å²	47.4	15%	0.149	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	129.2	-172.6	-56.6	175.8	0	0	0	108.5	I35 N39 Q266 Y276 I277 V279	I35-I268 HydrophobicContact CD1-CG2 4.09Å; I35-I268 HydrophobicContact CG1-CG2 4.32Å; I35-I268 HydrophobicContact CG2-CB 4.15Å; I35-I268 HydrophobicContact CG2-CD1 3.78Å; I35-I268 HydrophobicContact CG2-CG2 3.98Å; N39-I268 HydrophobicContact CB-CD1 3.87Å; Q266-I268 HydrophobicContact CG-CG1 4.03Å; I268-Y276 CarbonylContact O-C 3.59Å; I268-Y276 VanDerWaalsContact O-CA 3.28Å; I268-Y276 WeakPolarHBondContact O-CA 3.45Å; I268-I277 HydrophobicContact CB-CG2 4.44Å; I268-I277 PolarHBondContact N-O 2.7Å; I268-I277 PolarHBondContact O-N 2.88Å; I268-V279 HydrophobicContact CD1-CG2 4.48Å
269	R	89.3	Confident	88.7	Confident	121 Å²	121	47 Å²	47	46%	0.457	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	130.8	174.7	-169.3	178.4	178.6	164.8	6	109.6	S273 D274 Y276	R269-S273 PolarHBondContact NE-O 3.05Å; R269-S273 PolarHBondContact NH2-O 3.04Å; R269-D274 IonicContact NH2-OD1 3.5Å; R269-D274 PolarHBondContact NH2-OD1 3.47Å; R269-Y276 HydrophobicContact CB-CD1 3.83Å; R269-Y276 HydrophobicContact CB-CE1 3.53Å; R269-Y276 HydrophobicContact CB-CG 4.49Å; R269-Y276 HydrophobicContact CG-CD1 4.31Å; R269-Y276 HydrophobicContact CG-CE1 3.9Å; R269-Y276 HydrophobicContact CG-CE2 4.09Å
270	I	87.9	Confident	88.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-78.8	129.1	175.1	-62.3	150.1	0	0	0	108.4	L28 E31 I32 I35 V90 S273 F275 I277	L28-I270 HydrophobicContact CD1-CB 4.48Å; L28-I270 HydrophobicContact CD1-CG2 3.73Å; E31-I270 HydrophobicContact CB-CG2 3.85Å; I32-I270 HydrophobicContact CD1-CD1 3.91Å; I32-I270 HydrophobicContact CG1-CD1 3.5Å; I32-I270 HydrophobicContact CG1-CG1 3.98Å; I32-I270 HydrophobicContact CG1-CG2 4.47Å; I35-I270 HydrophobicContact CD1-CB 4.32Å; I35-I270 HydrophobicContact CD1-CG1 3.82Å; V90-I270 HydrophobicContact CG1-CD1 4.48Å; I270-S273 PolarHBondContact O-N 2.74Å; I270-S273 PolarHBondContact O-OG 3.16Å; I270-F275 HydrophobicContact CB-CB 4.39Å; I270-F275 HydrophobicContact CD1-CB 3.68Å; I270-F275 PolarHBondContact N-O 3.48Å; I270-I277 HydrophobicContact CD1-CB 4.21Å; I270-I277 HydrophobicContact CD1-CG2 4.33Å; I270-I277 HydrophobicContact CG1-CG2 4.09Å
271	A	80.7	Confident	89	Confident	53 Å²	53	44.1 Å²	44.1	44%	0.438	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	143.1	-168.9	0	0	0	0	0	113.1	E31 S273	E31-A271 HydrophobicContact CG-CB 4.43Å; A271-S273 PolarHBondContact O-N 3.13Å
272	Q	79	Confident	89.2	Confident	189 Å²	189	43.7 Å²	43.7	88%	0.883	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	21.9	178.1	-54.6	-177.9	2	0	0	115.2
273	S	83.3	Confident	89.3	Confident	16 Å²	16	44.2 Å²	44.2	11%	0.112	22%	0.218	C	C	.	.	S	Bend	trans	-138.6	171.4	-178.8	84.3	0	0	0	0	112.1	R269 I270 A271 F275	R269-S273 PolarHBondContact NE-O 3.05Å; R269-S273 PolarHBondContact NH2-O 3.04Å; I270-S273 PolarHBondContact O-N 2.74Å; I270-S273 PolarHBondContact O-OG 3.16Å; A271-S273 PolarHBondContact O-N 3.13Å; S273-F275 PolarHBondContact OG-N 2.85Å; S273-F275 VanDerWaalsContact OG-N 3.1Å
274	D	87.6	Confident	89.5	Confident	47 Å²	47	43 Å²	43	25%	0.251	21%	0.21	S	C	.	.	S	Bend	trans	-101.1	18.8	167.7	-14.8	-68.9	0	0	0	111.8	K68 Y92 E93 R269	K68-D274 IonicContact NZ-OD2 3.75Å; Y92-D274 HydrophobicContact CD2-CB 4.21Å; Y92-D274 WeakPolarHBondContact CD2-O 3.44Å; Y92-D274 HydrophobicContact CE2-CB 3.48Å; Y92-D274 VanDerWaalsContact CE2-CB 3.48Å; Y92-D274 WeakPolarHBondContact CE2-OD2 3.43Å; Y92-D274 VanDerWaalsContact CZ-OD2 3.29Å; Y92-D274 PolarHBondContact OH-OD2 3.44Å; E93-D274 PolarHBondContact N-O 3.17Å; R269-D274 IonicContact NH2-OD1 3.5Å; R269-D274 PolarHBondContact NH2-OD1 3.47Å
275	F	89.2	Confident	89.5	Confident	13 Å²	13	41.5 Å²	41.5	6%	0.057	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	148.1	170.2	-69.3	-96.3	0	0	0	111.1	L28 K68 L71 A72 V90 S91 Y92 I270 S273	L28-F275 HydrophobicContact CD1-CB 4.24Å; L28-F275 HydrophobicContact CD1-CD2 3.88Å; L28-F275 HydrophobicContact CD1-CG 4.21Å; L28-F275 HydrophobicContact CD2-CD2 4.01Å; L28-F275 HydrophobicContact CD2-CE2 3.97Å; L28-F275 HydrophobicContact CD2-CG 4.33Å; L28-F275 HydrophobicContact CD2-CZ 4.24Å; K68-F275 HydrophobicContact CB-CE2 4.45Å; K68-F275 HydrophobicContact CB-CZ 3.79Å; K68-F275 HydrophobicContact CD-CE2 4.48Å; K68-F275 HydrophobicContact CG-CZ 4.22Å; K68-F275 VanDerWaalsContact O-CE1 3.23Å; K68-F275 WeakPolarHBondContact O-CE1 3.42Å; L71-F275 HydrophobicContact CB-CZ 4.48Å; L71-F275 HydrophobicContact CD2-CE1 4.48Å; L71-F275 HydrophobicContact CD2-CZ 3.93Å; L71-F275 HydrophobicContact CG-CE1 4.4Å; L71-F275 HydrophobicContact CG-CZ 4.31Å; A72-F275 HydrophobicContact CB-CD1 4.2Å; A72-F275 HydrophobicContact CB-CE1 3.95Å; V90-F275 HydrophobicContact CG1-CD1 4.18Å; S91-F275 CarbonylContact O-C 3.55Å; S91-F275 VanDerWaalsContact O-CA 3.24Å; S91-F275 WeakPolarHBondContact O-CA 3.29Å; Y92-F275 HydrophobicContact CD2-CD1 4.14Å; Y92-F275 AromaticContact CD2-CD2 3.8Å; Y92-F275 HydrophobicContact CD2-CD2 3.8Å; Y92-F275 HydrophobicContact CD2-CE1 4.09Å; Y92-F275 AromaticContact CD2-CE2 3.73Å; Y92-F275 HydrophobicContact CD2-CE2 3.73Å; Y92-F275 AromaticContact CD2-CG 4Å; Y92-F275 HydrophobicContact CD2-CG 4Å; Y92-F275 AromaticContact CD2-CZ 3.88Å; Y92-F275 HydrophobicContact CD2-CZ 3.88Å; Y92-F275 HydrophobicContact CE2-CD2 4.33Å; Y92-F275 HydrophobicContact CE2-CE2 4.21Å; Y92-F275 HydrophobicContact CG-CE1 4.36Å; Y92-F275 HydrophobicContact CG-CZ 4.38Å; I270-F275 HydrophobicContact CB-CB 4.39Å; I270-F275 HydrophobicContact CD1-CB 3.68Å; I270-F275 PolarHBondContact N-O 3.48Å; S273-F275 PolarHBondContact OG-N 2.85Å; S273-F275 VanDerWaalsContact OG-N 3.1Å
276	Y	91.6	Very high	89.5	Confident	31 Å²	31	37.8 Å²	37.8	12%	0.122	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	140.1	175.9	-71.5	-104.6	0	0	0	109.7	V90 S91 E93 P96 K267 I268 R269	V90-Y276 CarbonylContact C-O 3.59Å; V90-Y276 WeakPolarHBondContact CA-O 3.43Å; S91-Y276 PolarHBondContact N-O 3.37Å; S91-Y276 PolarHBondContact O-N 2.87Å; S91-Y276 PolarHBondContact OG-O 3.35Å; E93-Y276 HydrophobicContact CB-CD2 4.2Å; E93-Y276 HydrophobicContact CB-CE2 4.16Å; P96-Y276 HydrophobicContact CB-CE2 4.33Å; P96-Y276 VanDerWaalsContact CB-OH 3.24Å; P96-Y276 WeakPolarHBondContact CB-OH 3.31Å; P96-Y276 WeakPolarHBondContact CG-OH 3.18Å; K267-Y276 HydrophobicContact CD-CD1 4.33Å; K267-Y276 HydrophobicContact CG-CD1 4.1Å; K267-Y276 HydrophobicContact CG-CG 4.47Å; I268-Y276 CarbonylContact O-C 3.59Å; I268-Y276 VanDerWaalsContact O-CA 3.28Å; I268-Y276 WeakPolarHBondContact O-CA 3.45Å; R269-Y276 HydrophobicContact CB-CD1 3.83Å; R269-Y276 HydrophobicContact CB-CE1 3.53Å; R269-Y276 HydrophobicContact CB-CG 4.49Å; R269-Y276 HydrophobicContact CG-CD1 4.31Å; R269-Y276 HydrophobicContact CG-CE1 3.9Å; R269-Y276 HydrophobicContact CG-CE2 4.09Å
277	I	91.1	Very high	89.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.4	169.5	-173.4	168.1	0	0	0	110.4	I32 I35 L36 T89 V90 I268 I270 V279	I32-I277 HydrophobicContact CG2-CD1 4Å; I35-I277 HydrophobicContact CB-CG2 4.32Å; I35-I277 HydrophobicContact CD1-CG2 4.23Å; I35-I277 HydrophobicContact CG2-CG2 3.64Å; L36-I277 HydrophobicContact CD1-CD1 4.45Å; L36-I277 HydrophobicContact CD2-CD1 3.94Å; L36-I277 HydrophobicContact CG-CD1 4.13Å; T89-I277 CarbonylContact O-C 3.53Å; T89-I277 WeakPolarHBondContact O-CA 3.05Å; V90-I277 HydrophobicContact CG2-CB 4.35Å; V90-I277 HydrophobicContact CG2-CD1 4.11Å; V90-I277 HydrophobicContact CG2-CG1 4.08Å; I268-I277 HydrophobicContact CB-CG2 4.44Å; I268-I277 PolarHBondContact N-O 2.7Å; I268-I277 PolarHBondContact O-N 2.88Å; I270-I277 HydrophobicContact CD1-CB 4.21Å; I270-I277 HydrophobicContact CD1-CG2 4.33Å; I270-I277 HydrophobicContact CG1-CG2 4.09Å; I277-V279 HydrophobicContact CD1-CG2 4.25Å; I277-V279 HydrophobicContact CG1-CG2 3.9Å; I277-V279 HydrophobicContact CG2-CG2 4.1Å
278	T	93.4	Very high	88.9	Confident	27 Å²	27	36.8 Å²	36.8	17%	0.166	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	125.8	168.4	-40.6	0	0	0	0	108.5	L88 T89 V265 Q266	L88-T278 WeakPolarHBondContact CA-O 3.33Å; T89-T278 PolarHBondContact N-O 3.47Å; T89-T278 PolarHBondContact O-N 2.63Å; T89-T278 WeakPolarHBondContact OG1-CB 3.45Å; T89-T278 PolarHBondContact OG1-OG1 3.23Å; V265-T278 HydrophobicContact CB-CG2 4.23Å; Q266-T278 WeakPolarHBondContact O-CA 3.29Å
279	V	91.9	Very high	88.6	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	134.6	-177	-175.1	0	0	0	0	109.2	I35 L36 N39 Y40 L88 V265 Q266 I268 I277 V281	I35-V279 HydrophobicContact CG2-CG2 4.23Å; L36-V279 HydrophobicContact CD2-CG1 4.46Å; L36-V279 HydrophobicContact CD2-CG2 4.24Å; N39-V279 HydrophobicContact CB-CG1 4.3Å; Y40-V279 HydrophobicContact CD2-CG1 4.19Å; L88-V279 HydrophobicContact CD2-CG1 4.33Å; L88-V279 HydrophobicContact CD2-CG2 4.46Å; V265-V279 CarbonylContact C-O 3.3Å; V265-V279 WeakPolarHBondContact CA-O 3.5Å; Q266-V279 PolarHBondContact N-O 3.07Å; Q266-V279 PolarHBondContact O-N 2.99Å; I268-V279 HydrophobicContact CD1-CG2 4.48Å; I277-V279 HydrophobicContact CD1-CG2 4.25Å; I277-V279 HydrophobicContact CG1-CG2 3.9Å; I277-V279 HydrophobicContact CG2-CG2 4.1Å; V279-V281 HydrophobicContact CB-CG1 4.22Å; V279-V281 HydrophobicContact CG1-CG1 4.25Å; V279-V281 PolarHBondContact O-N 3.19Å
280	P	93.7	Very high	88.3	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	112.7	163.9	30	-31.3	0	0	0	108.6	Y40 C41 R87 V265	Y40-P280 HydrophobicContact CD2-CG 3.82Å; Y40-P280 HydrophobicContact CE2-CG 3.73Å; C41-P280 WeakPolarHBondContact CB-O 3.32Å; C41-P280 PolarHBondContact N-O 3.05Å; C41-P280 PolarHBondContact SG-O 2.81Å; R87-P280 HydrophobicContact CB-CG 4.31Å; R87-P280 VanDerWaalsContact CZ-CB 3.45Å; V265-P280 HydrophobicContact CG1-CB 4.26Å
281	V	93.3	Very high	88.3	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-14	-173.6	-56.7	0	0	0	0	113.4	N39 R201 K264 Q266 V279	N39-V281 HydrophobicContact CB-CG1 4.07Å; N39-V281 WeakPolarHBondContact O-CA 3.38Å; N39-V281 WeakPolarHBondContact O-CG1 3.22Å; R201-V281 WeakPolarHBondContact CB-O 3.43Å; R201-V281 PolarHBondContact N-O 3.08Å; K264-V281 HydrophobicContact CB-CG2 4.16Å; K264-V281 HydrophobicContact CD-CG2 3.67Å; K264-V281 HydrophobicContact CG-CG2 3.65Å; K264-V281 PolarHBondContact O-N 3.03Å; Q266-V281 HydrophobicContact CB-CG1 3.71Å; Q266-V281 HydrophobicContact CB-CG2 3.94Å; V279-V281 HydrophobicContact CB-CG1 4.22Å; V279-V281 HydrophobicContact CG1-CG1 4.25Å; V279-V281 PolarHBondContact O-N 3.19Å
282	A	91.6	Very high	88.7	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.008	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	152.2	166.3	0	0	0	0	0	111.9	I198 Y199 D200 V263 K264	I198-A282 HydrophobicContact CG2-CB 4.37Å; Y199-A282 CarbonylContact O-C 3.47Å; Y199-A282 WeakPolarHBondContact O-CA 3.41Å; Y199-A282 VanDerWaalsContact O-CB 3.28Å; Y199-A282 WeakPolarHBondContact O-CB 3Å; D200-A282 HydrophobicContact CB-CB 4Å; V263-A282 HydrophobicContact CG1-CB 3.89Å; K264-A282 HydrophobicContact CB-CB 3.79Å; K264-A282 HydrophobicContact CD-CB 4.43Å; K264-A282 PolarHBondContact O-N 3.48Å
283	R	91.6	Very high	89.1	Confident	47 Å²	47	30.6 Å²	30.6	18%	0.177	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	154.6	174.9	59.1	163.6	157.1	-172.8	-19.4	112	C41 L42 E44 I198 Y199 I285 E294	C41-R283 HydrophobicContact CB-CB 4.27Å; C41-R283 HydrophobicContact CB-CG 4.24Å; C41-R283 PolarHBondContact O-NE 2.66Å; C41-R283 PolarHBondContact O-NH2 3.33Å; L42-R283 VanDerWaalsContact CD2-CZ 3.45Å; L42-R283 VanDerWaalsContact CD2-NH1 3.28Å; E44-R283 VanDerWaalsContact CD-NH2 3.27Å; E44-R283 IonicContact OE1-CZ 3.35Å; E44-R283 IonicContact OE1-NH1 3.47Å; E44-R283 PolarHBondContact OE1-NH1 2.96Å; E44-R283 IonicContact OE1-NH2 2.74Å; E44-R283 PolarHBondContact OE1-NH2 3.39Å; E44-R283 IonicContact OE2-CZ 3.92Å; E44-R283 IonicContact OE2-NH2 3.45Å; E44-R283 PolarHBondContact OE2-NH2 3Å; I198-R283 WeakPolarHBondContact CA-O 3.28Å; Y199-R283 HydrophobicContact CD1-CG 4.36Å; Y199-R283 PolarHBondContact N-O 2.95Å; Y199-R283 PolarHBondContact O-N 3.47Å; R283-I285 HydrophobicContact CG-CD1 4.35Å; R283-I285 HydrophobicContact CG-CG1 4.07Å; R283-E294 WeakPolarHBondContact CA-OE2 3.47Å
284	S	91.9	Very high	89.5	Confident	3 Å²	3	30.5 Å²	30.5	2%	0.021	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	147.9	160.2	161	0	0	0	0	109.6	D196 S292 W293 E294	D196-S284 WeakPolarHBondContact OD1-CB 3.48Å; D196-S284 PolarHBondContact OD1-OG 2.99Å; D196-S284 WeakPolarHBondContact OD2-CB 3.3Å; D196-S284 PolarHBondContact OD2-OG 2.83Å; S284-S292 WeakPolarHBondContact O-CB 3.45Å; S284-W293 PolarHBondContact OG-NE1 3.15Å; S284-E294 PolarHBondContact N-OE2 3.26Å
285	I	90.6	Very high	89.5	Confident	49 Å²	49	31 Å²	31	25%	0.251	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	97	174.7	-52.5	174.5	0	0	0	105.8	D196 T197 R283 P287	D196-I285 PolarHBondContact OD1-N 3.4Å; T197-I285 PolarHBondContact N-O 3.41Å; T197-I285 PolarHBondContact O-N 2.79Å; R283-I285 HydrophobicContact CG-CD1 4.35Å; R283-I285 HydrophobicContact CG-CG1 4.07Å; I285-P287 WeakPolarHBondContact O-CD 3.26Å
286	N	89.8	Confident	89.5	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	20%	0.203	C	C	.	.			trans	-74.6	121.8	-175.4	171	-108.6	0	0	0	111.4	I195 Y243 I288 T289 G290 Q291	I195-N286 PolarHBondContact O-ND2 2.82Å; I195-N286 VanDerWaalsContact O-ND2 3.1Å; Y243-N286 HydrophobicContact CD1-CB 4.31Å; Y243-N286 HydrophobicContact CE1-CB 3.69Å; N286-I288 PolarHBondContact O-N 3.45Å; N286-I288 PolarHBondContact OD1-N 3.35Å; N286-T289 PolarHBondContact O-N 2.89Å; N286-T289 PolarHBondContact OD1-OG1 3.5Å; N286-G290 PolarHBondContact O-N 2.83Å; N286-Q291 WeakPolarHBondContact CB-O 3.46Å; N286-Q291 PolarHBondContact N-O 2.91Å
287	P	85.7	Confident	89.5	Confident	60 Å²	60	33 Å²	33	39%	0.39	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-26.3	-173.7	-28.1	33.9	0	0	0	115.8	H194 I285 T289	H194-P287 HydrophobicContact CB-CB 4.31Å; H194-P287 HydrophobicContact CB-CG 3.9Å; H194-P287 VanDerWaalsContact CG-CG 3.44Å; I285-P287 WeakPolarHBondContact O-CD 3.26Å; P287-T289 VanDerWaalsContact C-N 3.34Å
288	I	83.4	Confident	89.7	Confident	85 Å²	85	33.2 Å²	33.2	44%	0.436	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-20.1	-178.2	-54	167.9	0	0	0	111.5	K247 L248 N286	K247-I288 HydrophobicContact CB-CD1 4.24Å; L248-I288 HydrophobicContact CD2-CD1 3.59Å; L248-I288 HydrophobicContact CG-CD1 4Å; N286-I288 PolarHBondContact O-N 3.45Å; N286-I288 PolarHBondContact OD1-N 3.35Å
289	T	83.6	Confident	89.7	Confident	43 Å²	43	33.9 Å²	33.9	26%	0.264	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-138.1	-14	-165.9	57.2	0	0	0	0	116.2	Y243 K247 N286 P287 Q291	Y243-T289 PolarHBondContact OH-OG1 2.8Å; K247-T289 HydrophobicContact CD-CG2 3.71Å; K247-T289 HydrophobicContact CG-CG2 4.22Å; N286-T289 PolarHBondContact O-N 2.89Å; N286-T289 PolarHBondContact OD1-OG1 3.5Å; P287-T289 VanDerWaalsContact C-N 3.34Å; T289-Q291 PolarHBondContact O-N 3.46Å; T289-Q291 PolarHBondContact OG1-N 2.9Å
290	G	84.6	Confident	89.8	Confident	61 Å²	61	34.8 Å²	34.8	63%	0.629	21%	0.213	S	C	*	.	S	Bend	trans	63.9	3.9	-170.2	0	0	0	0	0	114.3	N286	N286-G290 PolarHBondContact O-N 2.83Å
291	Q	86.5	Confident	89.6	Confident	116 Å²	116	37.3 Å²	37.3	54%	0.542	23%	0.229	S	C	.	.			trans	-107	171.2	-175	-71.3	176.2	-3.2	0	0	111.2	Y243 N286 T289	Y243-Q291 WeakPolarHBondContact OH-CB 3.47Å; N286-Q291 WeakPolarHBondContact CB-O 3.46Å; N286-Q291 PolarHBondContact N-O 2.91Å; T289-Q291 PolarHBondContact O-N 3.46Å; T289-Q291 PolarHBondContact OG1-N 2.9Å
292	S	88.9	Confident	89.5	Confident	38 Å²	38	38.3 Å²	38.3	27%	0.266	23%	0.234	S	C	.	.			trans	-124.9	157.8	177.9	-179.6	0	0	0	0	110.9	S284 E294	S284-S292 WeakPolarHBondContact O-CB 3.45Å; S292-E294 VanDerWaalsContact C-N 3.35Å; S292-E294 WeakPolarHBondContact OG-CB 3.13Å; S292-E294 WeakPolarHBondContact OG-CG 3.44Å; S292-E294 PolarHBondContact OG-N 3Å; S292-E294 VanDerWaalsContact OG-N 3.14Å; S292-E294 PolarHBondContact OG-OE2 2.78Å
293	W	89.1	Confident	89.5	Confident	4 Å²	4	44.3 Å²	44.3	2%	0.015	27%	0.266	C	S	.	.	S	Bend	trans	-82.1	-14.8	169.8	51	-90.6	0	0	0	112.7	L176 E239 A240 Y243 V263 S284 G297 V298	L176-W293 HydrophobicContact CD2-CZ2 4.3Å; E239-W293 HydrophobicContact CB-CB 4.44Å; E239-W293 HydrophobicContact CB-CD2 3.91Å; E239-W293 HydrophobicContact CB-CE3 3.48Å; E239-W293 VanDerWaalsContact CB-CE3 3.48Å; E239-W293 HydrophobicContact CB-CG 4.31Å; E239-W293 HydrophobicContact CB-CZ3 4.07Å; E239-W293 HydrophobicContact CG-CE3 4.28Å; E239-W293 WeakPolarHBondContact OE2-CZ3 3.21Å; A240-W293 HydrophobicContact CB-CZ2 4.3Å; Y243-W293 HydrophobicContact CD2-CB 3.79Å; Y243-W293 HydrophobicContact CE2-CB 4.47Å; Y243-W293 HydrophobicContact CG-CB 3.9Å; V263-W293 HydrophobicContact CG2-CH2 4.3Å; V263-W293 HydrophobicContact CG2-CZ2 3.76Å; S284-W293 PolarHBondContact OG-NE1 3.15Å; W293-G297 VanDerWaalsContact O-CA 3.28Å; W293-G297 WeakPolarHBondContact O-CA 3.47Å; W293-G297 PolarHBondContact O-N 3.16Å; W293-V298 HydrophobicContact CB-CG2 4.14Å
294	E	90.1	Very high	89.6	Confident	15 Å²	15	43.5 Å²	43.5	7%	0.07	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	153.2	-176.4	-61.3	172.4	86.9	0	0	112.9	R87 G261 S262 V263 R283 S284 S292 S296	R87-E294 IonicContact NH1-OE1 2.69Å; R87-E294 PolarHBondContact NH1-OE1 2.6Å; G261-E294 VanDerWaalsContact O-CA 3.25Å; G261-E294 WeakPolarHBondContact O-CA 3.33Å; G261-E294 WeakPolarHBondContact O-CB 3.42Å; S262-E294 VanDerWaalsContact CA-OE1 3.3Å; S262-E294 WeakPolarHBondContact CA-OE1 3.32Å; V263-E294 HydrophobicContact CG2-CG 4.36Å; V263-E294 PolarHBondContact N-OE1 3.48Å; R283-E294 WeakPolarHBondContact CA-OE2 3.47Å; S284-E294 PolarHBondContact N-OE2 3.26Å; S292-E294 VanDerWaalsContact C-N 3.35Å; S292-E294 WeakPolarHBondContact OG-CB 3.13Å; S292-E294 WeakPolarHBondContact OG-CG 3.44Å; S292-E294 PolarHBondContact OG-N 3Å; S292-E294 VanDerWaalsContact OG-N 3.14Å; S292-E294 PolarHBondContact OG-OE2 2.78Å; E294-S296 PolarHBondContact O-N 3.15Å
295	V	89.1	Confident	89.7	Confident	58 Å²	58	47.4 Å²	47.4	35%	0.352	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	-47	-178.8	-173.9	0	0	0	0	115.2	P86 R87 G260 G261	P86-V295 HydrophobicContact CG-CG1 3.77Å; R87-V295 HydrophobicContact CG-CG2 4Å; G260-V295 VanDerWaalsContact O-CA 3.3Å; G260-V295 WeakPolarHBondContact O-CA 3.41Å; G260-V295 PolarHBondContact O-N 3.26Å; G261-V295 PolarHBondContact O-N 3.4Å
296	S	88.8	Confident	89.7	Confident	78 Å²	78	45.8 Å²	45.8	55%	0.545	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-22.2	-175.7	-63.4	0	0	0	0	113.8	R257 E294	R257-S296 WeakPolarHBondContact CD-O 3.17Å; R257-S296 PolarHBondContact NH1-O 2.87Å; E294-S296 PolarHBondContact O-N 3.15Å
297	G	91.8	Very high	89.9	Confident	8 Å²	8	53.2 Å²	53.2	8%	0.082	31%	0.313	C	S	.	.			trans	71.4	160.3	-175.9	0	0	0	0	0	113.7	S258 W293 S299	S258-G297 WeakPolarHBondContact OG-CA 3.48Å; W293-G297 VanDerWaalsContact O-CA 3.28Å; W293-G297 WeakPolarHBondContact O-CA 3.47Å; W293-G297 PolarHBondContact O-N 3.16Å; G297-S299 PolarHBondContact O-N 3.01Å
298	V	94.8	Very high	90.3	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.018	31%	0.312	C	S	.	.			trans	-70.2	111.7	170.2	-167.5	0	0	0	0	108.4	E239 A242 Y243 R257 S258 W293	E239-V298 HydrophobicContact CB-CG2 4.01Å; E239-V298 VanDerWaalsContact O-CG2 3.32Å; E239-V298 WeakPolarHBondContact O-CG2 3.46Å; A242-V298 HydrophobicContact CB-CG1 4.27Å; A242-V298 HydrophobicContact CB-CG2 4.25Å; Y243-V298 HydrophobicContact CD2-CG2 4.3Å; R257-V298 WeakPolarHBondContact CA-O 3.23Å; S258-V298 PolarHBondContact N-O 3.03Å; S258-V298 VanDerWaalsContact N-O 3.09Å; S258-V298 PolarHBondContact OG-N 3.24Å; W293-V298 HydrophobicContact CB-CG2 4.14Å
299	S	93.9	Very high	90.8	Very high	41 Å²	41	50.1 Å²	50.1	29%	0.287	29%	0.291	S	S	.	.			trans	-68.9	139.9	167.1	-59.1	0	0	0	0	109.6	K246 R257 G297	K246-S299 PolarHBondContact NZ-O 3.37Å; R257-S299 PolarHBondContact NH1-OG 2.87Å; R257-S299 PolarHBondContact NH2-OG 2.83Å; R257-S299 VanDerWaalsContact NH2-OG 3.16Å; G297-S299 PolarHBondContact O-N 3.01Å
300	P	92.7	Very high	91.3	Very high	19 Å²	19	49.9 Å²	49.9	12%	0.123	29%	0.29	C	S	.	.			trans	-62.8	168.9	174.7	29.4	-36.8	0	0	0	111.4	K246 I253 G255 N303	K246-P300 VanDerWaalsContact NZ-C 3.34Å; K246-P300 PolarHBondContact NZ-O 3.47Å; I253-P300 HydrophobicContact CG2-CB 4.36Å; G255-P300 WeakPolarHBondContact O-CG 3.43Å; P300-N303 HydrophobicContact CG-CB 3.89Å
301	T	91	Very high	91.7	Very high	54 Å²	54	51.1 Å²	51.1	33%	0.331	29%	0.289	S	S	.	.	S	Bend	trans	-85	-44.7	161.2	-50.7	0	0	0	0	109.1	K246 I252 I253	K246-T301 VanDerWaalsContact CE-OG1 3.29Å; K246-T301 WeakPolarHBondContact CE-OG1 3.3Å; I252-T301 HydrophobicContact CG2-CG2 4.08Å; I253-T301 PolarHBondContact N-OG1 2.78Å; I253-T301 WeakPolarHBondContact O-CA 3.32Å; I253-T301 WeakPolarHBondContact O-CB 3.27Å; I253-T301 PolarHBondContact O-N 3.01Å
302	I	89.4	Confident	91.9	Very high	21 Å²	21	48.4 Å²	48.4	11%	0.108	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	110.3	175.4	-57.5	177.6	0	0	0	108.6	I253 V254 G255 V304 K312 L316	I253-I302 PolarHBondContact O-N 3.02Å; V254-I302 WeakPolarHBondContact CA-O 3.46Å; V254-I302 HydrophobicContact CG1-CB 4.49Å; V254-I302 HydrophobicContact CG2-CB 4.26Å; V254-I302 HydrophobicContact CG2-CD1 4.4Å; G255-I302 PolarHBondContact N-O 3.07Å; I302-V304 HydrophobicContact CG2-CG1 4.32Å; I302-V304 PolarHBondContact O-N 2.87Å; I302-K312 HydrophobicContact CG2-CG 3.99Å; I302-L316 HydrophobicContact CD1-CD1 4.24Å; I302-L316 HydrophobicContact CD1-CD2 3.76Å
303	N	92.8	Very high	92.1	Very high	126 Å²	126	46.6 Å²	46.6	67%	0.674	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	112.7	-178.1	-175.5	61.8	0	0	0	111.1	G255 P300	G255-N303 WeakPolarHBondContact O-CA 3.48Å; P300-N303 HydrophobicContact CG-CB 3.89Å
304	V	92.8	Very high	92.2	Very high	31 Å²	31	50.4 Å²	50.4	19%	0.188	28%	0.279	C	S	.	.			trans	-143.6	159.8	175.6	-70.7	0	0	0	0	109.7	V254 G255 I302 A306 A309 K312	V254-V304 HydrophobicContact CG1-CG2 3.84Å; G255-V304 CarbonylContact C-O 3.49Å; G255-V304 WeakPolarHBondContact CA-O 3.48Å; G255-V304 PolarHBondContact O-N 3.43Å; G255-V304 VanDerWaalsContact O-O 3.08Å; I302-V304 HydrophobicContact CG2-CG1 4.32Å; I302-V304 PolarHBondContact O-N 2.87Å; V304-A306 PolarHBondContact O-N 3.23Å; V304-A309 HydrophobicContact CG2-CB 4.17Å; V304-K312 HydrophobicContact CG1-CB 4.45Å; V304-K312 HydrophobicContact CG1-CG 4.22Å; V304-K312 HydrophobicContact CG2-CB 4.34Å
305	L	94	Very high	92.1	Very high	85 Å²	85	52.5 Å²	52.5	45%	0.445	30%	0.295	S	S	.	.			trans	-61.5	142.4	177.4	-59.6	174.2	0	0	0	109.7	K307 E308 A309	L305-K307 HydrophobicContact CB-CG 4.09Å; L305-K307 PolarHBondContact O-N 3.19Å; L305-E308 WeakPolarHBondContact CB-OE2 3.38Å; L305-E308 PolarHBondContact N-OE2 3Å; L305-E308 PolarHBondContact O-N 2.81Å; L305-A309 PolarHBondContact O-N 2.88Å
306	A	92	Very high	92.1	Very high	15 Å²	15	49.8 Å²	49.8	12%	0.124	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.4	-173.3	0	0	0	0	0	113.3	R169 E256 V304	R169-A306 WeakPolarHBondContact CD-O 3.33Å; R169-A306 PolarHBondContact NH1-O 3.45Å; E256-A306 VanDerWaalsContact CD-CB 3.45Å; E256-A306 HydrophobicContact CG-CB 4.04Å; E256-A306 WeakPolarHBondContact OE1-CB 3.46Å; E256-A306 PolarHBondContact OE1-N 2.87Å; V304-A306 PolarHBondContact O-N 3.23Å
307	K	92.9	Very high	92.1	Very high	156 Å²	156	46.9 Å²	46.9	68%	0.678	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-37.8	172.3	70.5	-176	-169.7	179.7	0	113.2	L305	L305-K307 HydrophobicContact CB-CG 4.09Å; L305-K307 PolarHBondContact O-N 3.19Å
308	E	94.8	Very high	91.8	Very high	80 Å²	80	49 Å²	49	37%	0.374	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-20	-176.4	-75.3	138.1	-161.7	0	0	112.9	L305 V310 S311 K312	L305-E308 WeakPolarHBondContact CB-OE2 3.38Å; L305-E308 PolarHBondContact N-OE2 3Å; L305-E308 PolarHBondContact O-N 2.81Å; E308-V310 PolarHBondContact O-N 3.44Å; E308-S311 WeakPolarHBondContact O-CA 3.46Å; E308-S311 WeakPolarHBondContact O-CB 3.29Å; E308-S311 PolarHBondContact O-N 3.1Å; E308-K312 PolarHBondContact O-N 3Å; E308-K312 VanDerWaalsContact O-N 3.13Å
309	A	94.2	Very high	91.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-50.6	-33.6	-172.1	0	0	0	0	0	115.3	L229 V254 V304 L305 A313	L229-A309 HydrophobicContact CD1-CB 4.5Å; L229-A309 HydrophobicContact CD2-CB 4.16Å; V254-A309 HydrophobicContact CG1-CB 4.32Å; V304-A309 HydrophobicContact CG2-CB 4.17Å; L305-A309 PolarHBondContact O-N 2.88Å; A309-A313 WeakPolarHBondContact O-CB 3.43Å; A309-A313 PolarHBondContact O-N 2.87Å
310	V	94	Very high	91	Very high	39 Å²	39	49.9 Å²	49.9	24%	0.236	27%	0.272	C	S	.	.	H	α-helix	trans	-69.1	-38.9	175.3	176.5	0	0	0	0	112.1	R169 L229 E308 A313 K314	R169-V310 VanDerWaalsContact NH2-CG2 3.31Å; L229-V310 HydrophobicContact CD1-CB 4.45Å; L229-V310 HydrophobicContact CD1-CG2 3.49Å; L229-V310 VanDerWaalsContact CD1-CG2 3.49Å; E308-V310 PolarHBondContact O-N 3.44Å; V310-A313 PolarHBondContact O-N 3.37Å; V310-K314 PolarHBondContact O-N 2.98Å
311	S	92.1	Very high	90.6	Very high	86 Å²	86	58.9 Å²	58.9	60%	0.601	31%	0.305	S	S	*	.	H	α-helix	trans	-69.9	-46.5	179.5	178.6	0	0	0	0	110.6	E308 A313 K314 S315	E308-S311 WeakPolarHBondContact O-CA 3.46Å; E308-S311 WeakPolarHBondContact O-CB 3.29Å; E308-S311 PolarHBondContact O-N 3.1Å; S311-A313 VanDerWaalsContact C-N 3.28Å; S311-A313 PolarHBondContact O-N 3.25Å; S311-K314 WeakPolarHBondContact O-CB 3.33Å; S311-K314 PolarHBondContact O-N 3Å; S311-K314 VanDerWaalsContact O-N 3.15Å; S311-S315 PolarHBondContact O-N 3.35Å
312	K	91.9	Very high	90.4	Very high	60 Å²	60	57.9 Å²	57.9	26%	0.261	30%	0.302	S	S	.	.	H	α-helix	trans	-64	-32.7	174.6	-171.3	65.9	-175.3	179.6	0	112.4	V254 I302 V304 E308 S315 L316 G360	V254-K312 HydrophobicContact CG1-CB 4.2Å; V254-K312 HydrophobicContact CG1-CG 4.26Å; I302-K312 HydrophobicContact CG2-CG 3.99Å; V304-K312 HydrophobicContact CG1-CB 4.45Å; V304-K312 HydrophobicContact CG1-CG 4.22Å; V304-K312 HydrophobicContact CG2-CB 4.34Å; E308-K312 PolarHBondContact O-N 3Å; E308-K312 VanDerWaalsContact O-N 3.13Å; K312-S315 PolarHBondContact O-OG 3.23Å; K312-L316 VanDerWaalsContact O-CB 3.27Å; K312-L316 WeakPolarHBondContact O-CB 3.27Å; K312-L316 PolarHBondContact O-N 3.19Å; K312-G360 VanDerWaalsContact CE-O 3.23Å; K312-G360 WeakPolarHBondContact CE-O 3.36Å; K312-G360 PolarHBondContact NZ-O 3.33Å
313	A	92.3	Very high	90.3	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-66.5	-41.7	172.2	0	0	0	0	0	112.7	I165 I227 L229 A309 V310 S311 L316 L317	I165-A313 HydrophobicContact CD1-CB 3.89Å; I165-A313 HydrophobicContact CG1-CB 4.34Å; I227-A313 HydrophobicContact CD1-CB 3.88Å; I227-A313 WeakPolarHBondContact CD1-O 3.39Å; I227-A313 HydrophobicContact CG2-CB 3.85Å; L229-A313 HydrophobicContact CD2-CB 3.97Å; A309-A313 WeakPolarHBondContact O-CB 3.43Å; A309-A313 PolarHBondContact O-N 2.87Å; V310-A313 PolarHBondContact O-N 3.37Å; S311-A313 VanDerWaalsContact C-N 3.28Å; S311-A313 PolarHBondContact O-N 3.25Å; A313-L316 PolarHBondContact O-N 2.64Å; A313-L317 WeakPolarHBondContact O-CG 3.33Å; A313-L317 PolarHBondContact O-N 2.69Å; A313-L317 VanDerWaalsContact O-N 3.1Å
314	K	90.9	Very high	90	Very high	83 Å²	83	55.3 Å²	55.3	36%	0.361	29%	0.293	S	S	.	.	H	α-helix	trans	-60.1	-49.5	173	-81.3	-168.2	173.5	-169.1	0	112	E126 V310 S311 L316 L317 A318	E126-K314 IonicContact OE2-NZ 2.7Å; E126-K314 PolarHBondContact OE2-NZ 2.77Å; V310-K314 PolarHBondContact O-N 2.98Å; S311-K314 WeakPolarHBondContact O-CB 3.33Å; S311-K314 PolarHBondContact O-N 3Å; S311-K314 VanDerWaalsContact O-N 3.15Å; K314-L316 VanDerWaalsContact C-N 3.3Å; K314-L316 PolarHBondContact O-N 3.31Å; K314-L317 PolarHBondContact O-N 2.86Å; K314-A318 PolarHBondContact O-N 3Å; K314-A318 VanDerWaalsContact O-N 3.14Å
315	S	88.4	Confident	89.8	Confident	59 Å²	59	59 Å²	59	41%	0.413	31%	0.307	S	S	.	.	H	α-helix	trans	-63.6	-37.1	-179.9	64.3	0	0	0	0	112.1	S311 K312 A318 L319	S311-S315 PolarHBondContact O-N 3.35Å; K312-S315 PolarHBondContact O-OG 3.23Å; S315-A318 PolarHBondContact O-N 3.14Å; S315-L319 PolarHBondContact O-N 2.8Å
316	L	89.1	Confident	89.6	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-64	-40.7	176.3	-178.6	63.9	0	0	0	112.3	I227 I252 V254 I302 K312 A313 K314 A318 L319 R320 V359	I227-L316 HydrophobicContact CD1-CB 4.27Å; I227-L316 HydrophobicContact CD1-CD2 3.83Å; I227-L316 HydrophobicContact CD1-CG 4.28Å; I227-L316 HydrophobicContact CG1-CD2 4.39Å; I252-L316 HydrophobicContact CB-CD2 4.41Å; I252-L316 HydrophobicContact CD1-CD2 3.89Å; I252-L316 HydrophobicContact CG2-CD2 3.94Å; V254-L316 HydrophobicContact CG2-CD2 4.36Å; I302-L316 HydrophobicContact CD1-CD1 4.24Å; I302-L316 HydrophobicContact CD1-CD2 3.76Å; K312-L316 VanDerWaalsContact O-CB 3.27Å; K312-L316 WeakPolarHBondContact O-CB 3.27Å; K312-L316 PolarHBondContact O-N 3.19Å; A313-L316 PolarHBondContact O-N 2.64Å; K314-L316 VanDerWaalsContact C-N 3.3Å; K314-L316 PolarHBondContact O-N 3.31Å; L316-A318 VanDerWaalsContact C-N 3.32Å; L316-L319 PolarHBondContact O-N 3.42Å; L316-R320 HydrophobicContact CD1-CG 4.28Å; L316-R320 HydrophobicContact CG-CG 4.46Å; L316-R320 WeakPolarHBondContact O-CB 3.29Å; L316-R320 VanDerWaalsContact O-CG 3.26Å; L316-R320 WeakPolarHBondContact O-CG 3.42Å; L316-R320 PolarHBondContact O-N 2.85Å; L316-V359 VanDerWaalsContact CD1-O 3.26Å; L316-V359 WeakPolarHBondContact CD1-O 3.35Å
317	L	88.8	Confident	89.5	Confident	16 Å²	16	55.6 Å²	55.6	8%	0.084	29%	0.286	C	S	.	.	H	α-helix	trans	-66.4	-34.2	175.9	-69.7	170.9	0	0	0	112.3	T129 I165 D225 I227 A313 K314 Y321	T129-L317 HydrophobicContact CG2-CD1 3.61Å; I165-L317 HydrophobicContact CD1-CD1 4.25Å; I165-L317 HydrophobicContact CG1-CD1 4.14Å; D225-L317 HydrophobicContact CB-CD2 3.67Å; I227-L317 HydrophobicContact CD1-CD1 4.17Å; I227-L317 HydrophobicContact CD1-CD2 3.86Å; I227-L317 HydrophobicContact CD1-CG 3.65Å; I227-L317 HydrophobicContact CG1-CD2 4.4Å; A313-L317 WeakPolarHBondContact O-CG 3.33Å; A313-L317 PolarHBondContact O-N 2.69Å; A313-L317 VanDerWaalsContact O-N 3.1Å; K314-L317 PolarHBondContact O-N 2.86Å; L317-Y321 WeakPolarHBondContact O-CB 3.43Å; L317-Y321 PolarHBondContact O-N 3.49Å; L317-Y321 VanDerWaalsContact O-N 3.09Å
318	A	85.9	Confident	89.3	Confident	53 Å²	53	53.1 Å²	53.1	44%	0.438	28%	0.277	S	S	.	.	H	α-helix	trans	-65.1	-48.9	173.6	0	0	0	0	0	111.6	K314 S315 L316 R320 Y321 A322	K314-A318 PolarHBondContact O-N 3Å; K314-A318 VanDerWaalsContact O-N 3.14Å; S315-A318 PolarHBondContact O-N 3.14Å; L316-A318 VanDerWaalsContact C-N 3.32Å; A318-R320 PolarHBondContact O-N 3.23Å; A318-Y321 WeakPolarHBondContact O-CB 3.34Å; A318-Y321 PolarHBondContact O-N 2.94Å; A318-A322 PolarHBondContact O-N 3.33Å; A318-A322 VanDerWaalsContact O-N 3.16Å
319	L	85.8	Confident	89.2	Confident	16 Å²	16	51.2 Å²	51.2	8%	0.084	27%	0.269	C	S	.	.	H	α-helix	trans	-59	-45.2	175.5	177.1	58.3	0	0	0	111.8	S315 L316 Y321 A322 I323 V359 S361 E362 L365	S315-L319 PolarHBondContact O-N 2.8Å; L316-L319 PolarHBondContact O-N 3.42Å; L319-Y321 PolarHBondContact O-N 2.72Å; L319-A322 WeakPolarHBondContact O-CB 3.43Å; L319-A322 PolarHBondContact O-N 3.02Å; L319-I323 HydrophobicContact CD1-CD1 4.46Å; L319-I323 HydrophobicContact CD1-CG1 4.24Å; L319-I323 HydrophobicContact CG-CD1 4.11Å; L319-I323 HydrophobicContact CG-CG1 4.38Å; L319-I323 WeakPolarHBondContact O-CG1 3.43Å; L319-I323 PolarHBondContact O-N 2.7Å; L319-V359 HydrophobicContact CD2-CG1 4.08Å; L319-S361 VanDerWaalsContact CD2-C 3.48Å; L319-E362 HydrophobicContact CD1-CG 3.68Å; L319-L365 HydrophobicContact CD1-CD2 4.43Å
320	R	85.6	Confident	89.1	Confident	46 Å²	46	51.2 Å²	51.2	17%	0.174	27%	0.269	C	S	.	.	H	α-helix	trans	-64.5	-27	178.5	-71.6	178.1	64.4	76.4	1.8	113.7	D225 L316 A318 L356	D225-R320 VanDerWaalsContact CG-NE 3.26Å; D225-R320 IonicContact OD1-CZ 2.81Å; D225-R320 IonicContact OD1-NE 2.68Å; D225-R320 PolarHBondContact OD1-NE 3.07Å; D225-R320 VanDerWaalsContact OD1-NE 3.12Å; D225-R320 IonicContact OD1-NH2 2.81Å; D225-R320 PolarHBondContact OD1-NH2 3Å; D225-R320 IonicContact OD2-CZ 3.35Å; D225-R320 IonicContact OD2-NE 2.6Å; D225-R320 PolarHBondContact OD2-NE 3.2Å; D225-R320 IonicContact OD2-NH2 3.36Å; L316-R320 HydrophobicContact CD1-CG 4.28Å; L316-R320 HydrophobicContact CG-CG 4.46Å; L316-R320 WeakPolarHBondContact O-CB 3.29Å; L316-R320 VanDerWaalsContact O-CG 3.26Å; L316-R320 WeakPolarHBondContact O-CG 3.42Å; L316-R320 PolarHBondContact O-N 2.85Å; A318-R320 PolarHBondContact O-N 3.23Å; R320-L356 PolarHBondContact NH1-O 2.9Å
321	Y	84.8	Confident	89	Confident	208 Å²	208	50 Å²	50	82%	0.816	26%	0.263	S	S	*	.	H	α-helix	trans	-73.2	-32.4	170.7	-172.5	-97.3	0	0	0	112.5	L317 A318 L319	L317-Y321 WeakPolarHBondContact O-CB 3.43Å; L317-Y321 PolarHBondContact O-N 3.49Å; L317-Y321 VanDerWaalsContact O-N 3.09Å; A318-Y321 WeakPolarHBondContact O-CB 3.34Å; A318-Y321 PolarHBondContact O-N 2.94Å; L319-Y321 PolarHBondContact O-N 2.72Å
322	A	85.4	Confident	89	Confident	34 Å²	34	48.2 Å²	48.2	28%	0.281	25%	0.246	S	C	.	.	H	α-helix	trans	-78.3	-35.6	178.1	0	0	0	0	0	113.7	A318 L319 P324 K325 I326	A318-A322 PolarHBondContact O-N 3.33Å; A318-A322 VanDerWaalsContact O-N 3.16Å; L319-A322 WeakPolarHBondContact O-CB 3.43Å; L319-A322 PolarHBondContact O-N 3.02Å; A322-P324 VanDerWaalsContact C-CD 3.49Å; A322-P324 VanDerWaalsContact C-N 3.35Å; A322-P324 VanDerWaalsContact O-N 3.12Å; A322-K325 WeakPolarHBondContact O-CB 3.41Å; A322-K325 PolarHBondContact O-N 2.95Å; A322-I326 HydrophobicContact CB-CD1 4.26Å; A322-I326 PolarHBondContact O-N 3.45Å
323	I	87.9	Confident	89	Confident	7 Å²	7	46.6 Å²	46.6	4%	0.036	24%	0.24	C	C	.	.	H	α-helix	trans	-46	-44.9	-174.4	-77.9	167	0	0	0	114.4	L319 K325 I326 M327 L356 V359 L365	L319-I323 HydrophobicContact CD1-CD1 4.46Å; L319-I323 HydrophobicContact CD1-CG1 4.24Å; L319-I323 HydrophobicContact CG-CD1 4.11Å; L319-I323 HydrophobicContact CG-CG1 4.38Å; L319-I323 WeakPolarHBondContact O-CG1 3.43Å; L319-I323 PolarHBondContact O-N 2.7Å; I323-K325 VanDerWaalsContact C-N 3.29Å; I323-K325 PolarHBondContact O-N 2.68Å; I323-I326 HydrophobicContact CG1-CD1 4.42Å; I323-I326 WeakPolarHBondContact O-CB 3.24Å; I323-I326 PolarHBondContact O-N 3.45Å; I323-I326 VanDerWaalsContact O-N 3.13Å; I323-M327 HydrophobicContact CG2-CG 3.97Å; I323-M327 VanDerWaalsContact O-CG 3.32Å; I323-M327 WeakPolarHBondContact O-CG 3.31Å; I323-M327 PolarHBondContact O-N 2.81Å; I323-L356 HydrophobicContact CD1-CD2 4.42Å; I323-L356 HydrophobicContact CG2-CD1 3.7Å; I323-L356 HydrophobicContact CG2-CD2 4Å; I323-L356 HydrophobicContact CG2-CG 4.41Å; I323-V359 HydrophobicContact CD1-CG1 4.38Å; I323-L365 HydrophobicContact CD1-CD1 4.3Å; I323-L365 HydrophobicContact CD1-CD2 4.37Å; I323-L365 HydrophobicContact CG1-CD1 4.36Å; I323-L365 HydrophobicContact CG1-CD2 3.84Å
324	P	87.1	Confident	89	Confident	86 Å²	86	46.6 Å²	46.6	56%	0.558	24%	0.24	S	C	*	.	H	α-helix	trans	-58.8	-33.9	176.8	-26.7	36.3	0	0	0	114.7	A322 Q328	A322-P324 VanDerWaalsContact C-CD 3.49Å; A322-P324 VanDerWaalsContact C-N 3.35Å; A322-P324 VanDerWaalsContact O-N 3.12Å; P324-Q328 PolarHBondContact O-N 3.02Å
325	K	88.3	Confident	89	Confident	108 Å²	108	47.1 Å²	47.1	47%	0.47	24%	0.24	S	C	.	.	H	α-helix	trans	-70.2	-44.5	173.6	-168	-152.1	179.2	-150.9	0	110.6	A322 I323 M327 Q328 I329 E569	A322-K325 WeakPolarHBondContact O-CB 3.41Å; A322-K325 PolarHBondContact O-N 2.95Å; I323-K325 VanDerWaalsContact C-N 3.29Å; I323-K325 PolarHBondContact O-N 2.68Å; K325-M327 VanDerWaalsContact C-N 3.35Å; K325-M327 PolarHBondContact O-N 2.67Å; K325-Q328 PolarHBondContact O-N 2.85Å; K325-I329 HydrophobicContact CD-CD1 4.07Å; K325-I329 HydrophobicContact CG-CD1 4.02Å; K325-I329 WeakPolarHBondContact O-CG1 3.29Å; K325-I329 PolarHBondContact O-N 2.71Å; K325-E569 PolarHBondContact NZ-O 3.33Å; K325-E569 IonicContact NZ-OE2 2.71Å
326	I	89	Confident	89	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-59	-47.6	178.5	-55.7	170.4	0	0	0	110	A322 I323 Q328 I329 I330 L365 I568 T571	A322-I326 HydrophobicContact CB-CD1 4.26Å; A322-I326 PolarHBondContact O-N 3.45Å; I323-I326 HydrophobicContact CG1-CD1 4.42Å; I323-I326 WeakPolarHBondContact O-CB 3.24Å; I323-I326 PolarHBondContact O-N 3.45Å; I323-I326 VanDerWaalsContact O-N 3.13Å; I326-Q328 VanDerWaalsContact C-N 3.33Å; I326-Q328 PolarHBondContact O-N 3.45Å; I326-I329 PolarHBondContact O-N 3.38Å; I326-I330 HydrophobicContact CG2-CD1 3.87Å; I326-I330 WeakPolarHBondContact O-CG1 3.43Å; I326-I330 PolarHBondContact O-N 2.99Å; I326-L365 HydrophobicContact CD1-CD2 3.89Å; I326-L365 HydrophobicContact CG2-CD2 4.43Å; I326-I568 HydrophobicContact CG2-CD1 4.13Å; I326-I568 HydrophobicContact CG2-CG2 4.4Å; I326-T571 HydrophobicContact CD1-CG2 3.64Å; I326-T571 HydrophobicContact CG1-CG2 3.96Å
327	M	89.4	Confident	89.2	Confident	24 Å²	24	50 Å²	50	12%	0.118	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-39.5	178.5	-68.1	-60.7	93.2	0	0	112.3	I323 K325 I330 S331 L351 L369	I323-M327 HydrophobicContact CG2-CG 3.97Å; I323-M327 VanDerWaalsContact O-CG 3.32Å; I323-M327 WeakPolarHBondContact O-CG 3.31Å; I323-M327 PolarHBondContact O-N 2.81Å; K325-M327 VanDerWaalsContact C-N 3.35Å; K325-M327 PolarHBondContact O-N 2.67Å; M327-I330 HydrophobicContact CE-CD1 3.95Å; M327-S331 WeakPolarHBondContact O-CB 3.41Å; M327-S331 PolarHBondContact O-N 2.6Å; M327-S331 PolarHBondContact O-OG 3.04Å; M327-L351 HydrophobicContact SD-CD2 4.48Å; M327-L369 HydrophobicContact CE-CD1 3.47Å; M327-L369 VanDerWaalsContact CE-CD1 3.47Å; M327-L369 HydrophobicContact CE-CD2 3.47Å; M327-L369 VanDerWaalsContact CE-CD2 3.47Å; M327-L369 HydrophobicContact CE-CG 4.1Å; M327-L369 HydrophobicContact SD-CD2 3.67Å
328	Q	90.3	Very high	89.5	Confident	105 Å²	105	49.2 Å²	49.2	49%	0.491	25%	0.247	S	C	.	.	H	α-helix	trans	-64.8	-48.4	175.9	-172.5	61.9	49.9	0	0	111.4	P324 K325 I326 I330 S331 D332	P324-Q328 PolarHBondContact O-N 3.02Å; K325-Q328 PolarHBondContact O-N 2.85Å; I326-Q328 VanDerWaalsContact C-N 3.33Å; I326-Q328 PolarHBondContact O-N 3.45Å; Q328-I330 PolarHBondContact O-N 3.47Å; Q328-S331 WeakPolarHBondContact O-CB 3.44Å; Q328-S331 PolarHBondContact O-N 2.79Å; Q328-S331 VanDerWaalsContact O-N 3.14Å; Q328-D332 PolarHBondContact NE2-OD1 3.2Å; Q328-D332 PolarHBondContact NE2-OD2 3.27Å; Q328-D332 VanDerWaalsContact O-CG 3.24Å; Q328-D332 PolarHBondContact O-N 3.45Å
329	I	91.6	Very high	89.7	Confident	40 Å²	40	47.4 Å²	47.4	21%	0.205	23%	0.232	C	C	.	.	H	α-helix	trans	-58.1	-49.3	178.9	-69	165.7	0	0	0	111.1	K325 I326 S331 D332 I333 I568	K325-I329 HydrophobicContact CD-CD1 4.07Å; K325-I329 HydrophobicContact CG-CD1 4.02Å; K325-I329 WeakPolarHBondContact O-CG1 3.29Å; K325-I329 PolarHBondContact O-N 2.71Å; I326-I329 PolarHBondContact O-N 3.38Å; I329-S331 VanDerWaalsContact C-N 3.32Å; I329-S331 PolarHBondContact O-N 3.15Å; I329-D332 PolarHBondContact O-N 3.31Å; I329-I333 HydrophobicContact CG2-CD1 3.6Å; I329-I333 HydrophobicContact CG2-CG1 4.37Å; I329-I333 VanDerWaalsContact O-CG1 3.29Å; I329-I333 WeakPolarHBondContact O-CG1 3.29Å; I329-I333 PolarHBondContact O-N 2.95Å; I329-I568 HydrophobicContact CB-CG2 4.45Å; I329-I568 HydrophobicContact CD1-CG2 3.94Å; I329-I568 HydrophobicContact CG2-CG1 4.34Å; I329-I568 HydrophobicContact CG2-CG2 4.18Å
330	I	91.8	Very high	90	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.3	-43.4	176.3	-68.3	169.2	0	0	0	110.9	I326 M327 Q328 D332 I333 M334 L351 L369 I384 I568 I575	I326-I330 HydrophobicContact CG2-CD1 3.87Å; I326-I330 WeakPolarHBondContact O-CG1 3.43Å; I326-I330 PolarHBondContact O-N 2.99Å; M327-I330 HydrophobicContact CE-CD1 3.95Å; Q328-I330 PolarHBondContact O-N 3.47Å; I330-D332 VanDerWaalsContact C-N 3.27Å; I330-D332 PolarHBondContact O-N 2.97Å; I330-I333 PolarHBondContact O-N 2.91Å; I330-M334 HydrophobicContact CG2-CE 4.27Å; I330-M334 HydrophobicContact CG2-CG 4.34Å; I330-M334 HydrophobicContact CG2-SD 4.22Å; I330-M334 WeakPolarHBondContact O-CB 3.38Å; I330-M334 WeakPolarHBondContact O-CG 3.31Å; I330-M334 PolarHBondContact O-N 3.15Å; I330-L351 HydrophobicContact CG2-CD1 3.84Å; I330-L369 HydrophobicContact CD1-CD1 4.09Å; I330-I384 HydrophobicContact CD1-CD1 3.94Å; I330-I568 HydrophobicContact CD1-CD1 3.76Å; I330-I568 HydrophobicContact CG1-CD1 3.57Å; I330-I575 HydrophobicContact CG2-CD1 3.88Å
331	S	92.1	Very high	90.2	Very high	14 Å²	14	48.1 Å²	48.1	10%	0.098	25%	0.245	C	C	.	.	H	α-helix	trans	-62.4	-33	179.6	-66	0	0	0	0	113.4	M327 Q328 I329 R335 L348	M327-S331 WeakPolarHBondContact O-CB 3.41Å; M327-S331 PolarHBondContact O-N 2.6Å; M327-S331 PolarHBondContact O-OG 3.04Å; Q328-S331 WeakPolarHBondContact O-CB 3.44Å; Q328-S331 PolarHBondContact O-N 2.79Å; Q328-S331 VanDerWaalsContact O-N 3.14Å; I329-S331 VanDerWaalsContact C-N 3.32Å; I329-S331 PolarHBondContact O-N 3.15Å; S331-R335 WeakPolarHBondContact O-CB 3.43Å; S331-R335 PolarHBondContact O-N 3.21Å; S331-R335 PolarHBondContact O-NH2 2.99Å; S331-L348 WeakPolarHBondContact OG-CD2 3.4Å
332	D	92.2	Very high	90.4	Very high	47 Å²	47	43.1 Å²	43.1	25%	0.251	23%	0.232	S	C	.	.	H	α-helix	trans	-81.4	-45.9	179.5	-63.9	-28.4	0	0	0	110.7	Q328 I329 I330 M334 R335 D336	Q328-D332 PolarHBondContact NE2-OD1 3.2Å; Q328-D332 PolarHBondContact NE2-OD2 3.27Å; Q328-D332 VanDerWaalsContact O-CG 3.24Å; Q328-D332 PolarHBondContact O-N 3.45Å; I329-D332 PolarHBondContact O-N 3.31Å; I330-D332 VanDerWaalsContact C-N 3.27Å; I330-D332 PolarHBondContact O-N 2.97Å; D332-M334 PolarHBondContact O-N 3.32Å; D332-R335 PolarHBondContact O-N 2.99Å; D332-R335 VanDerWaalsContact O-N 3.16Å; D332-R335 IonicContact OD1-CZ 2.93Å; D332-R335 IonicContact OD1-NH1 3.53Å; D332-R335 PolarHBondContact OD1-NH1 2.83Å; D332-R335 IonicContact OD1-NH2 2.74Å; D332-R335 PolarHBondContact OD1-NH2 3.5Å; D332-D336 PolarHBondContact O-N 2.92Å
333	I	92.6	Very high	90.8	Very high	26 Å²	26	45 Å²	45	13%	0.133	23%	0.232	C	C	.	.	H	α-helix	trans	-54.9	-49.5	173.8	-65.7	165.1	0	0	0	110.7	I329 I330 R335 D336 T337 F566 I575 V577	I329-I333 HydrophobicContact CG2-CD1 3.6Å; I329-I333 HydrophobicContact CG2-CG1 4.37Å; I329-I333 VanDerWaalsContact O-CG1 3.29Å; I329-I333 WeakPolarHBondContact O-CG1 3.29Å; I329-I333 PolarHBondContact O-N 2.95Å; I330-I333 PolarHBondContact O-N 2.91Å; I333-R335 PolarHBondContact O-N 2.79Å; I333-D336 PolarHBondContact O-N 3.1Å; I333-T337 WeakPolarHBondContact O-CB 3.26Å; I333-T337 PolarHBondContact O-N 2.97Å; I333-T337 PolarHBondContact O-OG1 2.88Å; I333-F566 HydrophobicContact CD1-CB 3.91Å; I333-F566 HydrophobicContact CD1-CG 4.4Å; I333-F566 HydrophobicContact CG2-CB 4.45Å; I333-F566 HydrophobicContact CG2-CD2 3.67Å; I333-F566 HydrophobicContact CG2-CE2 3.98Å; I333-F566 HydrophobicContact CG2-CG 3.98Å; I333-I575 HydrophobicContact CD1-CG2 4.03Å; I333-I575 HydrophobicContact CG2-CG2 4.29Å; I333-V577 HydrophobicContact CG2-CG2 3.99Å
334	M	91.6	Very high	90.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.9	-40.3	179.1	-70	-168.2	-44.2	0	0	112.4	I330 D332 D336 Y338 L347 L348 L351 L373 L382 I575	I330-M334 HydrophobicContact CG2-CE 4.27Å; I330-M334 HydrophobicContact CG2-CG 4.34Å; I330-M334 HydrophobicContact CG2-SD 4.22Å; I330-M334 WeakPolarHBondContact O-CB 3.38Å; I330-M334 WeakPolarHBondContact O-CG 3.31Å; I330-M334 PolarHBondContact O-N 3.15Å; D332-M334 PolarHBondContact O-N 3.32Å; M334-D336 VanDerWaalsContact C-N 3.29Å; M334-D336 PolarHBondContact O-N 2.81Å; M334-Y338 WeakPolarHBondContact O-CB 3.34Å; M334-Y338 PolarHBondContact O-N 3.39Å; M334-L347 HydrophobicContact CE-CB 4.19Å; M334-L348 HydrophobicContact CE-CD2 4.03Å; M334-L351 HydrophobicContact CE-CD1 3.43Å; M334-L351 VanDerWaalsContact CE-CD1 3.43Å; M334-L351 HydrophobicContact CE-CG 4.31Å; M334-L373 HydrophobicContact CE-CD2 4.16Å; M334-L373 HydrophobicContact SD-CD2 3.78Å; M334-L382 HydrophobicContact SD-CD1 4.46Å; M334-L382 HydrophobicContact SD-CD2 4.37Å; M334-I575 HydrophobicContact CG-CD1 4.32Å
335	R	91.1	Very high	91.1	Very high	95 Å²	95	45.1 Å²	45.1	36%	0.358	24%	0.235	S	C	.	.	H	α-helix	trans	-62.6	-39.9	179.9	-169.2	-172.7	-47.1	109.8	14.6	111.9	S331 D332 I333 V344 R499	S331-R335 WeakPolarHBondContact O-CB 3.43Å; S331-R335 PolarHBondContact O-N 3.21Å; S331-R335 PolarHBondContact O-NH2 2.99Å; D332-R335 PolarHBondContact O-N 2.99Å; D332-R335 VanDerWaalsContact O-N 3.16Å; D332-R335 IonicContact OD1-CZ 2.93Å; D332-R335 IonicContact OD1-NH1 3.53Å; D332-R335 PolarHBondContact OD1-NH1 2.83Å; D332-R335 IonicContact OD1-NH2 2.74Å; D332-R335 PolarHBondContact OD1-NH2 3.5Å; I333-R335 PolarHBondContact O-N 2.79Å; R335-V344 HydrophobicContact CB-CG1 4.33Å; R335-V344 HydrophobicContact CG-CG1 4.37Å; R335-R499 PolarHBondContact O-NH2 3.43Å
336	D	89.7	Confident	91.2	Very high	102 Å²	102	42.9 Å²	42.9	55%	0.545	23%	0.231	S	C	.	.	H	α-helix	trans	-87.1	-29.7	-172.7	-63.2	-7.4	0	0	0	111.8	D332 I333 M334	D332-D336 PolarHBondContact O-N 2.92Å; I333-D336 PolarHBondContact O-N 3.1Å; M334-D336 VanDerWaalsContact C-N 3.29Å; M334-D336 PolarHBondContact O-N 2.81Å
337	T	92.3	Very high	91.3	Very high	18 Å²	18	42.7 Å²	42.7	11%	0.11	23%	0.23	C	C	.	.	H	α-helix	trans	-119.6	-17.9	-169.3	68.3	0	0	0	0	116.9	I333 R499 F566 F579	I333-T337 WeakPolarHBondContact O-CB 3.26Å; I333-T337 PolarHBondContact O-N 2.97Å; I333-T337 PolarHBondContact O-OG1 2.88Å; T337-R499 WeakPolarHBondContact O-CG 3.3Å; T337-F566 HydrophobicContact CG2-CE2 4.42Å; T337-F566 HydrophobicContact CG2-CZ 3.87Å; T337-F579 VanDerWaalsContact O-CA 3.31Å; T337-F579 WeakPolarHBondContact O-CA 3.48Å; T337-F579 VanDerWaalsContact O-CB 3.27Å; T337-F579 WeakPolarHBondContact O-CB 3.22Å
338	Y	94.3	Very high	91.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.231	C	C	.	.			trans	-74.3	132.1	-176.7	-175.7	-124.9	0	0	0	112.8	M334 F340 R343 V344 L347 S377 L382 R499 V577 P578	M334-Y338 WeakPolarHBondContact O-CB 3.34Å; M334-Y338 PolarHBondContact O-N 3.39Å; Y338-F340 HydrophobicContact CD1-CB 4.24Å; Y338-F340 WeakPolarHBondContact CD1-O 3.41Å; Y338-F340 HydrophobicContact CE1-CB 3.62Å; Y338-F340 HydrophobicContact CE1-CD2 4.44Å; Y338-F340 HydrophobicContact CE2-CD2 4.4Å; Y338-F340 AromaticContact CZ-CD2 3.93Å; Y338-R343 HydrophobicContact CE1-CB 4.24Å; Y338-V344 HydrophobicContact CD1-CG2 3.92Å; Y338-L347 HydrophobicContact CD1-CD1 3.88Å; Y338-L347 HydrophobicContact CE1-CD1 3.38Å; Y338-S377 WeakPolarHBondContact OH-CB 3.5Å; Y338-L382 HydrophobicContact CD2-CD1 4.37Å; Y338-L382 HydrophobicContact CD2-CD2 4.37Å; Y338-L382 HydrophobicContact CE2-CB 4.2Å; Y338-L382 HydrophobicContact CE2-CD2 3.91Å; Y338-L382 HydrophobicContact CE2-CG 4.43Å; Y338-R499 WeakPolarHBondContact O-CG 3.28Å; Y338-V577 HydrophobicContact CD2-CG1 3.92Å; Y338-V577 HydrophobicContact CG-CG1 4.33Å; Y338-P578 WeakPolarHBondContact CA-O 3.38Å; Y338-P578 HydrophobicContact CD2-CG 3.78Å; Y338-P578 HydrophobicContact CE2-CG 3.58Å
339	A	92.1	Very high	91.2	Very high	16 Å²	16	44.3 Å²	44.3	13%	0.132	24%	0.238	C	C	.	.	S	Bend	trans	-64.1	-42.1	-172.4	0	0	0	0	0	114.1	S341 P578 N581	A339-S341 VanDerWaalsContact C-N 3.32Å; A339-S341 PolarHBondContact O-N 2.95Å; A339-P578 PolarHBondContact N-O 3.4Å; A339-N581 HydrophobicContact CB-CB 4.18Å; A339-N581 VanDerWaalsContact CB-CG 3.45Å; A339-N581 WeakPolarHBondContact CB-OD1 3.47Å
340	F	92	Very high	91	Very high	6 Å²	6	45.4 Å²	45.4	3%	0.026	24%	0.242	C	C	.	.			trans	-82	74.4	176.9	-65.8	-81.8	0	0	0	111.4	Y338 D342 R343 V344 N581 Y589 L591	Y338-F340 HydrophobicContact CD1-CB 4.24Å; Y338-F340 WeakPolarHBondContact CD1-O 3.41Å; Y338-F340 HydrophobicContact CE1-CB 3.62Å; Y338-F340 HydrophobicContact CE1-CD2 4.44Å; Y338-F340 HydrophobicContact CE2-CD2 4.4Å; Y338-F340 AromaticContact CZ-CD2 3.93Å; F340-D342 WeakPolarHBondContact CA-OD1 3.14Å; F340-D342 WeakPolarHBondContact CB-OD1 3.29Å; F340-D342 PolarHBondContact O-N 3.45Å; F340-D342 VanDerWaalsContact O-N 3.17Å; F340-R343 HydrophobicContact CB-CB 4.11Å; F340-R343 HydrophobicContact CB-CG 3.91Å; F340-R343 PolarHBondContact O-N 3.28Å; F340-V344 PolarHBondContact O-N 3.21Å; F340-N581 VanDerWaalsContact CD1-ND2 3.32Å; F340-N581 WeakPolarHBondContact CD1-ND2 3.35Å; F340-N581 WeakPolarHBondContact CD2-ND2 3.32Å; F340-N581 WeakPolarHBondContact CE1-ND2 3.49Å; F340-N581 WeakPolarHBondContact CE2-ND2 3.35Å; F340-N581 VanDerWaalsContact CE2-OD1 3.31Å; F340-N581 WeakPolarHBondContact CE2-OD1 3.16Å; F340-N581 WeakPolarHBondContact CG-ND2 3.39Å; F340-N581 WeakPolarHBondContact CZ-ND2 3.44Å; F340-Y589 HydrophobicContact CD1-CE1 4.38Å; F340-Y589 AromaticContact CE1-CD1 3.43Å; F340-Y589 HydrophobicContact CE1-CD1 3.43Å; F340-Y589 VanDerWaalsContact CE1-CD1 3.43Å; F340-Y589 HydrophobicContact CE1-CD2 4.33Å; F340-Y589 AromaticContact CE1-CE1 3.49Å; F340-Y589 HydrophobicContact CE1-CE1 3.49Å; F340-Y589 VanDerWaalsContact CE1-CE1 3.49Å; F340-Y589 HydrophobicContact CE1-CE2 4.39Å; F340-Y589 AromaticContact CE1-CG 3.88Å; F340-Y589 HydrophobicContact CE1-CG 3.88Å; F340-Y589 AromaticContact CE1-CZ 3.99Å; F340-Y589 AromaticContact CZ-CD1 3.43Å; F340-Y589 HydrophobicContact CZ-CD1 3.43Å; F340-Y589 VanDerWaalsContact CZ-CD1 3.43Å; F340-Y589 AromaticContact CZ-CE1 3.99Å; F340-Y589 HydrophobicContact CZ-CE1 3.99Å; F340-Y589 AromaticContact CZ-CG 3.77Å; F340-Y589 HydrophobicContact CZ-CG 3.77Å; F340-L591 HydrophobicContact CE2-CD2 4.07Å; F340-L591 HydrophobicContact CZ-CD2 4.25Å
341	S	88.7	Confident	90.7	Very high	71 Å²	71	45.7 Å²	45.7	50%	0.497	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-21.9	-177.9	61.1	0	0	0	0	114.8	A339	A339-S341 VanDerWaalsContact C-N 3.32Å; A339-S341 PolarHBondContact O-N 2.95Å
342	D	89.9	Confident	90.3	Very high	102 Å²	102	53 Å²	53	55%	0.545	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-41.7	170.4	59.5	-54.9	0	0	0	112.5	F340 V344 S345	F340-D342 WeakPolarHBondContact CA-OD1 3.14Å; F340-D342 WeakPolarHBondContact CB-OD1 3.29Å; F340-D342 PolarHBondContact O-N 3.45Å; F340-D342 VanDerWaalsContact O-N 3.17Å; D342-V344 VanDerWaalsContact C-N 3.32Å; D342-V344 PolarHBondContact O-N 2.86Å; D342-S345 PolarHBondContact O-OG 3.24Å
343	R	92.2	Very high	89.9	Confident	73 Å²	73	54.8 Å²	54.8	28%	0.275	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-16.1	-178.9	-57.9	-178.1	-166.6	-166.1	-0.9	113.1	Y338 F340 S345 T346 L347 S377	Y338-R343 HydrophobicContact CE1-CB 4.24Å; F340-R343 HydrophobicContact CB-CB 4.11Å; F340-R343 HydrophobicContact CB-CG 3.91Å; F340-R343 PolarHBondContact O-N 3.28Å; R343-S345 VanDerWaalsContact C-N 3.33Å; R343-S345 PolarHBondContact O-N 3.19Å; R343-T346 WeakPolarHBondContact O-CB 3.4Å; R343-T346 PolarHBondContact O-N 2.83Å; R343-L347 HydrophobicContact CB-CD1 4.28Å; R343-L347 WeakPolarHBondContact O-CG 3.39Å; R343-L347 PolarHBondContact O-N 2.87Å; R343-S377 PolarHBondContact NH1-O 2.85Å
344	V	91.3	Very high	89.3	Confident	13 Å²	13	54 Å²	54	8%	0.079	29%	0.289	C	S	.	.	H	α-helix	trans	-56.3	-42.6	-177.3	170.4	0	0	0	0	112.6	R335 Y338 F340 D342 T346 L347 L348	R335-V344 HydrophobicContact CB-CG1 4.33Å; R335-V344 HydrophobicContact CG-CG1 4.37Å; Y338-V344 HydrophobicContact CD1-CG2 3.92Å; F340-V344 PolarHBondContact O-N 3.21Å; D342-V344 VanDerWaalsContact C-N 3.32Å; D342-V344 PolarHBondContact O-N 2.86Å; V344-T346 PolarHBondContact O-N 2.63Å; V344-L347 PolarHBondContact O-N 2.61Å; V344-L348 HydrophobicContact CG1-CD1 3.82Å; V344-L348 HydrophobicContact CG1-CG 4.24Å; V344-L348 WeakPolarHBondContact O-CB 3.45Å; V344-L348 WeakPolarHBondContact O-CG 3.43Å; V344-L348 PolarHBondContact O-N 3.25Å
345	S	90.2	Very high	88.7	Confident	83 Å²	83	56.2 Å²	56.2	58%	0.58	30%	0.301	S	S	*	.	H	α-helix	trans	-60.9	-46.3	-179.6	57.7	0	0	0	0	111.7	D342 R343 L348 Q349	D342-S345 PolarHBondContact O-OG 3.24Å; R343-S345 VanDerWaalsContact C-N 3.33Å; R343-S345 PolarHBondContact O-N 3.19Å; S345-L348 PolarHBondContact O-N 3.27Å; S345-Q349 PolarHBondContact O-N 2.9Å; S345-Q349 VanDerWaalsContact O-N 3.13Å
346	T	91.1	Very high	88.1	Confident	61 Å²	61	53.8 Å²	53.8	37%	0.374	29%	0.294	S	S	.	.	H	α-helix	trans	-61.1	-51.1	174.5	-48.8	0	0	0	0	111.1	R343 V344 L348 Q349 H350 A376	R343-T346 WeakPolarHBondContact O-CB 3.4Å; R343-T346 PolarHBondContact O-N 2.83Å; V344-T346 PolarHBondContact O-N 2.63Å; T346-L348 VanDerWaalsContact C-N 3.31Å; T346-L348 PolarHBondContact O-N 3.08Å; T346-Q349 WeakPolarHBondContact O-CA 3.5Å; T346-Q349 WeakPolarHBondContact O-CB 3.38Å; T346-Q349 PolarHBondContact O-N 2.95Å; T346-H350 PolarHBondContact O-CD2 3.23Å; T346-H350 VanDerWaalsContact O-CD2 3.28Å; T346-H350 PolarHBondContact O-N 3.34Å; T346-A376 HydrophobicContact CG2-CB 4.3Å
347	L	90	Very high	87.2	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-57.3	-42.1	179	-71.3	165.7	0	0	0	112.4	M334 Y338 R343 V344 Q349 H350 L351 L373 A376 L382	M334-L347 HydrophobicContact CE-CB 4.19Å; Y338-L347 HydrophobicContact CD1-CD1 3.88Å; Y338-L347 HydrophobicContact CE1-CD1 3.38Å; R343-L347 HydrophobicContact CB-CD1 4.28Å; R343-L347 WeakPolarHBondContact O-CG 3.39Å; R343-L347 PolarHBondContact O-N 2.87Å; V344-L347 PolarHBondContact O-N 2.61Å; L347-Q349 VanDerWaalsContact C-N 3.33Å; L347-Q349 PolarHBondContact O-N 2.81Å; L347-H350 PolarHBondContact O-N 3.19Å; L347-L351 WeakPolarHBondContact O-CG 3.13Å; L347-L351 PolarHBondContact O-N 3.41Å; L347-L373 HydrophobicContact CB-CD2 4.4Å; L347-L373 HydrophobicContact CD2-CB 4.46Å; L347-L373 HydrophobicContact CD2-CD2 3.77Å; L347-A376 HydrophobicContact CD2-CB 3.88Å; L347-L382 HydrophobicContact CD1-CD2 4.17Å
348	L	89.9	Confident	86.2	Confident	27 Å²	27	53.3 Å²	53.3	14%	0.141	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-35.9	174.8	-68.3	175	0	0	0	112.6	S331 M334 V344 S345 T346 Q352	S331-L348 WeakPolarHBondContact OG-CD2 3.4Å; M334-L348 HydrophobicContact CE-CD2 4.03Å; V344-L348 HydrophobicContact CG1-CD1 3.82Å; V344-L348 HydrophobicContact CG1-CG 4.24Å; V344-L348 WeakPolarHBondContact O-CB 3.45Å; V344-L348 WeakPolarHBondContact O-CG 3.43Å; V344-L348 PolarHBondContact O-N 3.25Å; S345-L348 PolarHBondContact O-N 3.27Å; T346-L348 VanDerWaalsContact C-N 3.31Å; T346-L348 PolarHBondContact O-N 3.08Å; L348-Q352 VanDerWaalsContact O-CG 3.31Å; L348-Q352 WeakPolarHBondContact O-CG 3.47Å; L348-Q352 PolarHBondContact O-N 3.05Å
349	Q	88.7	Confident	85.6	Confident	136 Å²	136	53.5 Å²	53.5	64%	0.636	30%	0.297	S	S	*	.	H	α-helix	trans	-69.2	-36.7	174.1	-176.4	175.8	-22.7	0	0	112.4	S345 T346 L347 Q352 S353	S345-Q349 PolarHBondContact O-N 2.9Å; S345-Q349 VanDerWaalsContact O-N 3.13Å; T346-Q349 WeakPolarHBondContact O-CA 3.5Å; T346-Q349 WeakPolarHBondContact O-CB 3.38Å; T346-Q349 PolarHBondContact O-N 2.95Å; L347-Q349 VanDerWaalsContact C-N 3.33Å; L347-Q349 PolarHBondContact O-N 2.81Å; Q349-Q352 PolarHBondContact O-N 3.32Å; Q349-S353 WeakPolarHBondContact O-CB 3.29Å; Q349-S353 PolarHBondContact O-N 3.17Å; Q349-S353 VanDerWaalsContact O-N 3.08Å; Q349-S353 PolarHBondContact O-OG 2.94Å
350	H	86.9	Confident	85	Confident	63 Å²	63	53 Å²	53	29%	0.292	29%	0.293	S	S	.	.	H	α-helix	trans	-68	-38.4	173.2	-80.1	-92	0	0	0	112.4	T346 L347 S353 T354	T346-H350 PolarHBondContact O-CD2 3.23Å; T346-H350 VanDerWaalsContact O-CD2 3.28Å; T346-H350 PolarHBondContact O-N 3.34Å; L347-H350 PolarHBondContact O-N 3.19Å; H350-S353 WeakPolarHBondContact CA-OG 3.45Å; H350-S353 PolarHBondContact O-N 3.07Å; H350-S353 PolarHBondContact O-OG 2.92Å; H350-T354 PolarHBondContact O-N 2.84Å; H350-T354 PolarHBondContact O-OG1 3.07Å
351	L	86.3	Confident	84.7	Confident	7 Å²	7	54.3 Å²	54.3	4%	0.037	30%	0.303	C	S	.	.	H	α-helix	trans	-60.2	-48.5	169.9	-71	-173.1	0	0	0	111.9	M327 I330 M334 L347 S353 T354 L369 L373	M327-L351 HydrophobicContact SD-CD2 4.48Å; I330-L351 HydrophobicContact CG2-CD1 3.84Å; M334-L351 HydrophobicContact CE-CD1 3.43Å; M334-L351 VanDerWaalsContact CE-CD1 3.43Å; M334-L351 HydrophobicContact CE-CG 4.31Å; L347-L351 WeakPolarHBondContact O-CG 3.13Å; L347-L351 PolarHBondContact O-N 3.41Å; L351-S353 VanDerWaalsContact C-N 3.27Å; L351-S353 PolarHBondContact O-N 2.82Å; L351-T354 VanDerWaalsContact O-CB 3.29Å; L351-T354 WeakPolarHBondContact O-CB 3.33Å; L351-T354 PolarHBondContact O-N 3.15Å; L351-T354 PolarHBondContact O-OG1 3.27Å; L351-L369 HydrophobicContact CD2-CD2 3.66Å; L351-L373 HydrophobicContact CD2-CD2 3.97Å; L351-L373 HydrophobicContact CD2-CG 4.28Å; L351-L373 HydrophobicContact CG-CD2 4.17Å
352	Q	84.1	Confident	84.6	Confident	166 Å²	166	53.2 Å²	53.2	78%	0.776	29%	0.29	S	S	*	.	H	α-helix	trans	-64	-27.6	-179.8	-73.2	177.5	23.7	0	0	114.1	L348 Q349	L348-Q352 VanDerWaalsContact O-CG 3.31Å; L348-Q352 WeakPolarHBondContact O-CG 3.47Å; L348-Q352 PolarHBondContact O-N 3.05Å; Q349-Q352 PolarHBondContact O-N 3.32Å
353	S	82	Confident	84.4	Confident	85 Å²	85	50.9 Å²	50.9	59%	0.594	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	2.9	179.4	54.5	0	0	0	0	114.4	Q349 H350 L351 D355	Q349-S353 WeakPolarHBondContact O-CB 3.29Å; Q349-S353 PolarHBondContact O-N 3.17Å; Q349-S353 VanDerWaalsContact O-N 3.08Å; Q349-S353 PolarHBondContact O-OG 2.94Å; H350-S353 WeakPolarHBondContact CA-OG 3.45Å; H350-S353 PolarHBondContact O-N 3.07Å; H350-S353 PolarHBondContact O-OG 2.92Å; L351-S353 VanDerWaalsContact C-N 3.27Å; L351-S353 PolarHBondContact O-N 2.82Å; S353-D355 PolarHBondContact O-N 2.6Å
354	T	81.9	Confident	84.2	Confident	11 Å²	11	51 Å²	51	7%	0.067	29%	0.286	C	S	.	.			trans	-61.9	129.9	-179	-68.1	0	0	0	0	112.3	H350 L351 L356 R368 L369 N372	H350-T354 PolarHBondContact O-N 2.84Å; H350-T354 PolarHBondContact O-OG1 3.07Å; L351-T354 VanDerWaalsContact O-CB 3.29Å; L351-T354 WeakPolarHBondContact O-CB 3.33Å; L351-T354 PolarHBondContact O-N 3.15Å; L351-T354 PolarHBondContact O-OG1 3.27Å; T354-L356 HydrophobicContact CG2-CD2 3.88Å; T354-L356 HydrophobicContact CG2-CG 4.14Å; T354-L356 PolarHBondContact O-N 3.29Å; T354-R368 HydrophobicContact CG2-CG 4.09Å; T354-L369 HydrophobicContact CG2-CD2 4.48Å; T354-N372 WeakPolarHBondContact CB-ND2 3.4Å; T354-N372 WeakPolarHBondContact CG2-ND2 3.47Å; T354-N372 PolarHBondContact OG1-ND2 3.23Å
355	D	78.1	Confident	84	Confident	46 Å²	46	50.4 Å²	50.4	25%	0.246	28%	0.282	C	S	.	.			trans	-76.1	90.6	174.9	-165.6	-17.5	0	0	0	111.5	K249 S353 L357 S358	K249-D355 IonicContact NZ-OD2 2.69Å; K249-D355 PolarHBondContact NZ-OD2 3.23Å; S353-D355 PolarHBondContact O-N 2.6Å; D355-L357 PolarHBondContact O-N 3.25Å; D355-L357 VanDerWaalsContact OD1-CB 3.31Å; D355-L357 WeakPolarHBondContact OD1-CB 3.36Å; D355-L357 PolarHBondContact OD1-N 2.84Å; D355-S358 PolarHBondContact O-OG 3.28Å
356	L	77.6	Confident	84	Confident	43 Å²	43	46.7 Å²	46.7	23%	0.225	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	4.2	179.3	-62.5	164.1	0	0	0	113.6	R320 I323 T354 V359 L365	R320-L356 PolarHBondContact NH1-O 2.9Å; I323-L356 HydrophobicContact CD1-CD2 4.42Å; I323-L356 HydrophobicContact CG2-CD1 3.7Å; I323-L356 HydrophobicContact CG2-CD2 4Å; I323-L356 HydrophobicContact CG2-CG 4.41Å; T354-L356 HydrophobicContact CG2-CD2 3.88Å; T354-L356 HydrophobicContact CG2-CG 4.14Å; T354-L356 PolarHBondContact O-N 3.29Å; L356-V359 HydrophobicContact CD2-CG2 4.3Å; L356-L365 HydrophobicContact CD2-CD1 3.85Å
357	L	71.4	Confident	83.9	Confident	52 Å²	52	47.5 Å²	47.5	27%	0.272	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-15.5	177.7	-63.9	165.8	0	0	0	113.2	K249 I252 D355	K249-L357 HydrophobicContact CB-CD1 3.75Å; K249-L357 HydrophobicContact CD-CD1 4.21Å; K249-L357 HydrophobicContact CG-CD1 4.34Å; K249-L357 WeakPolarHBondContact O-CD1 3.48Å; I252-L357 HydrophobicContact CD1-CD2 4.26Å; I252-L357 HydrophobicContact CG1-CD2 4.19Å; D355-L357 PolarHBondContact O-N 3.25Å; D355-L357 VanDerWaalsContact OD1-CB 3.31Å; D355-L357 WeakPolarHBondContact OD1-CB 3.36Å; D355-L357 PolarHBondContact OD1-N 2.84Å
358	S	71.9	Confident	83.8	Confident	59 Å²	59	51.1 Å²	51.1	41%	0.413	27%	0.274	S	S	.	.	S	Bend	trans	-89.1	-16.6	174.2	56.9	0	0	0	0	114.1	D355 G360	D355-S358 PolarHBondContact O-OG 3.28Å; S358-G360 PolarHBondContact O-N 3.38Å
359	V	82.2	Confident	83.8	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.024	27%	0.268	C	S	.	.			trans	-67.4	120.4	-177.1	174.7	0	0	0	0	110.5	L316 L319 I323 L356 S361 D364 L365 R368	L316-V359 VanDerWaalsContact CD1-O 3.26Å; L316-V359 WeakPolarHBondContact CD1-O 3.35Å; L319-V359 HydrophobicContact CD2-CG1 4.08Å; I323-V359 HydrophobicContact CD1-CG1 4.38Å; L356-V359 HydrophobicContact CD2-CG2 4.3Å; V359-S361 WeakPolarHBondContact CG1-O 3.19Å; V359-D364 HydrophobicContact CG1-CB 4.28Å; V359-L365 HydrophobicContact CG1-CB 3.78Å; V359-L365 HydrophobicContact CG1-CD1 4.27Å; V359-L365 HydrophobicContact CG2-CD1 4.2Å; V359-R368 HydrophobicContact CG2-CB 4.33Å; V359-R368 HydrophobicContact CG2-CG 4.36Å
360	G	79.8	Confident	83.9	Confident	5 Å²	5	44.8 Å²	44.8	5%	0.052	25%	0.245	C	C	.	.			trans	-110.1	-9.2	-179.5	0	0	0	0	0	115.4	K312 S358 D364	K312-G360 VanDerWaalsContact CE-O 3.23Å; K312-G360 WeakPolarHBondContact CE-O 3.36Å; K312-G360 PolarHBondContact NZ-O 3.33Å; S358-G360 PolarHBondContact O-N 3.38Å; G360-D364 WeakPolarHBondContact CA-OD2 3.47Å; G360-D364 PolarHBondContact N-OD2 2.9Å
361	S	84.9	Confident	83.9	Confident	33 Å²	33	46.3 Å²	46.3	23%	0.231	25%	0.252	C	S	.	.	S	Bend	trans	-162.8	173.4	-173.8	61.6	0	0	0	0	110.7	L319 V359 D364 L365	L319-S361 VanDerWaalsContact CD2-C 3.48Å; V359-S361 WeakPolarHBondContact CG1-O 3.19Å; S361-D364 WeakPolarHBondContact CB-OD2 3.4Å; S361-D364 PolarHBondContact N-OD2 3.15Å; S361-D364 PolarHBondContact O-N 2.64Å; S361-D364 PolarHBondContact OG-N 3.5Å; S361-D364 PolarHBondContact OG-OD2 3.28Å; S361-L365 PolarHBondContact O-N 2.76Å
362	E	85.4	Confident	83.9	Confident	48 Å²	48	47.4 Å²	47.4	22%	0.224	26%	0.258	C	S	.	.	H	α-helix	trans	-70	-33.3	173.8	-72.8	179.6	-160.5	0	0	112	L319 L365 A366 Y386 D572 I573	L319-E362 HydrophobicContact CD1-CG 3.68Å; E362-L365 WeakPolarHBondContact O-CB 3.3Å; E362-L365 PolarHBondContact O-N 3.47Å; E362-A366 PolarHBondContact O-N 3.35Å; E362-Y386 HydrophobicContact CB-CD2 4.01Å; E362-Y386 HydrophobicContact CB-CE2 3.78Å; E362-D572 PolarHBondContact OE2-N 2.86Å; E362-I573 HydrophobicContact CB-CD1 3.98Å; E362-I573 HydrophobicContact CB-CG1 4.14Å; E362-I573 HydrophobicContact CG-CD1 4.16Å
363	T	87.5	Confident	84.1	Confident	54 Å²	54	39.5 Å²	39.5	33%	0.331	22%	0.222	S	C	.	.	H	α-helix	trans	-63	-45.5	170.2	-32.7	0	0	0	0	111.7	L365 A366 V367 Y386	T363-L365 PolarHBondContact O-N 3.03Å; T363-A366 PolarHBondContact O-N 3.03Å; T363-V367 WeakPolarHBondContact O-CG2 3.28Å; T363-V367 PolarHBondContact O-N 2.63Å; T363-Y386 HydrophobicContact CG2-CD1 4.45Å; T363-Y386 HydrophobicContact CG2-CG 4.47Å
364	D	86.4	Confident	84.5	Confident	76 Å²	76	38.4 Å²	38.4	41%	0.406	21%	0.207	S	C	.	.	H	α-helix	trans	-60	-34.7	173.4	-64.2	-55.1	0	0	0	111.5	V359 G360 S361 R368	V359-D364 HydrophobicContact CG1-CB 4.28Å; G360-D364 WeakPolarHBondContact CA-OD2 3.47Å; G360-D364 PolarHBondContact N-OD2 2.9Å; S361-D364 WeakPolarHBondContact CB-OD2 3.4Å; S361-D364 PolarHBondContact N-OD2 3.15Å; S361-D364 PolarHBondContact O-N 2.64Å; S361-D364 PolarHBondContact OG-N 3.5Å; S361-D364 PolarHBondContact OG-OD2 3.28Å; D364-R368 WeakPolarHBondContact O-CB 3.35Å; D364-R368 PolarHBondContact O-N 3.41Å
365	L	88.4	Confident	84.7	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-68	-51.5	177.9	-176.9	60.4	0	0	0	110.5	L319 I323 I326 L356 V359 S361 E362 T363 V367 R368 L369 I573	L319-L365 HydrophobicContact CD1-CD2 4.43Å; I323-L365 HydrophobicContact CD1-CD1 4.3Å; I323-L365 HydrophobicContact CD1-CD2 4.37Å; I323-L365 HydrophobicContact CG1-CD1 4.36Å; I323-L365 HydrophobicContact CG1-CD2 3.84Å; I326-L365 HydrophobicContact CD1-CD2 3.89Å; I326-L365 HydrophobicContact CG2-CD2 4.43Å; L356-L365 HydrophobicContact CD2-CD1 3.85Å; V359-L365 HydrophobicContact CG1-CB 3.78Å; V359-L365 HydrophobicContact CG1-CD1 4.27Å; V359-L365 HydrophobicContact CG2-CD1 4.2Å; S361-L365 PolarHBondContact O-N 2.76Å; E362-L365 WeakPolarHBondContact O-CB 3.3Å; E362-L365 PolarHBondContact O-N 3.47Å; T363-L365 PolarHBondContact O-N 3.03Å; L365-V367 PolarHBondContact O-N 3.34Å; L365-R368 PolarHBondContact O-N 2.88Å; L365-R368 VanDerWaalsContact O-N 3.16Å; L365-L369 HydrophobicContact CD1-CD1 3.83Å; L365-L369 HydrophobicContact CD1-CD2 4.42Å; L365-L369 HydrophobicContact CD1-CG 4.03Å; L365-L369 HydrophobicContact CG-CD1 3.72Å; L365-L369 HydrophobicContact CG-CG 4.35Å; L365-L369 WeakPolarHBondContact O-CB 3.46Å; L365-L369 WeakPolarHBondContact O-CG 3.45Å; L365-L369 PolarHBondContact O-N 2.92Å; L365-I573 HydrophobicContact CD2-CD1 3.98Å
366	A	88.9	Confident	84.9	Confident	4 Å²	4	41.3 Å²	41.3	3%	0.033	23%	0.229	C	C	.	.	H	α-helix	trans	-55.6	-49.6	177.2	0	0	0	0	0	111.8	E362 T363 R368 L369 N370 I384	E362-A366 PolarHBondContact O-N 3.35Å; T363-A366 PolarHBondContact O-N 3.03Å; A366-R368 VanDerWaalsContact C-N 3.34Å; A366-R368 PolarHBondContact O-N 3.12Å; A366-L369 PolarHBondContact O-N 2.99Å; A366-N370 WeakPolarHBondContact O-CB 3.4Å; A366-N370 VanDerWaalsContact O-CG 3.26Å; A366-N370 PolarHBondContact O-N 2.86Å; A366-N370 PolarHBondContact O-ND2 2.83Å; A366-I384 HydrophobicContact CB-CG2 3.87Å
367	V	89.3	Confident	85.5	Confident	79 Å²	79	39.3 Å²	39.3	48%	0.479	22%	0.218	S	C	.	.	H	α-helix	trans	-59	-43.8	176.1	172.6	0	0	0	0	111.7	T363 L365 N370 Q371	T363-V367 WeakPolarHBondContact O-CG2 3.28Å; T363-V367 PolarHBondContact O-N 2.63Å; L365-V367 PolarHBondContact O-N 3.34Å; V367-N370 PolarHBondContact O-N 3.43Å; V367-Q371 WeakPolarHBondContact O-CG 3.49Å; V367-Q371 PolarHBondContact O-N 2.88Å
368	R	88.4	Confident	86.3	Confident	75 Å²	75	43.9 Å²	43.9	28%	0.283	24%	0.238	S	C	.	.	H	α-helix	trans	-70.2	-32.9	-177.7	-169.9	53.4	158.3	169.8	1.6	113.2	T354 V359 D364 L365 A366 N372	T354-R368 HydrophobicContact CG2-CG 4.09Å; V359-R368 HydrophobicContact CG2-CB 4.33Å; V359-R368 HydrophobicContact CG2-CG 4.36Å; D364-R368 WeakPolarHBondContact O-CB 3.35Å; D364-R368 PolarHBondContact O-N 3.41Å; L365-R368 PolarHBondContact O-N 2.88Å; L365-R368 VanDerWaalsContact O-N 3.16Å; A366-R368 VanDerWaalsContact C-N 3.34Å; A366-R368 PolarHBondContact O-N 3.12Å; R368-N372 PolarHBondContact O-N 2.92Å
369	L	89.7	Confident	87.2	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-73	-45.1	174.6	-63.9	166.7	0	0	0	110.6	M327 I330 L351 T354 L365 A366 Q371 N372 L373 I384	M327-L369 HydrophobicContact CE-CD1 3.47Å; M327-L369 VanDerWaalsContact CE-CD1 3.47Å; M327-L369 HydrophobicContact CE-CD2 3.47Å; M327-L369 VanDerWaalsContact CE-CD2 3.47Å; M327-L369 HydrophobicContact CE-CG 4.1Å; M327-L369 HydrophobicContact SD-CD2 3.67Å; I330-L369 HydrophobicContact CD1-CD1 4.09Å; L351-L369 HydrophobicContact CD2-CD2 3.66Å; T354-L369 HydrophobicContact CG2-CD2 4.48Å; L365-L369 HydrophobicContact CD1-CD1 3.83Å; L365-L369 HydrophobicContact CD1-CD2 4.42Å; L365-L369 HydrophobicContact CD1-CG 4.03Å; L365-L369 HydrophobicContact CG-CD1 3.72Å; L365-L369 HydrophobicContact CG-CG 4.35Å; L365-L369 WeakPolarHBondContact O-CB 3.46Å; L365-L369 WeakPolarHBondContact O-CG 3.45Å; L365-L369 PolarHBondContact O-N 2.92Å; A366-L369 PolarHBondContact O-N 2.99Å; L369-Q371 VanDerWaalsContact C-N 3.32Å; L369-Q371 PolarHBondContact O-N 2.73Å; L369-N372 PolarHBondContact O-N 3.22Å; L369-N372 VanDerWaalsContact O-N 3.07Å; L369-L373 WeakPolarHBondContact O-CB 3.34Å; L369-L373 WeakPolarHBondContact O-CG 3.37Å; L369-L373 PolarHBondContact O-N 3.47Å; L369-I384 HydrophobicContact CB-CD1 3.56Å; L369-I384 HydrophobicContact CD1-CD1 3.88Å; L369-I384 HydrophobicContact CG-CD1 4.34Å
370	N	90.9	Very high	87.4	Confident	31 Å²	31	44.9 Å²	44.9	17%	0.166	24%	0.243	C	C	.	.	H	α-helix	trans	-56.6	-43.8	175.5	-72.9	-18.7	0	0	0	112.1	A366 V367 N372 L373 Q374 I384	A366-N370 WeakPolarHBondContact O-CB 3.4Å; A366-N370 VanDerWaalsContact O-CG 3.26Å; A366-N370 PolarHBondContact O-N 2.86Å; A366-N370 PolarHBondContact O-ND2 2.83Å; V367-N370 PolarHBondContact O-N 3.43Å; N370-N372 VanDerWaalsContact C-N 3.3Å; N370-N372 PolarHBondContact O-N 2.81Å; N370-L373 PolarHBondContact O-N 3.23Å; N370-Q374 VanDerWaalsContact O-CB 3.27Å; N370-Q374 WeakPolarHBondContact O-CB 3.39Å; N370-Q374 VanDerWaalsContact O-CG 3.29Å; N370-Q374 WeakPolarHBondContact O-CG 3.27Å; N370-Q374 PolarHBondContact O-N 3.49Å; N370-I384 PolarHBondContact ND2-O 3.06Å; N370-I384 WeakPolarHBondContact OD1-CB 3.4Å; N370-I384 PolarHBondContact OD1-N 2.98Å
371	Q	87.7	Confident	87.8	Confident	94 Å²	94	45.8 Å²	45.8	44%	0.439	25%	0.245	S	C	.	.	H	α-helix	trans	-53.4	-46.7	174.1	-76.3	171.8	-1.5	0	0	112.3	V367 L369 T375	V367-Q371 WeakPolarHBondContact O-CG 3.49Å; V367-Q371 PolarHBondContact O-N 2.88Å; L369-Q371 VanDerWaalsContact C-N 3.32Å; L369-Q371 PolarHBondContact O-N 2.73Å; Q371-T375 WeakPolarHBondContact O-CB 3.47Å; Q371-T375 PolarHBondContact O-N 3.06Å; Q371-T375 PolarHBondContact O-OG1 2.87Å
372	N	85.9	Confident	88.1	Confident	31 Å²	31	44.2 Å²	44.2	17%	0.166	23%	0.234	C	C	.	.	H	α-helix	trans	-80.3	-30.7	-176	-70.5	-6.9	0	0	0	113.2	T354 R368 L369 N370	T354-N372 WeakPolarHBondContact CB-ND2 3.4Å; T354-N372 WeakPolarHBondContact CG2-ND2 3.47Å; T354-N372 PolarHBondContact OG1-ND2 3.23Å; R368-N372 PolarHBondContact O-N 2.92Å; L369-N372 PolarHBondContact O-N 3.22Å; L369-N372 VanDerWaalsContact O-N 3.07Å; N370-N372 VanDerWaalsContact C-N 3.3Å; N370-N372 PolarHBondContact O-N 2.81Å
373	L	88.8	Confident	88.3	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-70	-53	173.7	-70.7	174.2	0	0	0	110.4	M334 L347 L351 L369 N370 T375 A376 S377 I384	M334-L373 HydrophobicContact CE-CD2 4.16Å; M334-L373 HydrophobicContact SD-CD2 3.78Å; L347-L373 HydrophobicContact CB-CD2 4.4Å; L347-L373 HydrophobicContact CD2-CB 4.46Å; L347-L373 HydrophobicContact CD2-CD2 3.77Å; L351-L373 HydrophobicContact CD2-CD2 3.97Å; L351-L373 HydrophobicContact CD2-CG 4.28Å; L351-L373 HydrophobicContact CG-CD2 4.17Å; L369-L373 WeakPolarHBondContact O-CB 3.34Å; L369-L373 WeakPolarHBondContact O-CG 3.37Å; L369-L373 PolarHBondContact O-N 3.47Å; N370-L373 PolarHBondContact O-N 3.23Å; L373-T375 VanDerWaalsContact C-N 3.26Å; L373-T375 PolarHBondContact O-N 2.87Å; L373-A376 CarbonylContact O-C 3.57Å; L373-A376 PolarHBondContact O-N 3.32Å; L373-S377 WeakPolarHBondContact O-CB 3.48Å; L373-S377 PolarHBondContact O-N 3.3Å; L373-S377 PolarHBondContact O-OG 3.28Å; L373-S377 VanDerWaalsContact O-OG 3.12Å; L373-I384 HydrophobicContact CD1-CD1 3.58Å; L373-I384 HydrophobicContact CD1-CG1 4.25Å
374	Q	89.2	Confident	88.5	Confident	61 Å²	61	42.3 Å²	42.3	29%	0.285	22%	0.223	S	C	.	.	H	α-helix	trans	-60.1	-34.5	-178.3	-70.2	-64.6	-36.7	0	0	112.8	N370 A376 S377 E378 D379 L382	N370-Q374 VanDerWaalsContact O-CB 3.27Å; N370-Q374 WeakPolarHBondContact O-CB 3.39Å; N370-Q374 VanDerWaalsContact O-CG 3.29Å; N370-Q374 WeakPolarHBondContact O-CG 3.27Å; N370-Q374 PolarHBondContact O-N 3.49Å; Q374-A376 PolarHBondContact O-N 3.33Å; Q374-A376 VanDerWaalsContact O-N 3.16Å; Q374-S377 WeakPolarHBondContact CA-OG 3.44Å; Q374-E378 PolarHBondContact O-N 3.46Å; Q374-E378 VanDerWaalsContact O-N 3.08Å; Q374-D379 PolarHBondContact NE2-O 3.33Å; Q374-D379 PolarHBondContact OE1-O 3.14Å; Q374-L382 PolarHBondContact NE2-O 3.29Å
375	T	85.5	Confident	88.5	Confident	100 Å²	100	43.7 Å²	43.7	61%	0.613	22%	0.222	S	C	*	.	H	α-helix	trans	-62.7	-16.3	173.7	-57.5	0	0	0	0	113.7	Q371 L373	Q371-T375 WeakPolarHBondContact O-CB 3.47Å; Q371-T375 PolarHBondContact O-N 3.06Å; Q371-T375 PolarHBondContact O-OG1 2.87Å; L373-T375 VanDerWaalsContact C-N 3.26Å; L373-T375 PolarHBondContact O-N 2.87Å
376	A	84	Confident	88.4	Confident	19 Å²	19	45.7 Å²	45.7	16%	0.157	23%	0.23	C	C	.	.	H	α-helix	trans	-127.8	-12.5	-177	0	0	0	0	0	114.3	T346 L347 L373 Q374	T346-A376 HydrophobicContact CG2-CB 4.3Å; L347-A376 HydrophobicContact CD2-CB 3.88Å; L373-A376 CarbonylContact O-C 3.57Å; L373-A376 PolarHBondContact O-N 3.32Å; Q374-A376 PolarHBondContact O-N 3.33Å; Q374-A376 VanDerWaalsContact O-N 3.16Å
377	S	88.5	Confident	87.8	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-95.4	-40	173.3	63.9	0	0	0	0	112.1	Y338 R343 L373 Q374 D379	Y338-S377 WeakPolarHBondContact OH-CB 3.5Å; R343-S377 PolarHBondContact NH1-O 2.85Å; L373-S377 WeakPolarHBondContact O-CB 3.48Å; L373-S377 PolarHBondContact O-N 3.3Å; L373-S377 PolarHBondContact O-OG 3.28Å; L373-S377 VanDerWaalsContact O-OG 3.12Å; Q374-S377 WeakPolarHBondContact CA-OG 3.44Å; S377-D379 PolarHBondContact O-N 2.7Å; S377-D379 VanDerWaalsContact O-N 3.11Å; S377-D379 PolarHBondContact OG-N 2.73Å
378	E	89.1	Confident	86.7	Confident	149 Å²	149	51.8 Å²	51.8	70%	0.696	25%	0.253	S	S	*	.			trans	49	25.1	-164.3	-61.1	-179.7	160.8	0	0	112.8	Q374	Q374-E378 PolarHBondContact O-N 3.46Å; Q374-E378 VanDerWaalsContact O-N 3.08Å
379	D	90.2	Very high	85	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.27	C	S	.	.			trans	-116.1	101.7	-174.7	-171.2	-21	0	0	0	109.8	Q374 S377 R381 L382 P578	Q374-D379 PolarHBondContact NE2-O 3.33Å; Q374-D379 PolarHBondContact OE1-O 3.14Å; S377-D379 PolarHBondContact O-N 2.7Å; S377-D379 VanDerWaalsContact O-N 3.11Å; S377-D379 PolarHBondContact OG-N 2.73Å; D379-R381 PolarHBondContact O-N 3.26Å; D379-R381 VanDerWaalsContact O-N 3.1Å; D379-R381 VanDerWaalsContact OD1-CB 3.24Å; D379-R381 WeakPolarHBondContact OD1-CB 3.37Å; D379-R381 WeakPolarHBondContact OD1-CG 3.23Å; D379-R381 IonicContact OD1-CZ 2.74Å; D379-R381 PolarHBondContact OD1-N 3.17Å; D379-R381 VanDerWaalsContact OD1-N 3.1Å; D379-R381 IonicContact OD1-NE 3.66Å; D379-R381 PolarHBondContact OD1-NE 3.41Å; D379-R381 IonicContact OD1-NH2 3.27Å; D379-R381 IonicContact OD2-CZ 3.61Å; D379-R381 IonicContact OD2-NE 3.42Å; D379-R381 PolarHBondContact OD2-NE 3.2Å; D379-R381 IonicContact OD2-NH2 3.62Å; D379-R381 PolarHBondContact OD2-NH2 2.99Å; D379-L382 PolarHBondContact O-N 3.04Å; D379-L382 VanDerWaalsContact O-N 3.09Å; D379-P578 WeakPolarHBondContact OD2-CG 3.36Å
380	P	86.9	Confident	83	Confident	84 Å²	84	57.7 Å²	57.7	55%	0.545	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-14.2	-174.8	28	-35.3	0	0	0	113.3	L382 L591	P380-L382 VanDerWaalsContact C-N 3.32Å; P380-L591 HydrophobicContact CG-CB 4.39Å
381	R	87.4	Confident	80.6	Confident	24 Å²	24	64.4 Å²	64.4	9%	0.091	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-23.7	176.5	-51	172	-67.1	168.3	9.9	112.2	D379 I383 P578 I580 N581 L591	D379-R381 PolarHBondContact O-N 3.26Å; D379-R381 VanDerWaalsContact O-N 3.1Å; D379-R381 VanDerWaalsContact OD1-CB 3.24Å; D379-R381 WeakPolarHBondContact OD1-CB 3.37Å; D379-R381 WeakPolarHBondContact OD1-CG 3.23Å; D379-R381 IonicContact OD1-CZ 2.74Å; D379-R381 PolarHBondContact OD1-N 3.17Å; D379-R381 VanDerWaalsContact OD1-N 3.1Å; D379-R381 IonicContact OD1-NE 3.66Å; D379-R381 PolarHBondContact OD1-NE 3.41Å; D379-R381 IonicContact OD1-NH2 3.27Å; D379-R381 IonicContact OD2-CZ 3.61Å; D379-R381 IonicContact OD2-NE 3.42Å; D379-R381 PolarHBondContact OD2-NE 3.2Å; D379-R381 IonicContact OD2-NH2 3.62Å; D379-R381 PolarHBondContact OD2-NH2 2.99Å; R381-I383 PolarHBondContact O-N 2.93Å; R381-P578 HydrophobicContact CB-CB 3.85Å; R381-P578 HydrophobicContact CB-CG 3.87Å; R381-I580 PolarHBondContact NH1-O 2.84Å; R381-N581 PolarHBondContact NH2-OD1 2.73Å; R381-L591 VanDerWaalsContact CD-O 3.24Å; R381-L591 WeakPolarHBondContact CD-O 3.39Å; R381-L591 WeakPolarHBondContact CG-O 3.19Å
382	L	91.1	Very high	78.2	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.337	C	S	.	.			trans	-85.2	94.7	178.3	-179.2	64.3	0	0	0	110.4	M334 Y338 L347 Q374 D379 P380 I575 V577	M334-L382 HydrophobicContact SD-CD1 4.46Å; M334-L382 HydrophobicContact SD-CD2 4.37Å; Y338-L382 HydrophobicContact CD2-CD1 4.37Å; Y338-L382 HydrophobicContact CD2-CD2 4.37Å; Y338-L382 HydrophobicContact CE2-CB 4.2Å; Y338-L382 HydrophobicContact CE2-CD2 3.91Å; Y338-L382 HydrophobicContact CE2-CG 4.43Å; L347-L382 HydrophobicContact CD1-CD2 4.17Å; Q374-L382 PolarHBondContact NE2-O 3.29Å; D379-L382 PolarHBondContact O-N 3.04Å; D379-L382 VanDerWaalsContact O-N 3.09Å; P380-L382 VanDerWaalsContact C-N 3.32Å; L382-I575 HydrophobicContact CD1-CD1 4.28Å; L382-V577 HydrophobicContact CD1-CB 4.35Å; L382-V577 HydrophobicContact CD1-CG1 4.21Å; L382-V577 HydrophobicContact CD1-CG2 3.96Å
383	I	90.8	Very high	76	Confident	58 Å²	58	65.6 Å²	65.6	30%	0.297	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	135.5	-173.6	-171.5	168.6	0	0	0	112.9	R381 R385 T576	R381-I383 PolarHBondContact O-N 2.93Å; I383-R385 HydrophobicContact CG1-CG 4.37Å; I383-T576 PolarHBondContact N-O 3.44Å; I383-T576 VanDerWaalsContact N-O 3.09Å; I383-T576 PolarHBondContact O-N 3.16Å
384	I	90.9	Very high	73.7	Confident	3 Å²	3	72.9 Å²	72.9	2%	0.015	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	130.3	170.7	-61.7	164.7	0	0	0	108.4	I330 A366 L369 N370 L373 I573 A574 I575	I330-I384 HydrophobicContact CD1-CD1 3.94Å; A366-I384 HydrophobicContact CB-CG2 3.87Å; L369-I384 HydrophobicContact CB-CD1 3.56Å; L369-I384 HydrophobicContact CD1-CD1 3.88Å; L369-I384 HydrophobicContact CG-CD1 4.34Å; N370-I384 PolarHBondContact ND2-O 3.06Å; N370-I384 WeakPolarHBondContact OD1-CB 3.4Å; N370-I384 PolarHBondContact OD1-N 2.98Å; L373-I384 HydrophobicContact CD1-CD1 3.58Å; L373-I384 HydrophobicContact CD1-CG1 4.25Å; I384-I573 HydrophobicContact CG2-CG2 3.39Å; I384-A574 CarbonylContact C-O 2.94Å; I384-A574 WeakPolarHBondContact CA-O 3.26Å; I384-I575 HydrophobicContact CD1-CD1 4.26Å; I384-I575 HydrophobicContact CG1-CB 4.05Å; I384-I575 HydrophobicContact CG1-CD1 3.77Å; I384-I575 HydrophobicContact CG1-CG1 3.71Å
385	R	88.1	Confident	71.6	Confident	106 Å²	106	77 Å²	77	40%	0.4	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	155.6	-177.8	-53.4	-166.1	-165.2	-175.6	3.9	111.8	I383 D390 I573 A574	I383-R385 HydrophobicContact CG1-CG 4.37Å; R385-D390 WeakPolarHBondContact CD-OD2 3.31Å; R385-D390 IonicContact CZ-OD2 3.59Å; R385-D390 IonicContact NE-OD2 3.58Å; R385-D390 IonicContact NH1-OD1 2.64Å; R385-D390 IonicContact NH1-OD2 3.62Å; R385-D390 PolarHBondContact NH1-OD2 2.66Å; R385-I573 WeakPolarHBondContact O-CA 3.14Å; R385-A574 PolarHBondContact N-O 3.36Å; R385-A574 PolarHBondContact O-N 2.72Å; R385-A574 VanDerWaalsContact O-N 3.08Å
386	Y	84.9	Confident	69.2	Low	42 Å²	42	80 Å²	80	17%	0.165	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	120.7	170.7	-176	-110.2	0	0	0	108.6	E362 T363 Q388 D389 D572	E362-Y386 HydrophobicContact CB-CD2 4.01Å; E362-Y386 HydrophobicContact CB-CE2 3.78Å; T363-Y386 HydrophobicContact CG2-CD1 4.45Å; T363-Y386 HydrophobicContact CG2-CG 4.47Å; Y386-Q388 HydrophobicContact CD1-CB 4.21Å; Y386-Q388 HydrophobicContact CE1-CB 3.71Å; Y386-Q388 HydrophobicContact CE1-CG 3.83Å; Y386-Q388 PolarHBondContact O-N 2.83Å; Y386-Q388 VanDerWaalsContact O-N 3.11Å; Y386-Q388 PolarHBondContact OH-NE2 3.12Å; Y386-D389 PolarHBondContact O-N 2.87Å; Y386-D572 HydrophobicContact CD2-CB 4.05Å; Y386-D572 WeakPolarHBondContact CD2-O 3.26Å; Y386-D572 HydrophobicContact CE2-CB 3.45Å; Y386-D572 VanDerWaalsContact CE2-CB 3.45Å; Y386-D572 PolarHBondContact OH-OD2 3.33Å
387	M	77.3	Confident	67.1	Low	74 Å²	74	85.7 Å²	85.7	37%	0.365	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-7	-161	-64.3	-166	-70.1	0	0	115.2	E567 D572 A574	M387-E567 HydrophobicContact SD-CG 3.93Å; M387-D572 PolarHBondContact N-O 3.43Å; M387-A574 HydrophobicContact CG-CB 4.07Å; M387-A574 HydrophobicContact SD-CB 3.97Å
388	Q	66.5	Low	65.2	Low	136 Å²	136	91 Å²	91	64%	0.636	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-7.4	175.6	-52.9	-169.7	12.9	0	0	113.8	Y386 D572	Y386-Q388 HydrophobicContact CD1-CB 4.21Å; Y386-Q388 HydrophobicContact CE1-CB 3.71Å; Y386-Q388 HydrophobicContact CE1-CG 3.83Å; Y386-Q388 PolarHBondContact O-N 2.83Å; Y386-Q388 VanDerWaalsContact O-N 3.11Å; Y386-Q388 PolarHBondContact OH-NE2 3.12Å; Q388-D572 PolarHBondContact NE2-OD2 2.89Å
389	D	51.1	Low	63.1	Low	118 Å²	118	92.7 Å²	92.7	63%	0.631	49%	0.487	S	S	*	.	S	Bend	trans	-92.1	-23.3	178.5	-67.4	-50.9	0	0	0	113.1	Y386	Y386-D389 PolarHBondContact O-N 2.87Å
390	D	49.4	Very low	61.3	Low	82 Å²	82	99 Å²	99	44%	0.439	52%	0.52	S	S	.	.			trans	-99.5	78.1	-178.6	-87.6	-25.4	0	0	0	112.3	R385 A392	R385-D390 WeakPolarHBondContact CD-OD2 3.31Å; R385-D390 IonicContact CZ-OD2 3.59Å; R385-D390 IonicContact NE-OD2 3.58Å; R385-D390 IonicContact NH1-OD1 2.64Å; R385-D390 IonicContact NH1-OD2 3.62Å; R385-D390 PolarHBondContact NH1-OD2 2.66Å; D390-A392 PolarHBondContact O-N 2.76Å; D390-A392 VanDerWaalsContact O-N 3.09Å
391	D	38.8	Very low	59.9	Low	172 Å²	172	102.2 Å²	102.2	92%	0.92	52%	0.523	S	S	*	.			trans	-80.6	29.2	169.8	-154.2	15.7	0	0	0	112
392	A	37.1	Very low	58.8	Low	79 Å²	79	105.3 Å²	105.3	65%	0.653	54%	0.544	S	S	*	.	S	Bend	trans	-144.1	91.5	-168	0	0	0	0	0	112.6	D390	D390-A392 PolarHBondContact O-N 2.76Å; D390-A392 VanDerWaalsContact O-N 3.09Å
393	G	41.4	Very low	57.9	Low	70 Å²	70	106 Å²	106	72%	0.722	55%	0.548	S	S	*	.			trans	77.5	78.7	158.8	0	0	0	0	0	116.5	E395	G393-E395 PolarHBondContact O-N 2.69Å; G393-E395 VanDerWaalsContact O-N 3.11Å
394	I	39.2	Very low	56.8	Low	154 Å²	154	107.4 Å²	107.4	79%	0.79	56%	0.561	S	S	*	*			trans	-64	108.8	150.4	-63.1	169.1	0	0	0	106.8	Q396	I394-Q396 PolarHBondContact O-N 3.36Å; I394-Q396 VanDerWaalsContact O-N 3.16Å
395	E	45.3	Very low	55.8	Low	148 Å²	148	111.1 Å²	111.1	69%	0.692	58%	0.581	S	S	*	*			trans	-61	116	176	-66.3	-173	121.5	0	0	110	G393	G393-E395 PolarHBondContact O-N 2.69Å; G393-E395 VanDerWaalsContact O-N 3.11Å
396	Q	36.3	Very low	55.4	Low	163 Å²	163	109.9 Å²	109.9	76%	0.762	58%	0.582	S	S	*	*			trans	-74.1	129.3	174.3	-66.1	-177.8	-16	0	0	109.1	I394 H398	I394-Q396 PolarHBondContact O-N 3.36Å; I394-Q396 VanDerWaalsContact O-N 3.16Å; Q396-H398 PolarHBondContact O-N 2.85Å; Q396-H398 PolarHBondContact O-ND1 3.02Å
397	D	38.6	Very low	55.1	Low	137 Å²	137	111.2 Å²	111.2	73%	0.733	60%	0.595	S	S	*	*			trans	-41.8	106.5	177.2	-84.2	-52.9	0	0	0	110.7	E399 K564	D397-E399 PolarHBondContact O-N 3.38Å; D397-E399 VanDerWaalsContact O-N 3.11Å; D397-K564 IonicContact OD1-NZ 3.18Å
398	H	47.8	Very low	55.4	Low	111 Å²	111	115.1 Å²	115.1	51%	0.514	61%	0.612	S	S	.	*			trans	-76.7	99.3	-179.8	-80	13	0	0	0	109.4	Q396 L400 M561	Q396-H398 PolarHBondContact O-N 2.85Å; Q396-H398 PolarHBondContact O-ND1 3.02Å; H398-L400 PolarHBondContact O-N 3.31Å; H398-M561 HydrophobicContact CB-CE 4.35Å
399	E	45.1	Very low	56.1	Low	185 Å²	185	112.7 Å²	112.7	86%	0.864	60%	0.603	S	S	*	*			trans	-53.8	132.6	178.2	-67	-169.9	138.1	0	0	111.9	D397 Y401	D397-E399 PolarHBondContact O-N 3.38Å; D397-E399 VanDerWaalsContact O-N 3.11Å; E399-Y401 PolarHBondContact O-N 3.34Å
400	L	52.6	Low	57.7	Low	133 Å²	133	107.1 Å²	107.1	70%	0.696	57%	0.573	S	S	*	*			trans	-62.3	106.2	-176.7	-74.3	165	0	0	0	111.6	H398 T402	H398-L400 PolarHBondContact O-N 3.31Å; L400-T402 PolarHBondContact O-N 2.7Å
401	Y	58.8	Low	59.4	Low	151 Å²	151	109.1 Å²	109.1	59%	0.592	58%	0.578	S	S	*	*			trans	-72.5	99.1	-178.9	-170.2	-96.2	0	0	0	111.4	E399 A436 E437	E399-Y401 PolarHBondContact O-N 3.34Å; Y401-A436 HydrophobicContact CD1-CB 3.82Å; Y401-A436 HydrophobicContact CE1-CB 4.31Å; Y401-E437 PolarHBondContact O-N 2.88Å
402	T	64.1	Low	61.6	Low	89 Å²	89	103.8 Å²	103.8	55%	0.546	56%	0.557	S	S	.	*	B	Isolated β-bridge	trans	-104.6	136.6	-177.9	41.2	0	0	0	0	111.4	L400 E437	L400-T402 PolarHBondContact O-N 2.7Å; T402-E437 WeakPolarHBondContact CA-O 3.38Å; T402-E437 HydrophobicContact CG2-CB 4.26Å
403	I	71.3	Confident	64	Low	16 Å²	16	100.6 Å²	100.6	8%	0.082	53%	0.529	C	S	.	.			trans	-91	128.9	178.2	-53.5	168.5	0	0	0	109.6	L410 Y413 A436 E437	I403-L410 HydrophobicContact CB-CD2 4.48Å; I403-L410 HydrophobicContact CG2-CD2 3.95Å; I403-Y413 HydrophobicContact CD1-CD1 3.62Å; I403-Y413 HydrophobicContact CD1-CD2 3.51Å; I403-Y413 HydrophobicContact CD1-CE1 3.75Å; I403-Y413 HydrophobicContact CD1-CE2 3.62Å; I403-Y413 HydrophobicContact CD1-CG 3.51Å; I403-Y413 HydrophobicContact CG1-CD2 4.4Å; I403-A436 HydrophobicContact CD1-CB 3.83Å; I403-A436 HydrophobicContact CG1-CB 3.9Å; I403-E437 PolarHBondContact N-O 3.37Å
404	P	67.9	Low	66.1	Low	86 Å²	86	97.3 Å²	97.3	56%	0.558	50%	0.495	S	S	*	.			trans	-61.8	137.9	171	-22.1	33.3	0	0	0	112.3	N406 L409	P404-N406 PolarHBondContact O-N 2.79Å; P404-L409 HydrophobicContact CB-CD1 4.38Å
405	D	69.9	Low	68.4	Low	82 Å²	82	94.1 Å²	94.1	44%	0.439	48%	0.479	S	S	.	.	S	Bend	trans	-68.8	30.4	-171.7	-64.8	-30.7	0	0	0	116.1	T438 S439 A440	D405-T438 PolarHBondContact OD1-OG1 2.77Å; D405-S439 VanDerWaalsContact CG-OG 3.26Å; D405-S439 PolarHBondContact OD1-N 3.43Å; D405-S439 PolarHBondContact OD1-OG 3.4Å; D405-S439 WeakPolarHBondContact OD2-CB 3.02Å; D405-S439 PolarHBondContact OD2-OG 2.9Å; D405-A440 HydrophobicContact CB-CB 3.91Å; D405-A440 WeakPolarHBondContact OD1-CB 3.46Å; D405-A440 PolarHBondContact OD1-N 2.71Å
406	N	79.7	Confident	70.5	Confident	80 Å²	80	94.1 Å²	94.1	43%	0.428	47%	0.473	S	S	.	.			trans	-86.7	121.8	174	179	-12.2	0	0	0	110.6	P404 E408 L409 L410	P404-N406 PolarHBondContact O-N 2.79Å; N406-E408 VanDerWaalsContact C-N 3.25Å; N406-E408 PolarHBondContact O-N 3.04Å; N406-E408 VanDerWaalsContact O-N 3.16Å; N406-E408 PolarHBondContact OD1-N 2.95Å; N406-L409 HydrophobicContact CB-CB 4.26Å; N406-L409 HydrophobicContact CB-CD1 4.03Å; N406-L409 HydrophobicContact CB-CG 4Å; N406-L409 PolarHBondContact O-N 3.1Å; N406-L410 PolarHBondContact O-N 2.81Å
407	T	78.9	Confident	73	Confident	70 Å²	70	86.9 Å²	86.9	43%	0.429	44%	0.439	S	S	.	.	H	α-helix	trans	-53.3	-34.3	179.3	-46.3	0	0	0	0	114.3	K411 E443	T407-K411 VanDerWaalsContact O-CB 3.26Å; T407-K411 WeakPolarHBondContact O-CB 3.2Å; T407-K411 PolarHBondContact O-N 2.59Å; T407-E443 HydrophobicContact CG2-CG 3.96Å
408	E	82.5	Confident	75.5	Confident	156 Å²	156	80.5 Å²	80.5	73%	0.729	41%	0.405	S	S	*	.	H	α-helix	trans	-71.4	-36.7	176	-66.1	-160.3	135.6	0	0	112.2	N406 K411 A412	N406-E408 VanDerWaalsContact C-N 3.25Å; N406-E408 PolarHBondContact O-N 3.04Å; N406-E408 VanDerWaalsContact O-N 3.16Å; N406-E408 PolarHBondContact OD1-N 2.95Å; E408-K411 PolarHBondContact O-N 2.97Å; E408-A412 WeakPolarHBondContact O-CB 3.22Å; E408-A412 PolarHBondContact O-N 2.81Å
409	L	82.6	Confident	77.7	Confident	85 Å²	85	79.8 Å²	79.8	45%	0.445	40%	0.401	S	S	.	.	H	α-helix	trans	-71.3	-40.9	176.1	-61.2	-177.4	0	0	0	111.4	P404 N406 K411 A412 Y413	P404-L409 HydrophobicContact CB-CD1 4.38Å; N406-L409 HydrophobicContact CB-CB 4.26Å; N406-L409 HydrophobicContact CB-CD1 4.03Å; N406-L409 HydrophobicContact CB-CG 4Å; N406-L409 PolarHBondContact O-N 3.1Å; L409-K411 VanDerWaalsContact C-N 3.33Å; L409-K411 PolarHBondContact O-N 2.84Å; L409-A412 PolarHBondContact O-N 3.44Å; L409-Y413 WeakPolarHBondContact O-CB 3.42Å; L409-Y413 PolarHBondContact O-N 3.26Å
410	L	83.4	Confident	80.1	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-60.8	-42	172.6	-68.5	166.9	0	0	0	111.4	I403 N406 Y413 V414 T438 A440 L447	I403-L410 HydrophobicContact CB-CD2 4.48Å; I403-L410 HydrophobicContact CG2-CD2 3.95Å; N406-L410 PolarHBondContact O-N 2.81Å; L410-Y413 PolarHBondContact O-N 3.37Å; L410-V414 WeakPolarHBondContact O-CG2 3.27Å; L410-V414 PolarHBondContact O-N 2.98Å; L410-T438 HydrophobicContact CD2-CG2 4.26Å; L410-A440 HydrophobicContact CD1-CB 3.77Å; L410-L447 HydrophobicContact CB-CD1 3.89Å
411	K	85.2	Confident	82.2	Confident	124 Å²	124	70.1 Å²	70.1	54%	0.539	35%	0.354	S	S	.	.	H	α-helix	trans	-67.9	-35.7	176	-173.7	174.7	-179.5	-179.8	0	112.7	T407 E408 L409 N415 L447	T407-K411 VanDerWaalsContact O-CB 3.26Å; T407-K411 WeakPolarHBondContact O-CB 3.2Å; T407-K411 PolarHBondContact O-N 2.59Å; E408-K411 PolarHBondContact O-N 2.97Å; L409-K411 VanDerWaalsContact C-N 3.33Å; L409-K411 PolarHBondContact O-N 2.84Å; K411-N415 PolarHBondContact O-N 3.32Å; K411-N415 PolarHBondContact O-ND2 2.94Å; K411-L447 HydrophobicContact CB-CD1 4.19Å; K411-L447 HydrophobicContact CB-CD2 4.19Å; K411-L447 HydrophobicContact CD-CD2 4.46Å; K411-L447 HydrophobicContact CG-CD2 4.15Å
412	A	85.8	Confident	83.8	Confident	59 Å²	59	66.9 Å²	66.9	49%	0.488	35%	0.35	S	S	.	.	H	α-helix	trans	-67.4	-43.8	172.8	0	0	0	0	0	111.6	E408 L409 N415 R416	E408-A412 WeakPolarHBondContact O-CB 3.22Å; E408-A412 PolarHBondContact O-N 2.81Å; L409-A412 PolarHBondContact O-N 3.44Å; A412-N415 PolarHBondContact O-N 2.72Å; A412-R416 WeakPolarHBondContact O-CB 3.47Å; A412-R416 PolarHBondContact O-N 2.8Å
413	Y	86.9	Confident	85.2	Confident	13 Å²	13	64.4 Å²	64.4	5%	0.051	33%	0.333	C	S	.	.	H	α-helix	trans	-57.2	-54.8	174.4	171.3	-97.7	0	0	0	111.6	I403 L409 L410 N415 R416 V417 F418 E434 A436 L444	I403-Y413 HydrophobicContact CD1-CD1 3.62Å; I403-Y413 HydrophobicContact CD1-CD2 3.51Å; I403-Y413 HydrophobicContact CD1-CE1 3.75Å; I403-Y413 HydrophobicContact CD1-CE2 3.62Å; I403-Y413 HydrophobicContact CD1-CG 3.51Å; I403-Y413 HydrophobicContact CG1-CD2 4.4Å; L409-Y413 WeakPolarHBondContact O-CB 3.42Å; L409-Y413 PolarHBondContact O-N 3.26Å; L410-Y413 PolarHBondContact O-N 3.37Å; Y413-N415 PolarHBondContact O-N 3.33Å; Y413-R416 PolarHBondContact O-N 2.92Å; Y413-V417 HydrophobicContact CD2-CG2 3.76Å; Y413-V417 HydrophobicContact CE2-CB 4.31Å; Y413-V417 HydrophobicContact CE2-CG2 3.53Å; Y413-V417 HydrophobicContact CG-CG2 4.43Å; Y413-V417 WeakPolarHBondContact O-CB 3.2Å; Y413-V417 PolarHBondContact O-N 2.89Å; Y413-F418 HydrophobicContact CE1-CE2 4.23Å; Y413-E434 HydrophobicContact CE2-CG 4.43Å; Y413-A436 HydrophobicContact CE2-CB 3.96Å; Y413-A436 PolarHBondContact OH-N 2.9Å; Y413-L444 HydrophobicContact CD1-CD1 4.44Å
414	V	86.8	Confident	86	Confident	1 Å²	1	69 Å²	69	1%	0.006	36%	0.364	C	S	.	.	H	α-helix	trans	-58.4	-35	-178.9	167.5	0	0	0	0	112.3	L410 F418 L444 L447 M448 K451	L410-V414 WeakPolarHBondContact O-CG2 3.27Å; L410-V414 PolarHBondContact O-N 2.98Å; V414-F418 HydrophobicContact CB-CD2 4.43Å; V414-F418 HydrophobicContact CG1-CD2 4.21Å; V414-F418 HydrophobicContact CG2-CD2 4.49Å; V414-F418 HydrophobicContact CG2-CE2 4.45Å; V414-F418 PolarHBondContact O-N 3.24Å; V414-L444 HydrophobicContact CG2-CD1 3.46Å; V414-L444 VanDerWaalsContact CG2-CD1 3.46Å; V414-L447 HydrophobicContact CG1-CB 4.38Å; V414-L447 HydrophobicContact CG2-CB 4.1Å; V414-M448 HydrophobicContact CG2-CG 4.32Å; V414-K451 HydrophobicContact CG1-CB 3.82Å; V414-K451 HydrophobicContact CG1-CG 3.82Å
415	N	87.1	Confident	86.7	Confident	87 Å²	87	68 Å²	68	47%	0.465	37%	0.369	S	S	.	.	H	α-helix	trans	-82.5	-18.2	177.1	-77.1	-75.9	0	0	0	114.7	K411 A412 Y413 K451	K411-N415 PolarHBondContact O-N 3.32Å; K411-N415 PolarHBondContact O-ND2 2.94Å; A412-N415 PolarHBondContact O-N 2.72Å; Y413-N415 PolarHBondContact O-N 3.33Å; N415-K451 PolarHBondContact OD1-NZ 3Å
416	R	89.1	Confident	87.8	Confident	148 Å²	148	67.1 Å²	67.1	56%	0.558	37%	0.365	S	S	*	.	H	α-helix	trans	-84.7	-40.2	173.5	-178.9	178.1	62.4	72.1	-2.2	112	A412 Y413 E434	A412-R416 WeakPolarHBondContact O-CB 3.47Å; A412-R416 PolarHBondContact O-N 2.8Å; Y413-R416 PolarHBondContact O-N 2.92Å; R416-E434 IonicContact CZ-OE1 2.76Å; R416-E434 IonicContact NH1-OE1 3.82Å; R416-E434 PolarHBondContact NH1-OE1 2.92Å; R416-E434 IonicContact NH2-OE1 2.67Å; R416-E434 PolarHBondContact NH2-OE1 3.17Å
417	V	87.9	Confident	88.4	Confident	10 Å²	10	63.5 Å²	63.5	6%	0.061	35%	0.345	C	S	.	.	H	α-helix	trans	-90.1	-42.1	-168.8	171.1	0	0	0	0	112.7	Y413 F432 E434	Y413-V417 HydrophobicContact CD2-CG2 3.76Å; Y413-V417 HydrophobicContact CE2-CB 4.31Å; Y413-V417 HydrophobicContact CE2-CG2 3.53Å; Y413-V417 HydrophobicContact CG-CG2 4.43Å; Y413-V417 WeakPolarHBondContact O-CB 3.2Å; Y413-V417 PolarHBondContact O-N 2.89Å; V417-F432 HydrophobicContact CG1-CB 3.78Å; V417-F432 WeakPolarHBondContact O-CA 3.25Å; V417-F432 WeakPolarHBondContact O-CB 3.5Å; V417-E434 HydrophobicContact CG1-CG 4.07Å; V417-E434 WeakPolarHBondContact CG1-O 3.05Å; V417-E434 HydrophobicContact CG2-CG 3.85Å; V417-E434 VanDerWaalsContact CG2-OE1 3.29Å; V417-E434 WeakPolarHBondContact CG2-OE1 3.43Å
418	F	91.8	Very high	89.2	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.018	33%	0.325	C	S	.	.			trans	-96.2	105.2	-176.8	-58.6	-75.9	0	0	0	111.9	Y413 V414 L430 F432 L435 M448 K451 I452 M480	Y413-F418 HydrophobicContact CE1-CE2 4.23Å; V414-F418 HydrophobicContact CB-CD2 4.43Å; V414-F418 HydrophobicContact CG1-CD2 4.21Å; V414-F418 HydrophobicContact CG2-CD2 4.49Å; V414-F418 HydrophobicContact CG2-CE2 4.45Å; V414-F418 PolarHBondContact O-N 3.24Å; F418-L430 HydrophobicContact CB-CD1 4.42Å; F418-L430 HydrophobicContact CD1-CD1 4.08Å; F418-F432 HydrophobicContact CD1-CB 3.56Å; F418-F432 AromaticContact CD1-CD1 3.75Å; F418-F432 HydrophobicContact CD1-CD1 3.75Å; F418-F432 AromaticContact CD1-CG 3.81Å; F418-F432 HydrophobicContact CD1-CG 3.81Å; F418-F432 HydrophobicContact CE1-CB 3.71Å; F418-F432 AromaticContact CE1-CD1 3.73Å; F418-F432 HydrophobicContact CE1-CD1 3.73Å; F418-F432 HydrophobicContact CE1-CD2 4.23Å; F418-F432 HydrophobicContact CE1-CE1 4.43Å; F418-F432 AromaticContact CE1-CG 3.61Å; F418-F432 HydrophobicContact CE1-CG 3.61Å; F418-F432 HydrophobicContact CG-CB 4.46Å; F418-L435 HydrophobicContact CE1-CD2 3.96Å; F418-L435 HydrophobicContact CZ-CD2 3.74Å; F418-M448 HydrophobicContact CE1-CE 4.12Å; F418-M448 HydrophobicContact CE2-CE 4.19Å; F418-M448 HydrophobicContact CE2-CG 4.2Å; F418-M448 HydrophobicContact CE2-SD 4.12Å; F418-M448 HydrophobicContact CZ-CE 3.72Å; F418-M448 HydrophobicContact CZ-SD 4.11Å; F418-K451 WeakPolarHBondContact O-CE 3.31Å; F418-I452 HydrophobicContact CB-CD1 3.97Å; F418-I452 HydrophobicContact CB-CG1 4.14Å; F418-I452 HydrophobicContact CD1-CD1 3.63Å; F418-I452 HydrophobicContact CD2-CD1 4.01Å; F418-I452 HydrophobicContact CE1-CD1 4.09Å; F418-I452 HydrophobicContact CE2-CD1 4.43Å; F418-I452 HydrophobicContact CG-CD1 3.59Å; F418-I452 HydrophobicContact CG-CG1 4.31Å; F418-I452 HydrophobicContact CZ-CD1 4.47Å; F418-M480 HydrophobicContact CE1-CE 3.91Å
419	K	94.8	Very high	89.8	Confident	95 Å²	95	53.7 Å²	53.7	41%	0.413	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	128.5	165.7	-176.6	178.1	-170.6	-103.3	0	108.5	E421 Y429 L430 R431	K419-E421 WeakPolarHBondContact CE-OE1 3.41Å; K419-E421 IonicContact NZ-OE1 3.49Å; K419-E421 PolarHBondContact NZ-OE1 3.28Å; K419-E421 IonicContact NZ-OE2 3.53Å; K419-E421 PolarHBondContact NZ-OE2 2.76Å; K419-Y429 HydrophobicContact CD-CE1 4.41Å; K419-L430 WeakPolarHBondContact O-CA 3.33Å; K419-R431 HydrophobicContact CB-CB 4.26Å; K419-R431 PolarHBondContact N-O 2.92Å; K419-R431 PolarHBondContact O-N 2.77Å
420	V	95.4	Very high	90.4	Very high	34 Å²	34	49.7 Å²	49.7	21%	0.206	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	122.4	-174.6	-177.6	0	0	0	0	108.8	Y429 L430 I452 L456	V420-Y429 WeakPolarHBondContact CA-O 3.44Å; V420-L430 HydrophobicContact CG2-CD1 4.02Å; V420-I452 HydrophobicContact CG2-CB 4.35Å; V420-I452 HydrophobicContact CG2-CG1 3.96Å; V420-I452 HydrophobicContact CG2-CG2 4.47Å; V420-L456 HydrophobicContact CG1-CD1 3.99Å; V420-L456 HydrophobicContact CG1-CD2 4.06Å; V420-L456 HydrophobicContact CG1-CG 3.9Å
421	E	95.4	Very high	91	Very high	82 Å²	82	52.4 Å²	52.4	38%	0.383	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	162	-178.9	-71.7	170	168.9	0	0	110.2	K419 Y429	K419-E421 WeakPolarHBondContact CE-OE1 3.41Å; K419-E421 IonicContact NZ-OE1 3.49Å; K419-E421 PolarHBondContact NZ-OE1 3.28Å; K419-E421 IonicContact NZ-OE2 3.53Å; K419-E421 PolarHBondContact NZ-OE2 2.76Å; E421-Y429 HydrophobicContact CB-CD1 4.41Å; E421-Y429 PolarHBondContact N-O 2.91Å; E421-Y429 PolarHBondContact O-N 2.93Å
422	V	94.1	Very high	91.3	Very high	82 Å²	82	46.6 Å²	46.6	50%	0.497	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	118.2	168.6	-178.6	0	0	0	0	107.9	L456 T459	V422-L456 HydrophobicContact CG2-CD2 4.19Å; V422-T459 HydrophobicContact CG1-CG2 3.96Å; V422-T459 HydrophobicContact CG2-CG2 4Å
423	L	93.3	Very high	91.3	Very high	38 Å²	38	46.7 Å²	46.7	20%	0.199	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	164.2	-177	-57.6	-176.3	0	0	0	111.3	N426 T427 Y429 Y611	L423-N426 PolarHBondContact O-N 2.91Å; L423-T427 WeakPolarHBondContact CB-O 3.02Å; L423-T427 PolarHBondContact N-O 3Å; L423-T427 PolarHBondContact O-N 3.26Å; L423-Y429 HydrophobicContact CD1-CD2 4.21Å; L423-Y429 HydrophobicContact CD1-CG 4.19Å; L423-Y611 WeakPolarHBondContact CD1-OH 3.39Å
424	P	86.9	Confident	91.3	Very high	111 Å²	111	47.9 Å²	47.9	72%	0.721	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	146	173.4	-26.9	36.3	0	0	0	112.6
425	G	83.9	Confident	91.1	Very high	65 Å²	65	48.2 Å²	48.2	67%	0.67	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	31.7	-174.4	0	0	0	0	0	113.9	T427	G425-T427 VanDerWaalsContact C-N 3.26Å; G425-T427 PolarHBondContact O-N 3Å; G425-T427 PolarHBondContact O-OG1 3.37Å; G425-T427 VanDerWaalsContact O-OG1 3.08Å
426	N	91.4	Very high	90.6	Very high	65 Å²	65	44.5 Å²	44.5	35%	0.348	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	42.1	175.4	-166.9	39.6	0	0	0	113.6	L423 D458 T459 D460	L423-N426 PolarHBondContact O-N 2.91Å; N426-D458 PolarHBondContact ND2-O 3.24Å; N426-T459 CarbonylContact O-C 3.45Å; N426-T459 WeakPolarHBondContact O-CA 3.19Å; N426-T459 WeakPolarHBondContact O-CB 3.38Å; N426-D460 WeakPolarHBondContact CB-OD2 3.29Å; N426-D460 PolarHBondContact ND2-N 2.97Å; N426-D460 PolarHBondContact ND2-OD2 2.66Å; N426-D460 PolarHBondContact O-N 2.68Å
427	T	93.4	Very high	90	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.018	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.6	-175.2	-62.3	0	0	0	0	109.5	L423 G425 N461 I463 M614	L423-T427 WeakPolarHBondContact CB-O 3.02Å; L423-T427 PolarHBondContact N-O 3Å; L423-T427 PolarHBondContact O-N 3.26Å; G425-T427 VanDerWaalsContact C-N 3.26Å; G425-T427 PolarHBondContact O-N 3Å; G425-T427 PolarHBondContact O-OG1 3.37Å; G425-T427 VanDerWaalsContact O-OG1 3.08Å; T427-N461 CarbonylContact C-O 3.55Å; T427-N461 WeakPolarHBondContact CA-O 3.22Å; T427-N461 HydrophobicContact CG2-CB 4.24Å; T427-I463 HydrophobicContact CG2-CD1 3.86Å; T427-I463 HydrophobicContact CG2-CG1 3.84Å; T427-M614 HydrophobicContact CG2-CE 4.04Å; T427-M614 HydrophobicContact CG2-SD 4.41Å; T427-M614 WeakPolarHBondContact OG1-CE 3.42Å
428	G	95.1	Very high	89.5	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	145.2	173.8	0	0	0	0	0	112	N461 I463	G428-N461 PolarHBondContact N-O 3.44Å; G428-I463 PolarHBondContact O-N 3.28Å
429	Y	96	Very high	88.7	Confident	21 Å²	21	44.3 Å²	44.3	8%	0.082	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	124.5	171.4	174.5	-92.7	0	0	0	110.2	K419 V420 E421 L423 R431 I463 D465	K419-Y429 HydrophobicContact CD-CE1 4.41Å; V420-Y429 WeakPolarHBondContact CA-O 3.44Å; E421-Y429 HydrophobicContact CB-CD1 4.41Å; E421-Y429 PolarHBondContact N-O 2.91Å; E421-Y429 PolarHBondContact O-N 2.93Å; L423-Y429 HydrophobicContact CD1-CD2 4.21Å; L423-Y429 HydrophobicContact CD1-CG 4.19Å; Y429-R431 HydrophobicContact CE1-CB 3.89Å; Y429-I463 WeakPolarHBondContact CA-O 3.46Å; Y429-I463 HydrophobicContact CD2-CB 4.23Å; Y429-I463 HydrophobicContact CD2-CG2 4.13Å; Y429-D465 HydrophobicContact CE2-CB 3.73Å; Y429-D465 PolarHBondContact OH-OD2 3.48Å
430	L	95.5	Very high	88	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	122.9	179.3	171.6	60.6	0	0	0	108.5	F418 K419 V420 F432 I452 L462 I463 I464 D465 M480	F418-L430 HydrophobicContact CB-CD1 4.42Å; F418-L430 HydrophobicContact CD1-CD1 4.08Å; K419-L430 WeakPolarHBondContact O-CA 3.33Å; V420-L430 HydrophobicContact CG2-CD1 4.02Å; L430-F432 HydrophobicContact CD1-CD1 4.19Å; L430-F432 HydrophobicContact CD2-CD1 4.36Å; L430-F432 HydrophobicContact CD2-CE1 4.09Å; L430-F432 HydrophobicContact CG-CD1 4.01Å; L430-F432 HydrophobicContact CG-CE1 4.15Å; L430-I452 HydrophobicContact CD1-CD1 4.32Å; L430-I452 HydrophobicContact CD1-CG1 4.36Å; L430-I452 HydrophobicContact CD1-CG2 3.93Å; L430-I452 HydrophobicContact CD2-CG2 3.95Å; L430-L462 HydrophobicContact CB-CD1 4.13Å; L430-I463 PolarHBondContact N-O 3.22Å; L430-I464 HydrophobicContact CD2-CG1 4.5Å; L430-I464 CarbonylContact O-C 3.6Å; L430-I464 VanDerWaalsContact O-CA 3.27Å; L430-I464 WeakPolarHBondContact O-CA 3.41Å; L430-D465 PolarHBondContact O-N 2.99Å; L430-M480 HydrophobicContact CD2-SD 4.27Å
431	R	94.5	Very high	87.3	Confident	59 Å²	59	42.3 Å²	42.3	22%	0.223	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	139.4	170.3	174.9	175.4	158.7	168.2	-2	110.3	K419 Y429 D433 D465 Y468	K419-R431 HydrophobicContact CB-CB 4.26Å; K419-R431 PolarHBondContact N-O 2.92Å; K419-R431 PolarHBondContact O-N 2.77Å; Y429-R431 HydrophobicContact CE1-CB 3.89Å; R431-D433 IonicContact CZ-OD1 2.75Å; R431-D433 IonicContact CZ-OD2 3.41Å; R431-D433 IonicContact NE-OD1 2.68Å; R431-D433 PolarHBondContact NE-OD1 2.96Å; R431-D433 IonicContact NE-OD2 2.58Å; R431-D433 IonicContact NH2-OD1 3.53Å; R431-D433 PolarHBondContact NH2-OD1 2.66Å; R431-D433 IonicContact NH2-OD2 2.96Å; R431-D433 PolarHBondContact NH2-OD2 3.01Å; R431-D465 HydrophobicContact CB-CB 3.93Å; R431-D465 HydrophobicContact CG-CB 4.12Å; R431-Y468 VanDerWaalsContact NH1-CD2 3.25Å; R431-Y468 VanDerWaalsContact NH2-CG 3.3Å
432	F	92	Very high	86.7	Confident	1 Å²	1	42.9 Å²	42.9	0%	0.004	26%	0.264	C	S	.	.			trans	-151.1	135.1	167.2	55.1	-87.3	0	0	0	111.9	V417 F418 L430 L435 I464 L466 N469 M480 L539	V417-F432 HydrophobicContact CG1-CB 3.78Å; V417-F432 WeakPolarHBondContact O-CA 3.25Å; V417-F432 WeakPolarHBondContact O-CB 3.5Å; F418-F432 HydrophobicContact CD1-CB 3.56Å; F418-F432 AromaticContact CD1-CD1 3.75Å; F418-F432 HydrophobicContact CD1-CD1 3.75Å; F418-F432 AromaticContact CD1-CG 3.81Å; F418-F432 HydrophobicContact CD1-CG 3.81Å; F418-F432 HydrophobicContact CE1-CB 3.71Å; F418-F432 AromaticContact CE1-CD1 3.73Å; F418-F432 HydrophobicContact CE1-CD1 3.73Å; F418-F432 HydrophobicContact CE1-CD2 4.23Å; F418-F432 HydrophobicContact CE1-CE1 4.43Å; F418-F432 AromaticContact CE1-CG 3.61Å; F418-F432 HydrophobicContact CE1-CG 3.61Å; F418-F432 HydrophobicContact CG-CB 4.46Å; L430-F432 HydrophobicContact CD1-CD1 4.19Å; L430-F432 HydrophobicContact CD2-CD1 4.36Å; L430-F432 HydrophobicContact CD2-CE1 4.09Å; L430-F432 HydrophobicContact CG-CD1 4.01Å; L430-F432 HydrophobicContact CG-CE1 4.15Å; F432-L435 HydrophobicContact CD2-CD1 4.25Å; F432-L435 HydrophobicContact CD2-CD2 3.82Å; F432-L435 HydrophobicContact CD2-CG 3.72Å; F432-L435 HydrophobicContact CE2-CD1 3.54Å; F432-L435 HydrophobicContact CE2-CD2 3.87Å; F432-L435 HydrophobicContact CE2-CG 3.53Å; F432-L435 HydrophobicContact CZ-CD1 4.2Å; F432-I464 HydrophobicContact CE1-CG2 3.79Å; F432-I464 HydrophobicContact CZ-CG2 4.24Å; F432-L466 HydrophobicContact CD2-CD2 4.35Å; F432-L466 HydrophobicContact CE1-CD2 4.06Å; F432-L466 HydrophobicContact CE2-CD2 3.63Å; F432-L466 HydrophobicContact CZ-CD2 3.47Å; F432-L466 VanDerWaalsContact CZ-CD2 3.47Å; F432-N469 VanDerWaalsContact CD2-ND2 3.27Å; F432-N469 WeakPolarHBondContact CD2-ND2 3.5Å; F432-N469 WeakPolarHBondContact CE2-ND2 3.4Å; F432-N469 PolarHBondContact O-ND2 2.94Å; F432-M480 HydrophobicContact CD1-CE 4.26Å; F432-M480 HydrophobicContact CE1-CE 3.6Å; F432-M480 HydrophobicContact CE1-SD 4.43Å; F432-M480 HydrophobicContact CE2-CE 4.44Å; F432-M480 HydrophobicContact CZ-CE 3.72Å; F432-L539 HydrophobicContact CE2-CD2 4.32Å; F432-L539 HydrophobicContact CZ-CD2 3.67Å
433	D	87.1	Confident	86.2	Confident	62 Å²	62	41.5 Å²	41.5	33%	0.332	25%	0.252	S	S	.	.	S	Bend	trans	-97.8	-4.5	-170.1	-58.9	4.8	0	0	0	112.4	R431 N469 T470	R431-D433 IonicContact CZ-OD1 2.75Å; R431-D433 IonicContact CZ-OD2 3.41Å; R431-D433 IonicContact NE-OD1 2.68Å; R431-D433 PolarHBondContact NE-OD1 2.96Å; R431-D433 IonicContact NE-OD2 2.58Å; R431-D433 IonicContact NH2-OD1 3.53Å; R431-D433 PolarHBondContact NH2-OD1 2.66Å; R431-D433 IonicContact NH2-OD2 2.96Å; R431-D433 PolarHBondContact NH2-OD2 3.01Å; D433-N469 WeakPolarHBondContact O-CA 3.27Å; D433-T470 PolarHBondContact O-N 3.21Å
434	E	85.4	Confident	85.8	Confident	37 Å²	37	40.1 Å²	40.1	17%	0.173	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	156.7	175.4	64.1	-171.6	165.9	0	0	112.1	Y413 R416 V417 R471	Y413-E434 HydrophobicContact CE2-CG 4.43Å; R416-E434 IonicContact CZ-OE1 2.76Å; R416-E434 IonicContact NH1-OE1 3.82Å; R416-E434 PolarHBondContact NH1-OE1 2.92Å; R416-E434 IonicContact NH2-OE1 2.67Å; R416-E434 PolarHBondContact NH2-OE1 3.17Å; V417-E434 HydrophobicContact CG1-CG 4.07Å; V417-E434 WeakPolarHBondContact CG1-O 3.05Å; V417-E434 HydrophobicContact CG2-CG 3.85Å; V417-E434 VanDerWaalsContact CG2-OE1 3.29Å; V417-E434 WeakPolarHBondContact CG2-OE1 3.43Å; E434-R471 VanDerWaalsContact CA-O 3.25Å; E434-R471 WeakPolarHBondContact CA-O 3.26Å
435	L	82.6	Confident	85.8	Confident	9 Å²	9	35.6 Å²	35.6	5%	0.047	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	84.8	169.5	-76.6	-179.6	0	0	0	111.8	F418 F432 R471 G472 S473 L477 M480 T535	F418-L435 HydrophobicContact CE1-CD2 3.96Å; F418-L435 HydrophobicContact CZ-CD2 3.74Å; F432-L435 HydrophobicContact CD2-CD1 4.25Å; F432-L435 HydrophobicContact CD2-CD2 3.82Å; F432-L435 HydrophobicContact CD2-CG 3.72Å; F432-L435 HydrophobicContact CE2-CD1 3.54Å; F432-L435 HydrophobicContact CE2-CD2 3.87Å; F432-L435 HydrophobicContact CE2-CG 3.53Å; F432-L435 HydrophobicContact CZ-CD1 4.2Å; L435-R471 PolarHBondContact N-O 3.03Å; L435-G472 CarbonylContact O-C 3.57Å; L435-G472 WeakPolarHBondContact O-CA 3.33Å; L435-S473 PolarHBondContact O-N 2.9Å; L435-L477 HydrophobicContact CD1-CD2 4.47Å; L435-M480 HydrophobicContact CD2-CE 4.39Å; L435-T535 HydrophobicContact CB-CG2 4.22Å; L435-T535 HydrophobicContact CD1-CG2 4.14Å
436	A	77.9	Confident	86	Confident	8 Å²	8	36.3 Å²	36.3	7%	0.066	20%	0.199	C	C	.	.			trans	-71.3	169.2	179.4	0	0	0	0	0	114.2	Y401 I403 Y413 S476	Y401-A436 HydrophobicContact CD1-CB 3.82Å; Y401-A436 HydrophobicContact CE1-CB 4.31Å; I403-A436 HydrophobicContact CD1-CB 3.83Å; I403-A436 HydrophobicContact CG1-CB 3.9Å; Y413-A436 HydrophobicContact CE2-CB 3.96Å; Y413-A436 PolarHBondContact OH-N 2.9Å; A436-S476 PolarHBondContact O-OG 3.1Å
437	E	76.8	Confident	85.9	Confident	49 Å²	49	34.1 Å²	34.1	23%	0.229	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-105	148.1	-178.2	-171	163.3	175.8	0	0	112.6	Y401 T402 I403 S473 N475	Y401-E437 PolarHBondContact O-N 2.88Å; T402-E437 WeakPolarHBondContact CA-O 3.38Å; T402-E437 HydrophobicContact CG2-CB 4.26Å; I403-E437 PolarHBondContact N-O 3.37Å; E437-S473 VanDerWaalsContact OE2-CB 3.31Å; E437-S473 WeakPolarHBondContact OE2-CB 3.38Å; E437-S473 PolarHBondContact OE2-OG 3.27Å; E437-N475 PolarHBondContact OE1-ND2 2.97Å
438	T	75.4	Confident	85.7	Confident	14 Å²	14	34.2 Å²	34.2	9%	0.086	19%	0.187	C	C	.	.			trans	-154.8	146.7	178.2	175.8	0	0	0	0	111.3	D405 L410 A440 V441 L444	D405-T438 PolarHBondContact OD1-OG1 2.77Å; L410-T438 HydrophobicContact CD2-CG2 4.26Å; T438-A440 PolarHBondContact OG1-N 2.8Å; T438-A440 VanDerWaalsContact OG1-N 3.14Å; T438-V441 WeakPolarHBondContact O-CG2 2.83Å; T438-L444 HydrophobicContact CG2-CB 4.31Å; T438-L444 HydrophobicContact CG2-CD2 3.64Å
439	S	75.6	Confident	85.3	Confident	96 Å²	96	34.5 Å²	34.5	67%	0.671	19%	0.19	S	C	*	.	S	Bend	trans	-75.8	-22.8	171.5	13.9	0	0	0	0	112.8	D405 V441	D405-S439 VanDerWaalsContact CG-OG 3.26Å; D405-S439 PolarHBondContact OD1-N 3.43Å; D405-S439 PolarHBondContact OD1-OG 3.4Å; D405-S439 WeakPolarHBondContact OD2-CB 3.02Å; D405-S439 PolarHBondContact OD2-OG 2.9Å; S439-V441 PolarHBondContact O-N 2.99Å; S439-V441 VanDerWaalsContact O-N 3.07Å
440	A	80.5	Confident	85	Confident	19 Å²	19	40 Å²	40	16%	0.157	22%	0.216	C	C	.	.			trans	-82.2	37.5	-179.3	0	0	0	0	0	115	D405 L410 T438 P442 E443 L444	D405-A440 HydrophobicContact CB-CB 3.91Å; D405-A440 WeakPolarHBondContact OD1-CB 3.46Å; D405-A440 PolarHBondContact OD1-N 2.71Å; L410-A440 HydrophobicContact CD1-CB 3.77Å; T438-A440 PolarHBondContact OG1-N 2.8Å; T438-A440 VanDerWaalsContact OG1-N 3.14Å; A440-P442 VanDerWaalsContact C-CD 3.4Å; A440-P442 VanDerWaalsContact C-N 3.34Å; A440-P442 VanDerWaalsContact O-N 3.11Å; A440-E443 PolarHBondContact O-N 3Å; A440-L444 PolarHBondContact O-N 2.9Å
441	V	79.8	Confident	84.8	Confident	67 Å²	67	43 Å²	43	41%	0.406	23%	0.229	S	C	.	.	H	α-helix	trans	-45.2	-43.8	-175.4	-176.2	0	0	0	0	114.6	T438 S439 E443 L444 E445	T438-V441 WeakPolarHBondContact O-CG2 2.83Å; S439-V441 PolarHBondContact O-N 2.99Å; S439-V441 VanDerWaalsContact O-N 3.07Å; V441-E443 PolarHBondContact O-N 2.94Å; V441-L444 PolarHBondContact O-N 3.18Å; V441-E445 PolarHBondContact O-N 2.85Å
442	P	82.9	Confident	84.7	Confident	94 Å²	94	40.2 Å²	40.2	61%	0.61	22%	0.218	S	C	*	.	H	α-helix	trans	-67	-31.3	-178.6	-21.9	35	0	0	0	114.6	A440 K446	A440-P442 VanDerWaalsContact C-CD 3.4Å; A440-P442 VanDerWaalsContact C-N 3.34Å; A440-P442 VanDerWaalsContact O-N 3.11Å; P442-K446 WeakPolarHBondContact O-CB 3.42Å; P442-K446 PolarHBondContact O-N 2.68Å
443	E	83.9	Confident	84.7	Confident	54 Å²	54	40.2 Å²	40.2	25%	0.252	22%	0.219	S	C	.	.	H	α-helix	trans	-81.5	-31.3	177.7	-166.8	64.2	-158.4	0	0	110.7	T407 A440 V441 K446 L447	T407-E443 HydrophobicContact CG2-CG 3.96Å; A440-E443 PolarHBondContact O-N 3Å; V441-E443 PolarHBondContact O-N 2.94Å; E443-K446 IonicContact OE1-NZ 2.67Å; E443-K446 PolarHBondContact OE1-NZ 3Å; E443-K446 IonicContact OE2-NZ 3.6Å; E443-K446 PolarHBondContact OE2-NZ 2.85Å; E443-L447 VanDerWaalsContact O-CG 3.3Å; E443-L447 WeakPolarHBondContact O-CG 3.04Å; E443-L447 PolarHBondContact O-N 3.36Å; E443-L447 VanDerWaalsContact O-N 3.14Å
444	L	85.2	Confident	84.8	Confident	9 Å²	9	41.6 Å²	41.6	5%	0.047	22%	0.223	C	C	.	.	H	α-helix	trans	-63.4	-47.8	168.8	178	61.4	0	0	0	111.6	Y413 V414 T438 A440 V441 K446 L447 M448 L479	Y413-L444 HydrophobicContact CD1-CD1 4.44Å; V414-L444 HydrophobicContact CG2-CD1 3.46Å; V414-L444 VanDerWaalsContact CG2-CD1 3.46Å; T438-L444 HydrophobicContact CG2-CB 4.31Å; T438-L444 HydrophobicContact CG2-CD2 3.64Å; A440-L444 PolarHBondContact O-N 2.9Å; V441-L444 PolarHBondContact O-N 3.18Å; L444-K446 VanDerWaalsContact C-N 3.34Å; L444-K446 PolarHBondContact O-N 3.47Å; L444-L447 PolarHBondContact O-N 2.94Å; L444-M448 HydrophobicContact CD1-CG 4.24Å; L444-M448 HydrophobicContact CD1-SD 4.11Å; L444-M448 HydrophobicContact CG-SD 4.01Å; L444-M448 WeakPolarHBondContact O-CG 3.35Å; L444-M448 PolarHBondContact O-N 3.47Å; L444-L479 HydrophobicContact CD2-CD2 4.14Å; L444-L479 HydrophobicContact CG-CD2 4.21Å
445	E	87.1	Confident	85.1	Confident	15 Å²	15	43 Å²	43	7%	0.07	24%	0.235	C	C	.	.	H	α-helix	trans	-54.2	-52	175.8	-177.6	-161.9	-162.1	0	0	110.6	V441 L447 M448 A449 L479 Y483 T513 T514	V441-E445 PolarHBondContact O-N 2.85Å; E445-L447 PolarHBondContact O-N 2.87Å; E445-M448 CarbonylContact O-C 3.55Å; E445-M448 PolarHBondContact O-N 2.73Å; E445-A449 WeakPolarHBondContact O-CB 3.5Å; E445-A449 PolarHBondContact O-N 3.18Å; E445-L479 HydrophobicContact CB-CD1 3.86Å; E445-L479 HydrophobicContact CG-CD1 3.76Å; E445-Y483 HydrophobicContact CG-CE2 4.14Å; E445-Y483 WeakPolarHBondContact CG-OH 3.31Å; E445-Y483 PolarHBondContact OE1-OH 3.3Å; E445-T513 VanDerWaalsContact OE1-CA 3.24Å; E445-T513 WeakPolarHBondContact OE1-CA 3.47Å; E445-T514 PolarHBondContact OE1-N 3.41Å; E445-T514 VanDerWaalsContact OE2-CB 3.24Å; E445-T514 WeakPolarHBondContact OE2-CB 3.44Å; E445-T514 PolarHBondContact OE2-OG1 2.95Å
446	K	87.6	Confident	85.6	Confident	80 Å²	80	42.6 Å²	42.6	35%	0.348	23%	0.233	S	C	.	.	H	α-helix	trans	-58.1	-34.5	-179.2	174.7	176.5	157.7	-131	0	113.1	P442 E443 L444 Q450 T514	P442-K446 WeakPolarHBondContact O-CB 3.42Å; P442-K446 PolarHBondContact O-N 2.68Å; E443-K446 IonicContact OE1-NZ 2.67Å; E443-K446 PolarHBondContact OE1-NZ 3Å; E443-K446 IonicContact OE2-NZ 3.6Å; E443-K446 PolarHBondContact OE2-NZ 2.85Å; L444-K446 VanDerWaalsContact C-N 3.34Å; L444-K446 PolarHBondContact O-N 3.47Å; K446-Q450 WeakPolarHBondContact O-CG 3.37Å; K446-Q450 PolarHBondContact O-N 3.09Å; K446-T514 HydrophobicContact CB-CG2 4.19Å; K446-T514 HydrophobicContact CG-CG2 4.44Å
447	L	88.7	Confident	86.1	Confident	19 Å²	19	45.8 Å²	45.8	10%	0.099	25%	0.246	C	C	.	.	H	α-helix	trans	-73.3	-40.8	173.3	-70.8	167.3	0	0	0	112	L410 K411 V414 E443 L444 E445 Q450 K451	L410-L447 HydrophobicContact CB-CD1 3.89Å; K411-L447 HydrophobicContact CB-CD1 4.19Å; K411-L447 HydrophobicContact CB-CD2 4.19Å; K411-L447 HydrophobicContact CD-CD2 4.46Å; K411-L447 HydrophobicContact CG-CD2 4.15Å; V414-L447 HydrophobicContact CG1-CB 4.38Å; V414-L447 HydrophobicContact CG2-CB 4.1Å; E443-L447 VanDerWaalsContact O-CG 3.3Å; E443-L447 WeakPolarHBondContact O-CG 3.04Å; E443-L447 PolarHBondContact O-N 3.36Å; E443-L447 VanDerWaalsContact O-N 3.14Å; L444-L447 PolarHBondContact O-N 2.94Å; E445-L447 PolarHBondContact O-N 2.87Å; L447-Q450 PolarHBondContact O-N 2.94Å; L447-K451 VanDerWaalsContact O-CB 3.26Å; L447-K451 WeakPolarHBondContact O-CB 3.44Å; L447-K451 PolarHBondContact O-N 3.44Å
448	M	89.2	Confident	86.6	Confident	6 Å²	6	49.3 Å²	49.3	3%	0.03	27%	0.266	C	S	.	.	H	α-helix	trans	-66.4	-39.6	175.1	-71.9	177.4	68	0	0	112.3	V414 F418 L444 E445 Q450 K451 I452 W453 L479 M480	V414-M448 HydrophobicContact CG2-CG 4.32Å; F418-M448 HydrophobicContact CE1-CE 4.12Å; F418-M448 HydrophobicContact CE2-CE 4.19Å; F418-M448 HydrophobicContact CE2-CG 4.2Å; F418-M448 HydrophobicContact CE2-SD 4.12Å; F418-M448 HydrophobicContact CZ-CE 3.72Å; F418-M448 HydrophobicContact CZ-SD 4.11Å; L444-M448 HydrophobicContact CD1-CG 4.24Å; L444-M448 HydrophobicContact CD1-SD 4.11Å; L444-M448 HydrophobicContact CG-SD 4.01Å; L444-M448 WeakPolarHBondContact O-CG 3.35Å; L444-M448 PolarHBondContact O-N 3.47Å; E445-M448 CarbonylContact O-C 3.55Å; E445-M448 PolarHBondContact O-N 2.73Å; M448-Q450 VanDerWaalsContact C-N 3.32Å; M448-Q450 PolarHBondContact O-N 2.8Å; M448-K451 PolarHBondContact O-N 2.95Å; M448-I452 HydrophobicContact CB-CD1 4.04Å; M448-I452 HydrophobicContact CE-CD1 3.73Å; M448-I452 HydrophobicContact CG-CD1 4Å; M448-I452 WeakPolarHBondContact O-CA 3.31Å; M448-I452 WeakPolarHBondContact O-CB 3.41Å; M448-I452 PolarHBondContact O-N 3.16Å; M448-W453 PolarHBondContact O-N 3.29Å; M448-L479 HydrophobicContact CE-CD2 4.42Å; M448-L479 HydrophobicContact SD-CD2 3.62Å; M448-L479 HydrophobicContact SD-CG 4.27Å; M448-M480 HydrophobicContact CE-CE 3.88Å
449	A	88.3	Confident	87.4	Confident	6 Å²	6	48.9 Å²	48.9	5%	0.05	26%	0.263	C	S	.	.	I	π-helix	trans	-54.5	-45.8	172.8	0	0	0	0	0	112	E445 W453 E454	E445-A449 WeakPolarHBondContact O-CB 3.5Å; E445-A449 PolarHBondContact O-N 3.18Å; A449-W453 PolarHBondContact O-N 2.63Å; A449-E454 VanDerWaalsContact O-CB 3.32Å; A449-E454 WeakPolarHBondContact O-CB 3.23Å; A449-E454 PolarHBondContact O-N 3.03Å
450	Q	89.8	Confident	88	Confident	135 Å²	135	48.7 Å²	48.7	63%	0.631	26%	0.255	S	S	*	.	I	π-helix	trans	-75.6	-30.3	179.2	-68	177.2	5.5	0	0	113.8	K446 L447 M448	K446-Q450 WeakPolarHBondContact O-CG 3.37Å; K446-Q450 PolarHBondContact O-N 3.09Å; L447-Q450 PolarHBondContact O-N 2.94Å; M448-Q450 VanDerWaalsContact C-N 3.32Å; M448-Q450 PolarHBondContact O-N 2.8Å
451	K	90.9	Very high	88.6	Confident	64 Å²	64	48.9 Å²	48.9	28%	0.278	25%	0.253	S	S	.	.	I	π-helix	trans	-90.4	-37.9	-174.5	177.3	65.8	177	-163.3	0	113.9	V414 N415 F418 L447 M448	V414-K451 HydrophobicContact CG1-CB 3.82Å; V414-K451 HydrophobicContact CG1-CG 3.82Å; N415-K451 PolarHBondContact OD1-NZ 3Å; F418-K451 WeakPolarHBondContact O-CE 3.31Å; L447-K451 VanDerWaalsContact O-CB 3.26Å; L447-K451 WeakPolarHBondContact O-CB 3.44Å; L447-K451 PolarHBondContact O-N 3.44Å; M448-K451 PolarHBondContact O-N 2.95Å
452	I	92.3	Very high	89.2	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.234	C	C	.	.	I	π-helix	trans	-111.4	-58.4	-168.4	-53.9	171.9	0	0	0	109.9	F418 V420 L430 M448 P455 L456	F418-I452 HydrophobicContact CB-CD1 3.97Å; F418-I452 HydrophobicContact CB-CG1 4.14Å; F418-I452 HydrophobicContact CD1-CD1 3.63Å; F418-I452 HydrophobicContact CD2-CD1 4.01Å; F418-I452 HydrophobicContact CE1-CD1 4.09Å; F418-I452 HydrophobicContact CE2-CD1 4.43Å; F418-I452 HydrophobicContact CG-CD1 3.59Å; F418-I452 HydrophobicContact CG-CG1 4.31Å; F418-I452 HydrophobicContact CZ-CD1 4.47Å; V420-I452 HydrophobicContact CG2-CB 4.35Å; V420-I452 HydrophobicContact CG2-CG1 3.96Å; V420-I452 HydrophobicContact CG2-CG2 4.47Å; L430-I452 HydrophobicContact CD1-CD1 4.32Å; L430-I452 HydrophobicContact CD1-CG1 4.36Å; L430-I452 HydrophobicContact CD1-CG2 3.93Å; L430-I452 HydrophobicContact CD2-CG2 3.95Å; M448-I452 HydrophobicContact CB-CD1 4.04Å; M448-I452 HydrophobicContact CE-CD1 3.73Å; M448-I452 HydrophobicContact CG-CD1 4Å; M448-I452 WeakPolarHBondContact O-CA 3.31Å; M448-I452 WeakPolarHBondContact O-CB 3.41Å; M448-I452 PolarHBondContact O-N 3.16Å; I452-P455 WeakPolarHBondContact O-CD 3.32Å; I452-L456 HydrophobicContact CG2-CD1 3.95Å; I452-L456 WeakPolarHBondContact O-CB 3.47Å; I452-L456 WeakPolarHBondContact O-CD1 3.49Å; I452-L456 WeakPolarHBondContact O-CG 3.27Å; I452-L456 PolarHBondContact O-N 3.07Å
453	W	91.2	Very high	89.9	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.008	21%	0.205	C	C	.	.	I	π-helix	trans	-80.2	-41.2	-165.4	-54.3	121.7	0	0	0	113.3	M448 A449 L456 K457 L462 M480 Y483 L484 P516	M448-W453 PolarHBondContact O-N 3.29Å; A449-W453 PolarHBondContact O-N 2.63Å; W453-L456 PolarHBondContact O-N 2.87Å; W453-K457 WeakPolarHBondContact O-CB 3.49Å; W453-K457 PolarHBondContact O-N 2.88Å; W453-L462 HydrophobicContact CZ3-CD2 4.16Å; W453-M480 HydrophobicContact CH2-SD 3.89Å; W453-M480 HydrophobicContact CZ2-SD 3.63Å; W453-Y483 HydrophobicContact CB-CD1 3.96Å; W453-Y483 HydrophobicContact CB-CE1 4Å; W453-Y483 AromaticContact CD1-CD1 3.23Å; W453-Y483 AromaticContact CD1-CE1 3.24Å; W453-Y483 AromaticContact CD1-CG 3.68Å; W453-Y483 AromaticContact CD1-CZ 3.71Å; W453-Y483 AromaticContact CD2-CD1 3.56Å; W453-Y483 HydrophobicContact CD2-CD1 3.56Å; W453-Y483 HydrophobicContact CD2-CE1 4.32Å; W453-Y483 AromaticContact CD2-CG 3.83Å; W453-Y483 HydrophobicContact CD2-CG 3.83Å; W453-Y483 VanDerWaalsContact CE2-CB 3.43Å; W453-Y483 AromaticContact CE2-CD1 3.68Å; W453-Y483 AromaticContact CE2-CG 3.46Å; W453-Y483 VanDerWaalsContact CE2-CG 3.46Å; W453-Y483 HydrophobicContact CE3-CD1 4.35Å; W453-Y483 AromaticContact CG-CD1 3.31Å; W453-Y483 HydrophobicContact CG-CD1 3.31Å; W453-Y483 AromaticContact CG-CE1 3.6Å; W453-Y483 HydrophobicContact CG-CE1 3.6Å; W453-Y483 AromaticContact CG-CG 3.99Å; W453-Y483 HydrophobicContact CG-CG 3.99Å; W453-Y483 VanDerWaalsContact CZ2-CB 3.41Å; W453-Y483 AromaticContact CZ2-CG 3.94Å; W453-Y483 HydrophobicContact CZ2-CG 3.94Å; W453-Y483 AromaticContact NE1-CD1 3.45Å; W453-Y483 AromaticContact NE1-CD2 3.61Å; W453-Y483 AromaticContact NE1-CE1 3.79Å; W453-Y483 AromaticContact NE1-CE2 3.95Å; W453-Y483 AromaticContact NE1-CG 3.34Å; W453-Y483 VanDerWaalsContact NE1-CG 3.34Å; W453-L484 HydrophobicContact CH2-CD2 3.78Å; W453-L484 HydrophobicContact CH2-CG 4.1Å; W453-L484 HydrophobicContact CZ3-CD2 3.95Å; W453-P516 HydrophobicContact CB-CG 4.27Å
454	E	90.3	Very high	90.4	Very high	90 Å²	90	38.6 Å²	38.6	42%	0.421	19%	0.193	S	C	.	.	H	α-helix	trans	-62.9	-37.4	178.3	-171.7	64.1	-158.1	0	0	113.8	A449 K457 P516	A449-E454 VanDerWaalsContact O-CB 3.32Å; A449-E454 WeakPolarHBondContact O-CB 3.23Å; A449-E454 PolarHBondContact O-N 3.03Å; E454-K457 WeakPolarHBondContact O-CD 3.34Å; E454-K457 IonicContact OE1-NZ 2.72Å; E454-K457 PolarHBondContact OE1-NZ 3.46Å; E454-P516 WeakPolarHBondContact OE2-CD 3.31Å
455	P	91.4	Very high	91	Very high	67 Å²	67	38.2 Å²	38.2	44%	0.435	19%	0.191	S	C	.	.	H	α-helix	trans	-72.5	-25	170.9	-23.1	35.8	0	0	0	115.8	I452	I452-P455 WeakPolarHBondContact O-CD 3.32Å
456	L	92.4	Very high	91.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-99.9	-14.6	-171.7	-66.4	178.5	0	0	0	114.4	V420 V422 I452 W453 D458 T459 L462 Y518	V420-L456 HydrophobicContact CG1-CD1 3.99Å; V420-L456 HydrophobicContact CG1-CD2 4.06Å; V420-L456 HydrophobicContact CG1-CG 3.9Å; V422-L456 HydrophobicContact CG2-CD2 4.19Å; I452-L456 HydrophobicContact CG2-CD1 3.95Å; I452-L456 WeakPolarHBondContact O-CB 3.47Å; I452-L456 WeakPolarHBondContact O-CD1 3.49Å; I452-L456 WeakPolarHBondContact O-CG 3.27Å; I452-L456 PolarHBondContact O-N 3.07Å; W453-L456 PolarHBondContact O-N 2.87Å; L456-D458 PolarHBondContact O-N 3Å; L456-T459 HydrophobicContact CD2-CG2 4.41Å; L456-T459 WeakPolarHBondContact O-CB 3.33Å; L456-T459 PolarHBondContact O-N 3.37Å; L456-T459 PolarHBondContact O-OG1 3.03Å; L456-L462 HydrophobicContact CD1-CD1 3.85Å; L456-Y518 WeakPolarHBondContact O-CE2 3.27Å
457	K	88.1	Confident	91.6	Very high	76 Å²	76	35.1 Å²	35.1	33%	0.33	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-25.8	-174.2	72.1	-171	-178.7	179.8	0	116.4	W453 E454 P516	W453-K457 WeakPolarHBondContact O-CB 3.49Å; W453-K457 PolarHBondContact O-N 2.88Å; E454-K457 WeakPolarHBondContact O-CD 3.34Å; E454-K457 IonicContact OE1-NZ 2.72Å; E454-K457 PolarHBondContact OE1-NZ 3.46Å; K457-P516 HydrophobicContact CB-CB 3.87Å; K457-P516 HydrophobicContact CB-CG 3.74Å; K457-P516 HydrophobicContact CD-CB 4.43Å; K457-P516 HydrophobicContact CD-CG 4.07Å; K457-P516 HydrophobicContact CG-CG 4.49Å
458	D	88.1	Confident	91.7	Very high	123 Å²	123	39.3 Å²	39.3	66%	0.658	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.5	9.2	-176	-58.4	-54.7	0	0	0	112.7	N426 L456	N426-D458 PolarHBondContact ND2-O 3.24Å; L456-D458 PolarHBondContact O-N 3Å
459	T	92.3	Very high	91.6	Very high	4 Å²	4	39 Å²	39	3%	0.025	19%	0.19	C	C	.	.			trans	-88.4	137.8	179.3	61	0	0	0	0	112.3	V422 N426 L456 N461 Y518	V422-T459 HydrophobicContact CG1-CG2 3.96Å; V422-T459 HydrophobicContact CG2-CG2 4Å; N426-T459 CarbonylContact O-C 3.45Å; N426-T459 WeakPolarHBondContact O-CA 3.19Å; N426-T459 WeakPolarHBondContact O-CB 3.38Å; L456-T459 HydrophobicContact CD2-CG2 4.41Å; L456-T459 WeakPolarHBondContact O-CB 3.33Å; L456-T459 PolarHBondContact O-N 3.37Å; L456-T459 PolarHBondContact O-OG1 3.03Å; T459-N461 VanDerWaalsContact C-N 3.34Å; T459-N461 PolarHBondContact O-N 3.45Å; T459-Y518 WeakPolarHBondContact O-CE2 3.42Å; T459-Y518 PolarHBondContact O-OH 3.38Å; T459-Y518 WeakPolarHBondContact OG1-CE2 3.45Å; T459-Y518 PolarHBondContact OG1-OH 2.79Å
460	D	88.1	Confident	91.3	Very high	93 Å²	93	42.1 Å²	42.1	50%	0.497	21%	0.208	S	C	.	.	S	Bend	trans	-70.7	-28.6	-174.5	-66.1	-62.8	0	0	0	113.3	N426	N426-D460 WeakPolarHBondContact CB-OD2 3.29Å; N426-D460 PolarHBondContact ND2-N 2.97Å; N426-D460 PolarHBondContact ND2-OD2 2.66Å; N426-D460 PolarHBondContact O-N 2.68Å
461	N	91.9	Very high	90.8	Very high	22 Å²	22	42.9 Å²	42.9	12%	0.118	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	155.4	178.8	-62.4	-96.1	0	0	0	109.8	T427 G428 T459 Y518 G523 Y525 M614	T427-N461 CarbonylContact C-O 3.55Å; T427-N461 WeakPolarHBondContact CA-O 3.22Å; T427-N461 HydrophobicContact CG2-CB 4.24Å; G428-N461 PolarHBondContact N-O 3.44Å; T459-N461 VanDerWaalsContact C-N 3.34Å; T459-N461 PolarHBondContact O-N 3.45Å; N461-Y518 WeakPolarHBondContact CA-OH 3.46Å; N461-Y518 PolarHBondContact N-OH 2.81Å; N461-Y518 VanDerWaalsContact N-OH 3.16Å; N461-Y518 PolarHBondContact O-OH 2.99Å; N461-G523 CarbonylContact C-O 3.48Å; N461-G523 VanDerWaalsContact CA-O 3.29Å; N461-G523 WeakPolarHBondContact CA-O 3.4Å; N461-G523 WeakPolarHBondContact OD1-CA 3.23Å; N461-Y525 HydrophobicContact CB-CE2 4.1Å; N461-Y525 WeakPolarHBondContact OD1-CE2 3.32Å; N461-M614 HydrophobicContact CB-CE 3.79Å; N461-M614 HydrophobicContact CB-SD 4.34Å
462	L	94.4	Very high	90.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.4	178.5	174.3	59.4	0	0	0	111	L430 W453 L456 I464 L484 Y518 G523 V524 Y525	L430-L462 HydrophobicContact CB-CD1 4.13Å; W453-L462 HydrophobicContact CZ3-CD2 4.16Å; L456-L462 HydrophobicContact CD1-CD1 3.85Å; L462-I464 HydrophobicContact CD2-CD1 4.31Å; L462-I464 HydrophobicContact CD2-CG1 4.23Å; L462-I464 HydrophobicContact CG-CG1 4.04Å; L462-L484 HydrophobicContact CD2-CD2 3.78Å; L462-Y518 HydrophobicContact CB-CD1 4.07Å; L462-Y518 HydrophobicContact CB-CE1 3.38Å; L462-Y518 HydrophobicContact CD2-CD1 3.9Å; L462-Y518 HydrophobicContact CD2-CE1 4.1Å; L462-Y518 HydrophobicContact CD2-CG 4.34Å; L462-Y518 HydrophobicContact CG-CE1 4.4Å; L462-Y518 PolarHBondContact N-OH 2.61Å; L462-G523 PolarHBondContact N-O 3.34Å; L462-V524 CarbonylContact O-C 3.49Å; L462-V524 WeakPolarHBondContact O-CA 3.46Å; L462-Y525 PolarHBondContact O-N 3.29Å
463	I	96	Very high	89.5	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.7	171.5	-55	-179	0	0	0	108.8	T427 G428 Y429 L430 Y525 L527 L607 V610	T427-I463 HydrophobicContact CG2-CD1 3.86Å; T427-I463 HydrophobicContact CG2-CG1 3.84Å; G428-I463 PolarHBondContact O-N 3.28Å; Y429-I463 WeakPolarHBondContact CA-O 3.46Å; Y429-I463 HydrophobicContact CD2-CB 4.23Å; Y429-I463 HydrophobicContact CD2-CG2 4.13Å; L430-I463 PolarHBondContact N-O 3.22Å; I463-Y525 CarbonylContact C-O 3.5Å; I463-Y525 WeakPolarHBondContact CA-O 3.36Å; I463-L527 HydrophobicContact CG2-CD1 3.89Å; I463-L527 HydrophobicContact CG2-CD2 4.33Å; I463-L527 HydrophobicContact CG2-CG 3.87Å; I463-L607 HydrophobicContact CD1-CD1 3.73Å; I463-L607 HydrophobicContact CG2-CD1 4.39Å; I463-V610 HydrophobicContact CD1-CG1 3.71Å; I463-V610 HydrophobicContact CG1-CG1 3.97Å
464	I	95.8	Very high	88.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	112.9	178	-52.5	-179.2	0	0	0	108.5	L430 F432 L462 L466 L484 V524 Y525 V526 L527	L430-I464 HydrophobicContact CD2-CG1 4.5Å; L430-I464 CarbonylContact O-C 3.6Å; L430-I464 VanDerWaalsContact O-CA 3.27Å; L430-I464 WeakPolarHBondContact O-CA 3.41Å; F432-I464 HydrophobicContact CE1-CG2 3.79Å; F432-I464 HydrophobicContact CZ-CG2 4.24Å; L462-I464 HydrophobicContact CD2-CD1 4.31Å; L462-I464 HydrophobicContact CD2-CG1 4.23Å; L462-I464 HydrophobicContact CG-CG1 4.04Å; I464-L466 HydrophobicContact CG2-CD2 3.93Å; I464-L466 HydrophobicContact CG2-CG 4.23Å; I464-L484 HydrophobicContact CD1-CD1 3.66Å; I464-L484 HydrophobicContact CD1-CD2 4.09Å; I464-V524 HydrophobicContact CD1-CG1 3.88Å; I464-V524 HydrophobicContact CG1-CG1 4.42Å; I464-Y525 PolarHBondContact N-O 2.91Å; I464-V526 HydrophobicContact CB-CG2 4.3Å; I464-V526 CarbonylContact O-C 3.42Å; I464-V526 VanDerWaalsContact O-CA 3.31Å; I464-V526 WeakPolarHBondContact O-CA 3.36Å; I464-L527 PolarHBondContact O-N 3.43Å
465	D	96.3	Very high	88.2	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	105.4	-174.4	-165.6	-9.9	0	0	0	111.4	Y429 L430 R431 R467 L527	Y429-D465 HydrophobicContact CE2-CB 3.73Å; Y429-D465 PolarHBondContact OH-OD2 3.48Å; L430-D465 PolarHBondContact O-N 2.99Å; R431-D465 HydrophobicContact CB-CB 3.93Å; R431-D465 HydrophobicContact CG-CB 4.12Å; D465-R467 WeakPolarHBondContact OD1-CB 3.33Å; D465-R467 WeakPolarHBondContact OD1-CG 3.41Å; D465-R467 IonicContact OD1-CZ 3.66Å; D465-R467 PolarHBondContact OD1-N 3.02Å; D465-R467 IonicContact OD1-NE 3.76Å; D465-R467 PolarHBondContact OD1-NE 2.75Å; D465-R467 IonicContact OD1-NH2 2.73Å; D465-R467 IonicContact OD2-CZ 2.66Å; D465-R467 IonicContact OD2-NE 2.75Å; D465-R467 IonicContact OD2-NH2 3.6Å; D465-R467 PolarHBondContact OD2-NH2 2.87Å; D465-L527 HydrophobicContact CB-CD1 4.28Å
466	L	95.1	Very high	87.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.206	C	C	.	.			trans	-107.6	5.3	179.7	-53.9	-177.3	0	0	0	112.9	F432 I464 Y468 N469 V526 L527 T532 L539	F432-L466 HydrophobicContact CD2-CD2 4.35Å; F432-L466 HydrophobicContact CE1-CD2 4.06Å; F432-L466 HydrophobicContact CE2-CD2 3.63Å; F432-L466 HydrophobicContact CZ-CD2 3.47Å; F432-L466 VanDerWaalsContact CZ-CD2 3.47Å; I464-L466 HydrophobicContact CG2-CD2 3.93Å; I464-L466 HydrophobicContact CG2-CG 4.23Å; L466-Y468 PolarHBondContact O-N 3.09Å; L466-N469 HydrophobicContact CB-CB 4.2Å; L466-N469 HydrophobicContact CD2-CB 4.42Å; L466-N469 WeakPolarHBondContact O-CB 3.37Å; L466-N469 PolarHBondContact O-N 3.4Å; L466-V526 HydrophobicContact CD1-CG1 3.52Å; L466-V526 HydrophobicContact CG-CG1 3.93Å; L466-L527 CarbonylContact C-O 3.6Å; L466-L527 WeakPolarHBondContact CA-O 3.4Å; L466-L527 WeakPolarHBondContact CB-O 3.41Å; L466-L527 PolarHBondContact N-O 3.02Å; L466-T532 HydrophobicContact CB-CG2 4.12Å; L466-T532 PolarHBondContact O-OG1 2.86Å; L466-L539 HydrophobicContact CD1-CB 4.24Å; L466-L539 HydrophobicContact CD1-CD2 4Å; L466-L539 HydrophobicContact CD1-CG 4.23Å; L466-L539 HydrophobicContact CD2-CD2 4.3Å
467	R	93.8	Very high	87.4	Confident	29 Å²	29	40.4 Å²	40.4	11%	0.109	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-9.2	-177.8	-65.1	178.4	-68.8	178.2	-1.5	115	D465 L527 S529 A603	D465-R467 WeakPolarHBondContact OD1-CB 3.33Å; D465-R467 WeakPolarHBondContact OD1-CG 3.41Å; D465-R467 IonicContact OD1-CZ 3.66Å; D465-R467 PolarHBondContact OD1-N 3.02Å; D465-R467 IonicContact OD1-NE 3.76Å; D465-R467 PolarHBondContact OD1-NE 2.75Å; D465-R467 IonicContact OD1-NH2 2.73Å; D465-R467 IonicContact OD2-CZ 2.66Å; D465-R467 IonicContact OD2-NE 2.75Å; D465-R467 IonicContact OD2-NH2 3.6Å; D465-R467 PolarHBondContact OD2-NH2 2.87Å; R467-L527 HydrophobicContact CG-CB 3.8Å; R467-L527 PolarHBondContact N-O 3.44Å; R467-S529 WeakPolarHBondContact CA-OG 3.29Å; R467-S529 PolarHBondContact O-OG 2.95Å; R467-A603 WeakPolarHBondContact CD-O 3.37Å; R467-A603 PolarHBondContact NH1-O 2.75Å
468	Y	89.6	Confident	87.3	Confident	107 Å²	107	37.8 Å²	37.8	42%	0.42	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.1	3	-179.3	-51.6	-88.1	0	0	0	112.1	R431 L466 T470	R431-Y468 VanDerWaalsContact NH1-CD2 3.25Å; R431-Y468 VanDerWaalsContact NH2-CG 3.3Å; L466-Y468 PolarHBondContact O-N 3.09Å; Y468-T470 PolarHBondContact O-N 2.87Å
469	N	87.9	Confident	87.2	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.168	C	C	.	.			trans	-85	104.1	-174	-166.4	-56.7	0	0	0	110.8	F432 D433 L466 T532 A533	F432-N469 VanDerWaalsContact CD2-ND2 3.27Å; F432-N469 WeakPolarHBondContact CD2-ND2 3.5Å; F432-N469 WeakPolarHBondContact CE2-ND2 3.4Å; F432-N469 PolarHBondContact O-ND2 2.94Å; D433-N469 WeakPolarHBondContact O-CA 3.27Å; L466-N469 HydrophobicContact CB-CB 4.2Å; L466-N469 HydrophobicContact CD2-CB 4.42Å; L466-N469 WeakPolarHBondContact O-CB 3.37Å; L466-N469 PolarHBondContact O-N 3.4Å; N469-T532 CarbonylContact O-C 3.55Å; N469-T532 WeakPolarHBondContact O-CA 3.22Å; N469-A533 PolarHBondContact O-N 2.91Å
470	T	82.1	Confident	86.9	Confident	72 Å²	72	32.4 Å²	32.4	44%	0.442	17%	0.167	S	C	.	.			trans	-107.4	-8.4	-171.2	48.8	0	0	0	0	113.9	D433 Y468 H531	D433-T470 PolarHBondContact O-N 3.21Å; Y468-T470 PolarHBondContact O-N 2.87Å; T470-H531 WeakPolarHBondContact CG2-O 3.16Å
471	R	79	Confident	87	Confident	151 Å²	151	28 Å²	28	57%	0.57	14%	0.144	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-155.1	143.3	-167.3	-62.9	-175	176.3	-178.7	-5.6	113.3	E434 L435	E434-R471 VanDerWaalsContact CA-O 3.25Å; E434-R471 WeakPolarHBondContact CA-O 3.26Å; L435-R471 PolarHBondContact N-O 3.03Å
472	G	75.6	Confident	86.8	Confident	28 Å²	28	27 Å²	27	29%	0.289	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-175	-165	164.2	0	0	0	0	0	114.1	L435	L435-G472 CarbonylContact O-C 3.57Å; L435-G472 WeakPolarHBondContact O-CA 3.33Å
473	S	79.1	Confident	86.4	Confident	15 Å²	15	27 Å²	27	11%	0.105	14%	0.139	C	C	.	.			trans	-126.3	131	166.6	175.2	0	0	0	0	110.1	L435 E437 N475 S476 T535	L435-S473 PolarHBondContact O-N 2.9Å; E437-S473 VanDerWaalsContact OE2-CB 3.31Å; E437-S473 WeakPolarHBondContact OE2-CB 3.38Å; E437-S473 PolarHBondContact OE2-OG 3.27Å; S473-N475 PolarHBondContact O-N 2.69Å; S473-N475 VanDerWaalsContact O-N 3.08Å; S473-N475 PolarHBondContact OG-N 3.06Å; S473-S476 PolarHBondContact O-N 3.36Å; S473-T535 PolarHBondContact N-OG1 3.47Å
474	S	79.1	Confident	86	Confident	23 Å²	23	27.1 Å²	27.1	16%	0.161	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-56.3	-26.5	178.9	-33.5	0	0	0	0	112.6	S476 L477 T535 E538	S474-S476 PolarHBondContact O-N 3.17Å; S474-L477 WeakPolarHBondContact O-CB 3.18Å; S474-L477 PolarHBondContact O-N 3.27Å; S474-L477 VanDerWaalsContact O-N 3.16Å; S474-T535 PolarHBondContact N-OG1 3.33Å; S474-E538 VanDerWaalsContact CB-OE2 3.24Å; S474-E538 WeakPolarHBondContact CB-OE2 3.45Å; S474-E538 VanDerWaalsContact OG-CD 3.22Å; S474-E538 PolarHBondContact OG-OE1 3.23Å; S474-E538 PolarHBondContact OG-OE2 2.79Å
475	N	76.1	Confident	85.3	Confident	82 Å²	82	27.3 Å²	27.3	44%	0.439	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-58.3	-29.7	175.4	-71.9	-17.1	0	0	0	112.8	E437 S473 H507	E437-N475 PolarHBondContact OE1-ND2 2.97Å; S473-N475 PolarHBondContact O-N 2.69Å; S473-N475 VanDerWaalsContact O-N 3.08Å; S473-N475 PolarHBondContact OG-N 3.06Å; N475-H507 PolarHBondContact OD1-CE1 2.98Å
476	S	79.8	Confident	84.1	Confident	22 Å²	22	30.4 Å²	30.4	15%	0.154	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-83.2	-12.2	-179.4	-68	0	0	0	0	114.1	A436 S473 S474 T478 L479	A436-S476 PolarHBondContact O-OG 3.1Å; S473-S476 PolarHBondContact O-N 3.36Å; S474-S476 PolarHBondContact O-N 3.17Å; S476-T478 PolarHBondContact O-N 3.06Å; S476-L479 PolarHBondContact O-N 2.94Å
477	L	86.8	Confident	82.5	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.7	-39.7	-179.8	-68.9	169.7	0	0	0	113	L435 S474 L479 M480 L481 F494 T535 E538 L539 L542	L435-L477 HydrophobicContact CD1-CD2 4.47Å; S474-L477 WeakPolarHBondContact O-CB 3.18Å; S474-L477 PolarHBondContact O-N 3.27Å; S474-L477 VanDerWaalsContact O-N 3.16Å; L477-L479 PolarHBondContact O-N 3.1Å; L477-L479 VanDerWaalsContact O-N 3.1Å; L477-M480 PolarHBondContact O-N 3.4Å; L477-L481 HydrophobicContact CB-CD1 4.28Å; L477-L481 WeakPolarHBondContact O-CG 3.46Å; L477-L481 PolarHBondContact O-N 2.82Å; L477-F494 HydrophobicContact CB-CE1 3.99Å; L477-F494 HydrophobicContact CB-CZ 4.05Å; L477-F494 HydrophobicContact CD1-CE1 4.21Å; L477-F494 HydrophobicContact CD1-CZ 3.93Å; L477-T535 HydrophobicContact CD1-CG2 4.18Å; L477-T535 HydrophobicContact CD2-CG2 3.5Å; L477-T535 VanDerWaalsContact CD2-CG2 3.5Å; L477-T535 HydrophobicContact CG-CG2 3.69Å; L477-E538 HydrophobicContact CD1-CB 3.57Å; L477-L539 HydrophobicContact CD2-CB 3.68Å; L477-L539 HydrophobicContact CD2-CD1 4.17Å; L477-L539 HydrophobicContact CD2-CG 4.4Å; L477-L542 HydrophobicContact CD1-CD1 4.18Å
478	T	86.2	Confident	80.9	Confident	21 Å²	21	35.4 Å²	35.4	13%	0.129	20%	0.196	C	C	.	.	H	α-helix	trans	-52.7	-35.2	-179.3	-43.3	0	0	0	0	112.3	S476 S482 F493 H507 K508	S476-T478 PolarHBondContact O-N 3.06Å; T478-S482 WeakPolarHBondContact O-CB 3.28Å; T478-S482 PolarHBondContact O-N 3.29Å; T478-S482 PolarHBondContact O-OG 2.96Å; T478-F493 HydrophobicContact CG2-CD2 4.35Å; T478-F493 HydrophobicContact CG2-CE2 4.48Å; T478-H507 PolarHBondContact OG1-ND1 3.21Å; T478-K508 WeakPolarHBondContact CG2-O 3.33Å
479	L	85.3	Confident	79.4	Confident	13 Å²	13	38.1 Å²	38.1	7%	0.068	21%	0.212	C	C	.	.	H	α-helix	trans	-70	-42.6	177.9	175.3	57.4	0	0	0	111.9	L444 E445 M448 S476 L477 Y483 L510	L444-L479 HydrophobicContact CD2-CD2 4.14Å; L444-L479 HydrophobicContact CG-CD2 4.21Å; E445-L479 HydrophobicContact CB-CD1 3.86Å; E445-L479 HydrophobicContact CG-CD1 3.76Å; M448-L479 HydrophobicContact CE-CD2 4.42Å; M448-L479 HydrophobicContact SD-CD2 3.62Å; M448-L479 HydrophobicContact SD-CG 4.27Å; S476-L479 PolarHBondContact O-N 2.94Å; L477-L479 PolarHBondContact O-N 3.1Å; L477-L479 VanDerWaalsContact O-N 3.1Å; L479-Y483 HydrophobicContact CD1-CE2 4.22Å; L479-Y483 WeakPolarHBondContact O-CD2 3.26Å; L479-L510 HydrophobicContact CD1-CD1 3.86Å
480	M	87.8	Confident	78	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-68.1	-48.6	178.4	-169.1	66.4	67.8	0	0	111.2	F418 L430 F432 L435 M448 W453 L477 S482 Y483 L484 L539	F418-M480 HydrophobicContact CE1-CE 3.91Å; L430-M480 HydrophobicContact CD2-SD 4.27Å; F432-M480 HydrophobicContact CD1-CE 4.26Å; F432-M480 HydrophobicContact CE1-CE 3.6Å; F432-M480 HydrophobicContact CE1-SD 4.43Å; F432-M480 HydrophobicContact CE2-CE 4.44Å; F432-M480 HydrophobicContact CZ-CE 3.72Å; L435-M480 HydrophobicContact CD2-CE 4.39Å; M448-M480 HydrophobicContact CE-CE 3.88Å; W453-M480 HydrophobicContact CH2-SD 3.89Å; W453-M480 HydrophobicContact CZ2-SD 3.63Å; L477-M480 PolarHBondContact O-N 3.4Å; M480-S482 VanDerWaalsContact C-N 3.31Å; M480-S482 PolarHBondContact O-N 2.94Å; M480-Y483 PolarHBondContact O-N 2.83Å; M480-Y483 VanDerWaalsContact O-N 3.13Å; M480-L484 HydrophobicContact CG-CD1 4.06Å; M480-L484 PolarHBondContact O-N 2.88Å; M480-L539 HydrophobicContact CG-CD1 4.37Å; M480-L539 HydrophobicContact CG-CD2 4.23Å
481	L	88.7	Confident	77.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.4	-33.3	-176.8	-66.3	165.8	0	0	0	112.8	L477 Y483 L484 C485 F493 F494 L539 L542 I543 L546	L477-L481 HydrophobicContact CB-CD1 4.28Å; L477-L481 WeakPolarHBondContact O-CG 3.46Å; L477-L481 PolarHBondContact O-N 2.82Å; L481-Y483 PolarHBondContact O-N 3.27Å; L481-Y483 VanDerWaalsContact O-N 3.11Å; L481-L484 PolarHBondContact O-N 3.12Å; L481-L484 VanDerWaalsContact O-N 3.11Å; L481-C485 WeakPolarHBondContact O-CB 3.4Å; L481-C485 PolarHBondContact O-N 3.34Å; L481-F493 HydrophobicContact CB-CD1 4.36Å; L481-F493 HydrophobicContact CB-CD2 3.75Å; L481-F493 HydrophobicContact CB-CE1 4.19Å; L481-F493 HydrophobicContact CB-CE2 3.52Å; L481-F493 HydrophobicContact CB-CG 4.16Å; L481-F493 HydrophobicContact CB-CZ 3.76Å; L481-F493 HydrophobicContact CD1-CB 4.11Å; L481-F493 HydrophobicContact CD1-CD2 4.07Å; L481-F493 HydrophobicContact CD1-CG 4.09Å; L481-F494 HydrophobicContact CD1-CE1 4.26Å; L481-L539 HydrophobicContact CD2-CD1 3.84Å; L481-L539 HydrophobicContact CG-CD1 4.23Å; L481-L542 HydrophobicContact CD1-CB 4.31Å; L481-L542 HydrophobicContact CD1-CD1 3.57Å; L481-L542 HydrophobicContact CD2-CB 4.36Å; L481-I543 HydrophobicContact CD2-CD1 4.39Å; L481-L546 HydrophobicContact CD1-CD1 4.32Å; L481-L546 HydrophobicContact CD2-CD1 3.98Å
482	S	87.7	Confident	77.9	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.014	22%	0.223	C	C	.	.	H	α-helix	trans	-63.7	-13.4	176.1	-61.9	0	0	0	0	114.6	T478 M480 L510	T478-S482 WeakPolarHBondContact O-CB 3.28Å; T478-S482 PolarHBondContact O-N 3.29Å; T478-S482 PolarHBondContact O-OG 2.96Å; M480-S482 VanDerWaalsContact C-N 3.31Å; M480-S482 PolarHBondContact O-N 2.94Å; S482-L510 WeakPolarHBondContact OG-CG 3.43Å; S482-L510 PolarHBondContact OG-N 3.5Å
483	Y	87.3	Confident	78.4	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-101.7	-20.9	174.1	-80.1	-97.8	0	0	0	113.3	E445 W453 L479 M480 L481 T513 T514 G515 P516 V517 Y518 N519	E445-Y483 HydrophobicContact CG-CE2 4.14Å; E445-Y483 WeakPolarHBondContact CG-OH 3.31Å; E445-Y483 PolarHBondContact OE1-OH 3.3Å; W453-Y483 HydrophobicContact CB-CD1 3.96Å; W453-Y483 HydrophobicContact CB-CE1 4Å; W453-Y483 AromaticContact CD1-CD1 3.23Å; W453-Y483 AromaticContact CD1-CE1 3.24Å; W453-Y483 AromaticContact CD1-CG 3.68Å; W453-Y483 AromaticContact CD1-CZ 3.71Å; W453-Y483 AromaticContact CD2-CD1 3.56Å; W453-Y483 HydrophobicContact CD2-CD1 3.56Å; W453-Y483 HydrophobicContact CD2-CE1 4.32Å; W453-Y483 AromaticContact CD2-CG 3.83Å; W453-Y483 HydrophobicContact CD2-CG 3.83Å; W453-Y483 VanDerWaalsContact CE2-CB 3.43Å; W453-Y483 AromaticContact CE2-CD1 3.68Å; W453-Y483 AromaticContact CE2-CG 3.46Å; W453-Y483 VanDerWaalsContact CE2-CG 3.46Å; W453-Y483 HydrophobicContact CE3-CD1 4.35Å; W453-Y483 AromaticContact CG-CD1 3.31Å; W453-Y483 HydrophobicContact CG-CD1 3.31Å; W453-Y483 AromaticContact CG-CE1 3.6Å; W453-Y483 HydrophobicContact CG-CE1 3.6Å; W453-Y483 AromaticContact CG-CG 3.99Å; W453-Y483 HydrophobicContact CG-CG 3.99Å; W453-Y483 VanDerWaalsContact CZ2-CB 3.41Å; W453-Y483 AromaticContact CZ2-CG 3.94Å; W453-Y483 HydrophobicContact CZ2-CG 3.94Å; W453-Y483 AromaticContact NE1-CD1 3.45Å; W453-Y483 AromaticContact NE1-CD2 3.61Å; W453-Y483 AromaticContact NE1-CE1 3.79Å; W453-Y483 AromaticContact NE1-CE2 3.95Å; W453-Y483 AromaticContact NE1-CG 3.34Å; W453-Y483 VanDerWaalsContact NE1-CG 3.34Å; L479-Y483 HydrophobicContact CD1-CE2 4.22Å; L479-Y483 WeakPolarHBondContact O-CD2 3.26Å; M480-Y483 PolarHBondContact O-N 2.83Å; M480-Y483 VanDerWaalsContact O-N 3.13Å; L481-Y483 PolarHBondContact O-N 3.27Å; L481-Y483 VanDerWaalsContact O-N 3.11Å; Y483-T513 HydrophobicContact CD2-CG2 4.07Å; Y483-T513 HydrophobicContact CE1-CG2 4.19Å; Y483-T513 HydrophobicContact CE2-CG2 3.69Å; Y483-T513 HydrophobicContact CG-CG2 4.47Å; Y483-T514 PolarHBondContact OH-N 3.12Å; Y483-G515 PolarHBondContact OH-N 3.42Å; Y483-P516 VanDerWaalsContact CD1-O 3.29Å; Y483-P516 WeakPolarHBondContact CD1-O 3.49Å; Y483-V517 WeakPolarHBondContact O-CG1 3.41Å; Y483-Y518 WeakPolarHBondContact O-CA 3.45Å; Y483-Y518 WeakPolarHBondContact O-CB 3.4Å; Y483-Y518 PolarHBondContact O-N 2.65Å; Y483-N519 PolarHBondContact O-N 3.06Å
484	L	87.1	Confident	79	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-94.3	-42	-177.6	-62.3	173.8	0	0	0	112.4	W453 L462 I464 M480 L481 N519 V524 I543	W453-L484 HydrophobicContact CH2-CD2 3.78Å; W453-L484 HydrophobicContact CH2-CG 4.1Å; W453-L484 HydrophobicContact CZ3-CD2 3.95Å; L462-L484 HydrophobicContact CD2-CD2 3.78Å; I464-L484 HydrophobicContact CD1-CD1 3.66Å; I464-L484 HydrophobicContact CD1-CD2 4.09Å; M480-L484 HydrophobicContact CG-CD1 4.06Å; M480-L484 PolarHBondContact O-N 2.88Å; L481-L484 PolarHBondContact O-N 3.12Å; L481-L484 VanDerWaalsContact O-N 3.11Å; L484-N519 CarbonylContact O-C 3.33Å; L484-N519 WeakPolarHBondContact O-CA 3.46Å; L484-V524 HydrophobicContact CD2-CG1 4.38Å; L484-V524 HydrophobicContact CD2-CG2 4.41Å; L484-I543 HydrophobicContact CD1-CD1 3.75Å
485	C	79.9	Confident	79.6	Confident	4 Å²	4	38.1 Å²	38.1	3%	0.027	20%	0.203	C	C	.	.	S	Bend	trans	-86.3	152.3	-177.4	-56.5	0	0	0	0	112.3	L481 C487 F493	L481-C485 WeakPolarHBondContact O-CB 3.4Å; L481-C485 PolarHBondContact O-N 3.34Å; C485-C487 PolarHBondContact O-N 2.85Å; C485-C487 VanDerWaalsContact O-N 3.11Å; C485-C487 PolarHBondContact O-SG 2.86Å; C485-C487 VanDerWaalsContact O-SG 3.4Å; C485-F493 HydrophobicContact CB-CE1 3.81Å; C485-F493 HydrophobicContact CB-CZ 4.31Å
486	D	71.1	Confident	80.3	Confident	66 Å²	66	35.1 Å²	35.1	35%	0.353	19%	0.186	S	C	.	.			trans	-75.5	99.6	171.8	-171.2	-35.2	0	0	0	110.4	S488 S520	D486-S488 VanDerWaalsContact C-N 3.29Å; D486-S488 PolarHBondContact O-N 3.39Å; D486-S488 WeakPolarHBondContact OD1-CB 3.49Å; D486-S488 PolarHBondContact OD1-N 3.48Å; D486-S488 PolarHBondContact OD1-OG 3.14Å; D486-S520 WeakPolarHBondContact CB-OG 3.4Å
487	C	63.4	Low	80.8	Confident	35 Å²	35	36.2 Å²	36.2	24%	0.236	19%	0.19	C	C	.	.			trans	-91.7	29.5	-179.1	-55.8	0	0	0	0	113	C485 Q489	C485-C487 PolarHBondContact O-N 2.85Å; C485-C487 VanDerWaalsContact O-N 3.11Å; C485-C487 PolarHBondContact O-SG 2.86Å; C485-C487 VanDerWaalsContact O-SG 3.4Å; C487-Q489 CarbonylContact C-O 3.39Å; C487-Q489 PolarHBondContact O-N 3.4Å; C487-Q489 VanDerWaalsContact O-N 3.16Å
488	S	59.5	Low	81	Confident	100 Å²	100	36.6 Å²	36.6	70%	0.699	19%	0.192	S	C	*	.	S	Bend	trans	-62.9	-16.5	-179.7	52.2	0	0	0	0	114.3	D486	D486-S488 VanDerWaalsContact C-N 3.29Å; D486-S488 PolarHBondContact O-N 3.39Å; D486-S488 WeakPolarHBondContact OD1-CB 3.49Å; D486-S488 PolarHBondContact OD1-N 3.48Å; D486-S488 PolarHBondContact OD1-OG 3.14Å
489	Q	57.3	Low	81.2	Confident	163 Å²	163	38.9 Å²	38.9	76%	0.762	20%	0.199	S	C	*	.	S	Bend	trans	-120.9	157.8	159	-58.8	-169.7	29.6	0	0	109.8	C487 Q491	C487-Q489 CarbonylContact C-O 3.39Å; C487-Q489 PolarHBondContact O-N 3.4Å; C487-Q489 VanDerWaalsContact O-N 3.16Å; Q489-Q491 VanDerWaalsContact C-N 3.32Å; Q489-Q491 PolarHBondContact O-N 2.75Å
490	K	59.2	Low	81.3	Confident	162 Å²	162	42.8 Å²	42.8	70%	0.704	22%	0.218	S	C	*	.			trans	-72.7	83.6	-177.8	-171	-173.1	178.5	-176.7	0	111.2
491	Q	72.1	Confident	81.3	Confident	72 Å²	72	49.7 Å²	49.7	34%	0.336	25%	0.248	S	C	.	.			trans	-79.3	152.4	-176	-159.6	176.5	13.4	0	0	111.9	Q489 K508 S509	Q489-Q491 VanDerWaalsContact C-N 3.32Å; Q489-Q491 PolarHBondContact O-N 2.75Å; Q491-K508 WeakPolarHBondContact O-CA 3.39Å; Q491-S509 PolarHBondContact N-OG 2.94Å; Q491-S509 PolarHBondContact O-N 3.45Å; Q491-S509 PolarHBondContact O-OG 2.95Å
492	N	85.9	Confident	81.2	Confident	35 Å²	35	55.6 Å²	55.6	19%	0.187	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	126.6	162.5	-166.7	64.7	0	0	0	108.3	F494 T495 E506 H507 K508	N492-F494 PolarHBondContact ND2-O 2.89Å; N492-F494 VanDerWaalsContact ND2-O 3.1Å; N492-F494 PolarHBondContact OD1-O 2.87Å; N492-T495 PolarHBondContact ND2-OG1 3.12Å; N492-E506 WeakPolarHBondContact OD1-CB 3.37Å; N492-H507 PolarHBondContact OD1-N 2.87Å; N492-K508 HydrophobicContact CB-CG 4.14Å; N492-K508 WeakPolarHBondContact OD1-CE 3.33Å; N492-K508 WeakPolarHBondContact OD1-CG 3.12Å
493	F	87.8	Confident	81.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-44.5	177	-63.2	-48.9	0	0	0	111.4	T478 L481 C485 H507 L546 N585	T478-F493 HydrophobicContact CG2-CD2 4.35Å; T478-F493 HydrophobicContact CG2-CE2 4.48Å; L481-F493 HydrophobicContact CB-CD1 4.36Å; L481-F493 HydrophobicContact CB-CD2 3.75Å; L481-F493 HydrophobicContact CB-CE1 4.19Å; L481-F493 HydrophobicContact CB-CE2 3.52Å; L481-F493 HydrophobicContact CB-CG 4.16Å; L481-F493 HydrophobicContact CB-CZ 3.76Å; L481-F493 HydrophobicContact CD1-CB 4.11Å; L481-F493 HydrophobicContact CD1-CD2 4.07Å; L481-F493 HydrophobicContact CD1-CG 4.09Å; C485-F493 HydrophobicContact CB-CE1 3.81Å; C485-F493 HydrophobicContact CB-CZ 4.31Å; F493-H507 PolarHBondContact N-O 3.14Å; F493-L546 HydrophobicContact CB-CD1 4.23Å; F493-L546 HydrophobicContact CD1-CD1 3.73Å; F493-L546 HydrophobicContact CD1-CD2 3.91Å; F493-L546 HydrophobicContact CE1-CD1 4.48Å; F493-L546 HydrophobicContact CG-CD1 4.27Å; F493-N585 PolarHBondContact O-N 3.45Å
494	F	91	Very high	81.5	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	168.9	178.6	60.2	-84.1	0	0	0	110.8	L477 L481 N492 I496 H507 L542 F582 I583	L477-F494 HydrophobicContact CB-CE1 3.99Å; L477-F494 HydrophobicContact CB-CZ 4.05Å; L477-F494 HydrophobicContact CD1-CE1 4.21Å; L477-F494 HydrophobicContact CD1-CZ 3.93Å; L481-F494 HydrophobicContact CD1-CE1 4.26Å; N492-F494 PolarHBondContact ND2-O 2.89Å; N492-F494 VanDerWaalsContact ND2-O 3.1Å; N492-F494 PolarHBondContact OD1-O 2.87Å; F494-I496 HydrophobicContact CD2-CD1 4.39Å; F494-I496 HydrophobicContact CD2-CG1 4.02Å; F494-I496 HydrophobicContact CE2-CD1 3.89Å; F494-I496 HydrophobicContact CE2-CG1 4.01Å; F494-H507 HydrophobicContact CD1-CB 3.89Å; F494-H507 HydrophobicContact CD2-CB 3.95Å; F494-H507 AromaticContact CD2-CD2 3.76Å; F494-H507 AromaticContact CD2-CG 3.81Å; F494-H507 HydrophobicContact CE1-CB 3.64Å; F494-H507 HydrophobicContact CE2-CB 3.7Å; F494-H507 AromaticContact CE2-CD2 3.41Å; F494-H507 VanDerWaalsContact CE2-CD2 3.41Å; F494-H507 WeakPolarHBondContact CE2-CD2 3.47Å; F494-H507 AromaticContact CE2-CE1 3.75Å; F494-H507 AromaticContact CE2-CG 3.24Å; F494-H507 AromaticContact CE2-ND1 3.47Å; F494-H507 WeakPolarHBondContact CE2-ND1 3.35Å; F494-H507 AromaticContact CE2-NE2 3.76Å; F494-H507 HydrophobicContact CG-CB 4.04Å; F494-H507 HydrophobicContact CZ-CB 3.54Å; F494-H507 AromaticContact CZ-CG 3.37Å; F494-H507 AromaticContact CZ-ND1 3.36Å; F494-H507 WeakPolarHBondContact CZ-ND1 3.43Å; F494-H507 WeakPolarHBondContact O-CB 3.37Å; F494-H507 PolarHBondContact O-N 3.44Å; F494-L542 HydrophobicContact CB-CD2 3.98Å; F494-L542 HydrophobicContact CD1-CD1 3.35Å; F494-L542 HydrophobicContact CD1-CD2 4.06Å; F494-L542 HydrophobicContact CD1-CG 4.37Å; F494-L542 HydrophobicContact CE1-CD1 3.57Å; F494-L542 HydrophobicContact CG-CD1 4.15Å; F494-L542 HydrophobicContact CG-CD2 4.33Å; F494-L542 HydrophobicContact CZ-CD1 4.5Å; F494-F582 HydrophobicContact CB-CE1 4.08Å; F494-F582 HydrophobicContact CB-CZ 3.98Å; F494-F582 HydrophobicContact CD1-CZ 4.38Å; F494-F582 HydrophobicContact CD2-CD2 4.28Å; F494-F582 AromaticContact CD2-CE2 3.61Å; F494-F582 HydrophobicContact CD2-CE2 3.61Å; F494-F582 AromaticContact CD2-CZ 3.78Å; F494-F582 HydrophobicContact CD2-CZ 3.78Å; F494-F582 AromaticContact CE2-CE2 3.89Å; F494-F582 HydrophobicContact CE2-CE2 3.89Å; F494-F582 HydrophobicContact CE2-CZ 4.32Å; F494-F582 HydrophobicContact CG-CE1 4.4Å; F494-F582 HydrophobicContact CG-CE2 4.14Å; F494-F582 AromaticContact CG-CZ 3.81Å; F494-F582 HydrophobicContact CG-CZ 3.81Å; F494-I583 CarbonylContact C-O 3.6Å; F494-I583 WeakPolarHBondContact CA-O 3.5Å; F494-I583 VanDerWaalsContact CB-O 3.24Å; F494-I583 WeakPolarHBondContact CB-O 3.29Å
495	T	91.4	Very high	81.6	Confident	21 Å²	21	66 Å²	66	13%	0.129	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	127.4	178.3	-62.3	0	0	0	0	109.4	N492 T504 T505 I583	N492-T495 PolarHBondContact ND2-OG1 3.12Å; T495-T504 HydrophobicContact CG2-CG2 3.58Å; T495-T505 CarbonylContact C-O 3.55Å; T495-T505 WeakPolarHBondContact CA-O 3.49Å; T495-I583 PolarHBondContact N-O 3.22Å; T495-I583 PolarHBondContact O-N 3.34Å
496	I	90.8	Very high	82	Confident	19 Å²	19	71 Å²	71	10%	0.097	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	119.6	174	-68.3	-177.9	0	0	0	108.6	F494 T504 T505 I580 F582	F494-I496 HydrophobicContact CD2-CD1 4.39Å; F494-I496 HydrophobicContact CD2-CG1 4.02Å; F494-I496 HydrophobicContact CE2-CD1 3.89Å; F494-I496 HydrophobicContact CE2-CG1 4.01Å; I496-T504 CarbonylContact O-C 3.58Å; I496-T504 WeakPolarHBondContact O-CA 3.23Å; I496-T505 PolarHBondContact N-O 3.25Å; I496-T505 PolarHBondContact O-N 3.39Å; I496-I580 HydrophobicContact CG2-CG1 4.39Å; I496-I580 HydrophobicContact CG2-CG2 4.03Å; I496-F582 HydrophobicContact CD1-CD2 4.42Å; I496-F582 HydrophobicContact CG1-CD2 4.15Å
497	N	90.4	Very high	82.8	Confident	44 Å²	44	68.3 Å²	68.3	24%	0.235	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	102.5	170	-77.7	-26.7	0	0	0	109.2	T504 I580 N581 I583	N497-T504 VanDerWaalsContact OD1-CB 3.3Å; N497-T504 WeakPolarHBondContact OD1-CB 3.31Å; N497-T504 VanDerWaalsContact OD1-CG2 3.23Å; N497-T504 WeakPolarHBondContact OD1-CG2 3.31Å; N497-T504 PolarHBondContact OD1-OG1 3.43Å; N497-I580 WeakPolarHBondContact O-CA 3.41Å; N497-N581 HydrophobicContact CB-CB 4.25Å; N497-N581 PolarHBondContact N-O 2.86Å; N497-N581 PolarHBondContact O-N 3.18Å; N497-I583 WeakPolarHBondContact ND2-CD1 3.49Å
498	D	90.6	Very high	83.9	Confident	9 Å²	9	69.9 Å²	69.9	5%	0.048	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	113.6	176	-176.5	-35.5	0	0	0	110.2	I500 K501 N502 T503 I580	D498-I500 PolarHBondContact OD1-N 2.92Å; D498-K501 HydrophobicContact CB-CB 4.27Å; D498-K501 PolarHBondContact OD1-N 2.71Å; D498-K501 WeakPolarHBondContact OD2-CD 3.37Å; D498-K501 WeakPolarHBondContact OD2-CE 3.41Å; D498-K501 WeakPolarHBondContact OD2-CG 3.33Å; D498-K501 IonicContact OD2-NZ 2.66Å; D498-K501 PolarHBondContact OD2-NZ 2.87Å; D498-N502 CarbonylContact O-C 3.43Å; D498-N502 WeakPolarHBondContact O-CA 3.14Å; D498-N502 PolarHBondContact O-N 2.96Å; D498-T503 PolarHBondContact N-O 2.91Å; D498-T503 PolarHBondContact O-N 3.04Å; D498-I580 HydrophobicContact CB-CG1 4.33Å
499	R	91	Very high	85.1	Confident	69 Å²	69	65.4 Å²	65.4	26%	0.26	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-35.6	-179.4	179.7	60	179.3	151.4	1	113.4	R335 T337 Y338 N502 F579	R335-R499 PolarHBondContact O-NH2 3.43Å; T337-R499 WeakPolarHBondContact O-CG 3.3Å; Y338-R499 WeakPolarHBondContact O-CG 3.28Å; R499-N502 PolarHBondContact O-N 3.24Å; R499-F579 HydrophobicContact CB-CB 4.41Å; R499-F579 WeakPolarHBondContact CB-O 3.45Å; R499-F579 PolarHBondContact N-O 3.49Å
500	I	87.9	Confident	86.1	Confident	94 Å²	94	60.3 Å²	60.3	48%	0.482	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-40.7	-174.8	-65.9	175.4	0	0	0	110.5	D498 N502 F579	D498-I500 PolarHBondContact OD1-N 2.92Å; I500-N502 VanDerWaalsContact C-N 3.3Å; I500-F579 HydrophobicContact CB-CD2 4.3Å; I500-F579 HydrophobicContact CD1-CB 3.85Å; I500-F579 HydrophobicContact CD1-CD1 4.19Å; I500-F579 HydrophobicContact CD1-CD2 3.58Å; I500-F579 HydrophobicContact CD1-CE2 4.19Å; I500-F579 HydrophobicContact CD1-CG 3.59Å; I500-F579 HydrophobicContact CG1-CB 3.96Å; I500-F579 HydrophobicContact CG1-CD2 3.87Å; I500-F579 HydrophobicContact CG1-CG 4.08Å
501	K	87.4	Confident	86.7	Confident	147 Å²	147	58.6 Å²	58.6	64%	0.639	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-18.4	171	-60.1	-173.2	-166.9	92.9	0	112.4	D498 T503	D498-K501 HydrophobicContact CB-CB 4.27Å; D498-K501 PolarHBondContact OD1-N 2.71Å; D498-K501 WeakPolarHBondContact OD2-CD 3.37Å; D498-K501 WeakPolarHBondContact OD2-CE 3.41Å; D498-K501 WeakPolarHBondContact OD2-CG 3.33Å; D498-K501 IonicContact OD2-NZ 2.66Å; D498-K501 PolarHBondContact OD2-NZ 2.87Å; K501-T503 VanDerWaalsContact C-N 3.34Å; K501-T503 HydrophobicContact CB-CG2 4.13Å; K501-T503 WeakPolarHBondContact CB-OG1 3.35Å
502	N	86.8	Confident	86.8	Confident	124 Å²	124	63.7 Å²	63.7	66%	0.663	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	49.6	-170.9	-166.5	88.8	0	0	0	111.5	D498 R499 I500	D498-N502 CarbonylContact O-C 3.43Å; D498-N502 WeakPolarHBondContact O-CA 3.14Å; D498-N502 PolarHBondContact O-N 2.96Å; R499-N502 PolarHBondContact O-N 3.24Å; I500-N502 VanDerWaalsContact C-N 3.3Å
503	T	89.9	Confident	86.6	Confident	63 Å²	63	63.5 Å²	63.5	39%	0.387	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	131.2	-176.5	51.9	0	0	0	0	112	D498 K501	D498-T503 PolarHBondContact N-O 2.91Å; D498-T503 PolarHBondContact O-N 3.04Å; K501-T503 VanDerWaalsContact C-N 3.34Å; K501-T503 HydrophobicContact CB-CG2 4.13Å; K501-T503 WeakPolarHBondContact CB-OG1 3.35Å
504	T	90.6	Very high	86.3	Confident	95 Å²	95	67.6 Å²	67.6	58%	0.583	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	125.8	165.3	-62.6	0	0	0	0	109.2	T495 I496 N497	T495-T504 HydrophobicContact CG2-CG2 3.58Å; I496-T504 CarbonylContact O-C 3.58Å; I496-T504 WeakPolarHBondContact O-CA 3.23Å; N497-T504 VanDerWaalsContact OD1-CB 3.3Å; N497-T504 WeakPolarHBondContact OD1-CB 3.31Å; N497-T504 VanDerWaalsContact OD1-CG2 3.23Å; N497-T504 WeakPolarHBondContact OD1-CG2 3.31Å; N497-T504 PolarHBondContact OD1-OG1 3.43Å
505	T	89.2	Confident	85.9	Confident	63 Å²	63	68.2 Å²	68.2	39%	0.387	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	119.5	176.5	-55.6	0	0	0	0	109.4	T495 I496 H507	T495-T505 CarbonylContact C-O 3.55Å; T495-T505 WeakPolarHBondContact CA-O 3.49Å; I496-T505 PolarHBondContact N-O 3.25Å; I496-T505 PolarHBondContact O-N 3.39Å; T505-H507 WeakPolarHBondContact CG2-NE2 3.49Å; T505-H507 PolarHBondContact O-CD2 3.02Å
506	E	89.5	Confident	85.4	Confident	110 Å²	110	69 Å²	69	51%	0.514	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	119.2	179.1	-54.5	178.2	99.6	0	0	110.4	N492 K508	N492-E506 WeakPolarHBondContact OD1-CB 3.37Å; E506-K508 HydrophobicContact CB-CD 4.4Å; E506-K508 HydrophobicContact CB-CG 4.33Å; E506-K508 VanDerWaalsContact CD-CE 3.42Å; E506-K508 PolarHBondContact O-N 2.93Å; E506-K508 VanDerWaalsContact OE1-CE 3.29Å; E506-K508 WeakPolarHBondContact OE1-CE 3.43Å; E506-K508 IonicContact OE1-NZ 2.67Å; E506-K508 PolarHBondContact OE1-NZ 3.19Å; E506-K508 WeakPolarHBondContact OE2-CE 3.4Å; E506-K508 IonicContact OE2-NZ 2.67Å; E506-K508 PolarHBondContact OE2-NZ 2.86Å
507	H	88.3	Confident	85.1	Confident	10 Å²	10	70.6 Å²	70.6	5%	0.046	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	88.9	-175.1	-67.6	-111	0	0	0	110.3	N475 T478 N492 F493 F494 T505	N475-H507 PolarHBondContact OD1-CE1 2.98Å; T478-H507 PolarHBondContact OG1-ND1 3.21Å; N492-H507 PolarHBondContact OD1-N 2.87Å; F493-H507 PolarHBondContact N-O 3.14Å; F494-H507 HydrophobicContact CD1-CB 3.89Å; F494-H507 HydrophobicContact CD2-CB 3.95Å; F494-H507 AromaticContact CD2-CD2 3.76Å; F494-H507 AromaticContact CD2-CG 3.81Å; F494-H507 HydrophobicContact CE1-CB 3.64Å; F494-H507 HydrophobicContact CE2-CB 3.7Å; F494-H507 AromaticContact CE2-CD2 3.41Å; F494-H507 VanDerWaalsContact CE2-CD2 3.41Å; F494-H507 WeakPolarHBondContact CE2-CD2 3.47Å; F494-H507 AromaticContact CE2-CE1 3.75Å; F494-H507 AromaticContact CE2-CG 3.24Å; F494-H507 AromaticContact CE2-ND1 3.47Å; F494-H507 WeakPolarHBondContact CE2-ND1 3.35Å; F494-H507 AromaticContact CE2-NE2 3.76Å; F494-H507 HydrophobicContact CG-CB 4.04Å; F494-H507 HydrophobicContact CZ-CB 3.54Å; F494-H507 AromaticContact CZ-CG 3.37Å; F494-H507 AromaticContact CZ-ND1 3.36Å; F494-H507 WeakPolarHBondContact CZ-ND1 3.43Å; F494-H507 WeakPolarHBondContact O-CB 3.37Å; F494-H507 PolarHBondContact O-N 3.44Å; T505-H507 WeakPolarHBondContact CG2-NE2 3.49Å; T505-H507 PolarHBondContact O-CD2 3.02Å
508	K	86.3	Confident	84.8	Confident	67 Å²	67	68.6 Å²	68.6	29%	0.291	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	144.1	-171.5	-64.2	-176.8	175.8	171.9	0	113.4	T478 Q491 N492 E506	T478-K508 WeakPolarHBondContact CG2-O 3.33Å; Q491-K508 WeakPolarHBondContact O-CA 3.39Å; N492-K508 HydrophobicContact CB-CG 4.14Å; N492-K508 WeakPolarHBondContact OD1-CE 3.33Å; N492-K508 WeakPolarHBondContact OD1-CG 3.12Å; E506-K508 HydrophobicContact CB-CD 4.4Å; E506-K508 HydrophobicContact CB-CG 4.33Å; E506-K508 VanDerWaalsContact CD-CE 3.42Å; E506-K508 PolarHBondContact O-N 2.93Å; E506-K508 VanDerWaalsContact OE1-CE 3.29Å; E506-K508 WeakPolarHBondContact OE1-CE 3.43Å; E506-K508 IonicContact OE1-NZ 2.67Å; E506-K508 PolarHBondContact OE1-NZ 3.19Å; E506-K508 WeakPolarHBondContact OE2-CE 3.4Å; E506-K508 IonicContact OE2-NZ 2.67Å; E506-K508 PolarHBondContact OE2-NZ 2.86Å
509	S	84.1	Confident	83.8	Confident	6 Å²	6	70 Å²	70	4%	0.042	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-49	140	176.4	62.8	0	0	0	0	112.8	Q491 S511	Q491-S509 PolarHBondContact N-OG 2.94Å; Q491-S509 PolarHBondContact O-N 3.45Å; Q491-S509 PolarHBondContact O-OG 2.95Å; S509-S511 PolarHBondContact O-N 3.26Å
510	L	79.2	Confident	82.4	Confident	56 Å²	56	68.9 Å²	68.9	29%	0.293	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-57.2	134.3	174.8	-67.5	175.1	0	0	0	111	L479 S482 K512	L479-L510 HydrophobicContact CD1-CD1 3.86Å; S482-L510 WeakPolarHBondContact OG-CG 3.43Å; S482-L510 PolarHBondContact OG-N 3.5Å; L510-K512 PolarHBondContact O-N 3.42Å
511	S	70.8	Confident	81.4	Confident	126 Å²	126	74.3 Å²	74.3	88%	0.881	39%	0.392	S	S	*	.	S	Bend	trans	-69.9	-18.1	-176.3	54.1	0	0	0	0	114.2	S509	S509-S511 PolarHBondContact O-N 3.26Å
512	K	74.3	Confident	81	Confident	179 Å²	179	69.8 Å²	69.8	78%	0.778	37%	0.374	S	S	*	.	S	Bend	trans	-164.2	132.2	168.8	-177.4	178.1	178.7	-176.7	0	108.3	L510	L510-K512 PolarHBondContact O-N 3.42Å
513	T	81.3	Confident	81	Confident	31 Å²	31	64.4 Å²	64.4	19%	0.19	35%	0.347	C	S	.	.			trans	-83	152.7	172.4	55	0	0	0	0	112.3	E445 Y483 G515 V517	E445-T513 VanDerWaalsContact OE1-CA 3.24Å; E445-T513 WeakPolarHBondContact OE1-CA 3.47Å; Y483-T513 HydrophobicContact CD2-CG2 4.07Å; Y483-T513 HydrophobicContact CE1-CG2 4.19Å; Y483-T513 HydrophobicContact CE2-CG2 3.69Å; Y483-T513 HydrophobicContact CG-CG2 4.47Å; T513-G515 PolarHBondContact OG1-O 3.13Å; T513-V517 HydrophobicContact CG2-CG2 3.95Å; T513-V517 VanDerWaalsContact OG1-CG2 3.28Å; T513-V517 WeakPolarHBondContact OG1-CG2 3.17Å
514	T	82.8	Confident	81.1	Confident	86 Å²	86	61.5 Å²	61.5	53%	0.528	33%	0.329	S	S	.	.	S	Bend	trans	-83.3	-21.8	173.9	-65	0	0	0	0	112.8	E445 K446 Y483	E445-T514 PolarHBondContact OE1-N 3.41Å; E445-T514 VanDerWaalsContact OE2-CB 3.24Å; E445-T514 WeakPolarHBondContact OE2-CB 3.44Å; E445-T514 PolarHBondContact OE2-OG1 2.95Å; K446-T514 HydrophobicContact CB-CG2 4.19Å; K446-T514 HydrophobicContact CG-CG2 4.44Å; Y483-T514 PolarHBondContact OH-N 3.12Å
515	G	80.8	Confident	81.4	Confident	14 Å²	14	57.2 Å²	57.2	14%	0.144	30%	0.303	C	S	.	.	S	Bend	trans	-119.8	178.3	176.5	0	0	0	0	0	114.5	Y483 T513	Y483-G515 PolarHBondContact OH-N 3.42Å; T513-G515 PolarHBondContact OG1-O 3.13Å
516	P	82.4	Confident	81.7	Confident	38 Å²	38	54.2 Å²	54.2	25%	0.247	28%	0.284	C	S	.	.			trans	-65	135.6	176.1	28.3	-34.7	0	0	0	111.5	W453 E454 K457 Y483	W453-P516 HydrophobicContact CB-CG 4.27Å; E454-P516 WeakPolarHBondContact OE2-CD 3.31Å; K457-P516 HydrophobicContact CB-CB 3.87Å; K457-P516 HydrophobicContact CB-CG 3.74Å; K457-P516 HydrophobicContact CD-CB 4.43Å; K457-P516 HydrophobicContact CD-CG 4.07Å; K457-P516 HydrophobicContact CG-CG 4.49Å; Y483-P516 VanDerWaalsContact CD1-O 3.29Å; Y483-P516 WeakPolarHBondContact CD1-O 3.49Å
517	V	84.6	Confident	82.1	Confident	51 Å²	51	49 Å²	49	31%	0.309	26%	0.26	S	S	.	.			trans	-87.6	124.2	178.8	-176.9	0	0	0	0	109.4	Y483 T513 N519	Y483-V517 WeakPolarHBondContact O-CG1 3.41Å; T513-V517 HydrophobicContact CG2-CG2 3.95Å; T513-V517 VanDerWaalsContact OG1-CG2 3.28Å; T513-V517 WeakPolarHBondContact OG1-CG2 3.17Å; V517-N519 VanDerWaalsContact C-N 3.34Å; V517-N519 HydrophobicContact CG1-CB 4.04Å; V517-N519 PolarHBondContact O-N 3.19Å; V517-N519 PolarHBondContact O-ND2 3.47Å; V517-N519 VanDerWaalsContact O-ND2 3.07Å
518	Y	83.1	Confident	82.4	Confident	3 Å²	3	48.5 Å²	48.5	1%	0.012	26%	0.258	C	S	.	.			trans	-67.7	-34.8	-178	-165.8	-110.7	0	0	0	112.7	L456 T459 N461 L462 Y483 H522 V524	L456-Y518 WeakPolarHBondContact O-CE2 3.27Å; T459-Y518 WeakPolarHBondContact O-CE2 3.42Å; T459-Y518 PolarHBondContact O-OH 3.38Å; T459-Y518 WeakPolarHBondContact OG1-CE2 3.45Å; T459-Y518 PolarHBondContact OG1-OH 2.79Å; N461-Y518 WeakPolarHBondContact CA-OH 3.46Å; N461-Y518 PolarHBondContact N-OH 2.81Å; N461-Y518 VanDerWaalsContact N-OH 3.16Å; N461-Y518 PolarHBondContact O-OH 2.99Å; L462-Y518 HydrophobicContact CB-CD1 4.07Å; L462-Y518 HydrophobicContact CB-CE1 3.38Å; L462-Y518 HydrophobicContact CD2-CD1 3.9Å; L462-Y518 HydrophobicContact CD2-CE1 4.1Å; L462-Y518 HydrophobicContact CD2-CG 4.34Å; L462-Y518 HydrophobicContact CG-CE1 4.4Å; L462-Y518 PolarHBondContact N-OH 2.61Å; Y483-Y518 WeakPolarHBondContact O-CA 3.45Å; Y483-Y518 WeakPolarHBondContact O-CB 3.4Å; Y483-Y518 PolarHBondContact O-N 2.65Å; Y518-H522 HydrophobicContact CD1-CB 4.26Å; Y518-H522 HydrophobicContact CE1-CB 3.46Å; Y518-H522 VanDerWaalsContact CE1-CB 3.46Å; Y518-H522 HydrophobicContact CE2-CB 4.34Å; Y518-H522 VanDerWaalsContact CZ-CB 3.48Å; Y518-H522 AromaticContact CZ-CG 3.81Å; Y518-H522 PolarHBondContact O-ND1 3.17Å; Y518-H522 WeakPolarHBondContact OH-CB 3.43Å; Y518-V524 HydrophobicContact CD1-CG2 4Å; Y518-V524 HydrophobicContact CE1-CG2 3.99Å
519	N	68.9	Low	82.8	Confident	37 Å²	37	45.5 Å²	45.5	20%	0.198	25%	0.245	C	C	.	.			trans	59.5	161.3	167.2	77.7	81.1	0	0	0	117.7	Y483 L484 V517 R521 H522	Y483-N519 PolarHBondContact O-N 3.06Å; L484-N519 CarbonylContact O-C 3.33Å; L484-N519 WeakPolarHBondContact O-CA 3.46Å; V517-N519 VanDerWaalsContact C-N 3.34Å; V517-N519 HydrophobicContact CG1-CB 4.04Å; V517-N519 PolarHBondContact O-N 3.19Å; V517-N519 PolarHBondContact O-ND2 3.47Å; V517-N519 VanDerWaalsContact O-ND2 3.07Å; N519-R521 PolarHBondContact O-N 2.61Å; N519-R521 VanDerWaalsContact OD1-CB 3.28Å; N519-R521 WeakPolarHBondContact OD1-CB 3.38Å; N519-R521 VanDerWaalsContact OD1-CG 3.27Å; N519-R521 WeakPolarHBondContact OD1-CG 3.26Å; N519-R521 PolarHBondContact OD1-N 2.73Å; N519-H522 PolarHBondContact O-N 2.85Å
520	S	63.3	Low	83.1	Confident	46 Å²	46	51.8 Å²	51.8	32%	0.322	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	11.4	-172.5	62.5	0	0	0	0	115.7	D486 R658	D486-S520 WeakPolarHBondContact CB-OG 3.4Å; S520-R658 PolarHBondContact O-NH2 3.1Å
521	R	65.3	Low	83.6	Confident	209 Å²	209	55.1 Å²	55.1	79%	0.789	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-21.1	173.7	-62.6	179.5	-179	-152.1	-1.9	113.5	N519	N519-R521 PolarHBondContact O-N 2.61Å; N519-R521 VanDerWaalsContact OD1-CB 3.28Å; N519-R521 WeakPolarHBondContact OD1-CB 3.38Å; N519-R521 VanDerWaalsContact OD1-CG 3.27Å; N519-R521 WeakPolarHBondContact OD1-CG 3.26Å; N519-R521 PolarHBondContact OD1-N 2.73Å
522	H	78.9	Confident	84.5	Confident	52 Å²	52	49.1 Å²	49.1	24%	0.241	24%	0.24	C	C	.	.	S	Bend	trans	-97.3	160.5	177.5	-55.6	109.7	0	0	0	111	Y518 N519 R658	Y518-H522 HydrophobicContact CD1-CB 4.26Å; Y518-H522 HydrophobicContact CE1-CB 3.46Å; Y518-H522 VanDerWaalsContact CE1-CB 3.46Å; Y518-H522 HydrophobicContact CE2-CB 4.34Å; Y518-H522 VanDerWaalsContact CZ-CB 3.48Å; Y518-H522 AromaticContact CZ-CG 3.81Å; Y518-H522 PolarHBondContact O-ND1 3.17Å; Y518-H522 WeakPolarHBondContact OH-CB 3.43Å; N519-H522 PolarHBondContact O-N 2.85Å; H522-R658 PolarHBondContact O-NH1 2.62Å; H522-R658 PolarHBondContact O-NH2 2.92Å
523	G	87.7	Confident	85.1	Confident	11 Å²	11	41.3 Å²	41.3	11%	0.113	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	132	172.3	0	0	0	0	0	110.6	N461 L462	N461-G523 CarbonylContact C-O 3.48Å; N461-G523 VanDerWaalsContact CA-O 3.29Å; N461-G523 WeakPolarHBondContact CA-O 3.4Å; N461-G523 WeakPolarHBondContact OD1-CA 3.23Å; L462-G523 PolarHBondContact N-O 3.34Å
524	V	92.9	Very high	85.2	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125.9	174.4	180	0	0	0	0	107.5	L462 I464 L484 Y518 G549 T550	L462-V524 CarbonylContact O-C 3.49Å; L462-V524 WeakPolarHBondContact O-CA 3.46Å; I464-V524 HydrophobicContact CD1-CG1 3.88Å; I464-V524 HydrophobicContact CG1-CG1 4.42Å; L484-V524 HydrophobicContact CD2-CG1 4.38Å; L484-V524 HydrophobicContact CD2-CG2 4.41Å; Y518-V524 HydrophobicContact CD1-CG2 4Å; Y518-V524 HydrophobicContact CE1-CG2 3.99Å; V524-G549 CarbonylContact O-C 3.5Å; V524-G549 WeakPolarHBondContact O-CA 3.28Å; V524-T550 PolarHBondContact O-N 2.93Å
525	Y	95.1	Very high	85.4	Confident	6 Å²	6	36.5 Å²	36.5	2%	0.024	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.6	-175.2	-54.7	-89.9	0	0	0	109.3	N461 L462 I463 I464 T550 V610 V613 M614 H617	N461-Y525 HydrophobicContact CB-CE2 4.1Å; N461-Y525 WeakPolarHBondContact OD1-CE2 3.32Å; L462-Y525 PolarHBondContact O-N 3.29Å; I463-Y525 CarbonylContact C-O 3.5Å; I463-Y525 WeakPolarHBondContact CA-O 3.36Å; I464-Y525 PolarHBondContact N-O 2.91Å; Y525-T550 CarbonylContact C-O 3.33Å; Y525-T550 VanDerWaalsContact CA-O 3.28Å; Y525-T550 WeakPolarHBondContact CA-O 3.3Å; Y525-V610 HydrophobicContact CD1-CG1 4.18Å; Y525-V610 HydrophobicContact CD2-CG1 4.26Å; Y525-V610 HydrophobicContact CG-CG1 3.78Å; Y525-V610 HydrophobicContact CG-CG2 4.49Å; Y525-V613 HydrophobicContact CE1-CG1 4.02Å; Y525-M614 HydrophobicContact CD1-CG 4.4Å; Y525-M614 HydrophobicContact CD2-CG 3.91Å; Y525-M614 HydrophobicContact CD2-SD 4.09Å; Y525-M614 HydrophobicContact CE1-CG 3.9Å; Y525-M614 HydrophobicContact CE2-CG 3.35Å; Y525-M614 HydrophobicContact CE2-SD 3.99Å; Y525-M614 HydrophobicContact CG-CG 4.42Å; Y525-H617 AromaticContact CE1-CE1 3.76Å; Y525-H617 AromaticContact CE1-ND1 3.56Å; Y525-H617 AromaticContact CZ-ND1 3.7Å; Y525-H617 PolarHBondContact OH-ND1 2.95Å
526	V	96.4	Very high	85.8	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.1	-174.2	177.1	0	0	0	0	109.3	I464 L466 A540 I543 T550 V551 V552	I464-V526 HydrophobicContact CB-CG2 4.3Å; I464-V526 CarbonylContact O-C 3.42Å; I464-V526 VanDerWaalsContact O-CA 3.31Å; I464-V526 WeakPolarHBondContact O-CA 3.36Å; L466-V526 HydrophobicContact CD1-CG1 3.52Å; L466-V526 HydrophobicContact CG-CG1 3.93Å; V526-A540 HydrophobicContact CG1-CB 4.32Å; V526-I543 HydrophobicContact CG2-CB 4.23Å; V526-I543 HydrophobicContact CG2-CD1 4.4Å; V526-I543 HydrophobicContact CG2-CG1 4.02Å; V526-I543 HydrophobicContact CG2-CG2 3.82Å; V526-T550 PolarHBondContact N-O 2.75Å; V526-V551 HydrophobicContact CB-CG2 4.14Å; V526-V551 CarbonylContact O-C 3.48Å; V526-V551 WeakPolarHBondContact O-CA 3.31Å; V526-V552 PolarHBondContact O-N 3.04Å
527	L	97.3	Very high	86.1	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	123.3	176.2	-51.1	-179.2	0	0	0	110.2	I463 I464 D465 L466 R467 V552 A606 L607 V610	I463-L527 HydrophobicContact CG2-CD1 3.89Å; I463-L527 HydrophobicContact CG2-CD2 4.33Å; I463-L527 HydrophobicContact CG2-CG 3.87Å; I464-L527 PolarHBondContact O-N 3.43Å; D465-L527 HydrophobicContact CB-CD1 4.28Å; L466-L527 CarbonylContact C-O 3.6Å; L466-L527 WeakPolarHBondContact CA-O 3.4Å; L466-L527 WeakPolarHBondContact CB-O 3.41Å; L466-L527 PolarHBondContact N-O 3.02Å; R467-L527 HydrophobicContact CG-CB 3.8Å; R467-L527 PolarHBondContact N-O 3.44Å; L527-V552 WeakPolarHBondContact CA-O 3.46Å; L527-A606 HydrophobicContact CD2-CB 4.04Å; L527-A606 WeakPolarHBondContact CD2-O 3.32Å; L527-L607 HydrophobicContact CD1-CB 4.22Å; L527-L607 HydrophobicContact CD1-CD1 4.25Å; L527-V610 HydrophobicContact CD2-CB 4.43Å; L527-V610 HydrophobicContact CD2-CG2 3.53Å
528	A	96	Very high	86.4	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	154.1	-177.5	0	0	0	0	0	112.4	V551 V552 G553 E554 T556 P597	A528-V551 HydrophobicContact CB-CG1 3.87Å; A528-V552 PolarHBondContact N-O 2.6Å; A528-G553 WeakPolarHBondContact O-CA 3.41Å; A528-E554 PolarHBondContact O-N 3.2Å; A528-T556 HydrophobicContact CB-CG2 3.86Å; A528-P597 HydrophobicContact CB-CG 4.35Å
529	S	94.6	Very high	86.8	Confident	3 Å²	3	31.7 Å²	31.7	2%	0.021	15%	0.148	C	C	.	.			trans	-142.1	170.4	173.1	74	0	0	0	0	110.7	R467 H531 T532 E554 T556	R467-S529 WeakPolarHBondContact CA-OG 3.29Å; R467-S529 PolarHBondContact O-OG 2.95Å; S529-H531 PolarHBondContact O-N 3.1Å; S529-H531 VanDerWaalsContact O-N 3.08Å; S529-H531 PolarHBondContact OG-N 2.88Å; S529-T532 PolarHBondContact N-OG1 3.41Å; S529-T532 VanDerWaalsContact O-CB 3.29Å; S529-T532 WeakPolarHBondContact O-CB 3.31Å; S529-T532 PolarHBondContact O-N 2.88Å; S529-T532 PolarHBondContact O-OG1 3.22Å; S529-T532 PolarHBondContact OG-N 2.91Å; S529-E554 WeakPolarHBondContact CA-OE2 3.42Å; S529-T556 WeakPolarHBondContact O-CA 3.24Å
530	Y	90.2	Very high	88	Confident	139 Å²	139	30 Å²	30	55%	0.545	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-19.1	168	177.9	-108.3	0	0	0	113.5	E554 I555 S557	Y530-E554 PolarHBondContact N-OE2 3.01Å; Y530-I555 WeakPolarHBondContact CA-O 3.33Å; Y530-S557 VanDerWaalsContact O-CB 3.22Å; Y530-S557 WeakPolarHBondContact O-CB 3.37Å
531	H	88.4	Confident	89.4	Confident	126 Å²	126	29.6 Å²	29.6	58%	0.583	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-7.1	174.4	-61.3	-34.7	0	0	0	114.2	T470 S529 A533	T470-H531 WeakPolarHBondContact CG2-O 3.16Å; S529-H531 PolarHBondContact O-N 3.1Å; S529-H531 VanDerWaalsContact O-N 3.08Å; S529-H531 PolarHBondContact OG-N 2.88Å; H531-A533 PolarHBondContact O-N 3.17Å
532	T	90.8	Very high	90.6	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.093	C	C	.	.			trans	-66.6	116.5	168.3	-56.2	0	0	0	0	108.2	L466 N469 S529 G536 E537 T556 S557	L466-T532 HydrophobicContact CB-CG2 4.12Å; L466-T532 PolarHBondContact O-OG1 2.86Å; N469-T532 CarbonylContact O-C 3.55Å; N469-T532 WeakPolarHBondContact O-CA 3.22Å; S529-T532 PolarHBondContact N-OG1 3.41Å; S529-T532 VanDerWaalsContact O-CB 3.29Å; S529-T532 WeakPolarHBondContact O-CB 3.31Å; S529-T532 PolarHBondContact O-N 2.88Å; S529-T532 PolarHBondContact O-OG1 3.22Å; S529-T532 PolarHBondContact OG-N 2.91Å; T532-G536 VanDerWaalsContact CG2-C 3.49Å; T532-E537 HydrophobicContact CG2-CG 4.24Å; T532-E537 WeakPolarHBondContact O-CG 3.37Å; T532-T556 HydrophobicContact CG2-CG2 3.98Å; T532-T556 WeakPolarHBondContact O-CB 3.44Å; T532-S557 WeakPolarHBondContact O-CB 3.37Å; T532-S557 PolarHBondContact O-N 2.89Å; T532-S557 PolarHBondContact O-OG 3.1Å
533	A	86.3	Confident	91.1	Very high	14 Å²	14	17.2 Å²	17.2	12%	0.116	8%	0.081	C	C	.	.			trans	-134.7	157.9	-172.5	0	0	0	0	0	112.8	N469 H531 T535 G536 E537 S557	N469-A533 PolarHBondContact O-N 2.91Å; H531-A533 PolarHBondContact O-N 3.17Å; A533-T535 PolarHBondContact O-N 2.77Å; A533-G536 PolarHBondContact O-N 3.28Å; A533-E537 WeakPolarHBondContact CA-OE1 3.49Å; A533-S557 WeakPolarHBondContact CB-OG 3.16Å
534	S	83.9	Confident	91.2	Very high	16 Å²	16	18.7 Å²	18.7	11%	0.112	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	-125.8	172.7	-179.4	0	0	0	0	111.8	G536 E537 E538 N559	S534-G536 PolarHBondContact O-N 3.3Å; S534-G536 VanDerWaalsContact O-N 3.13Å; S534-E537 WeakPolarHBondContact O-CA 3.31Å; S534-E537 WeakPolarHBondContact O-CB 3.13Å; S534-E537 PolarHBondContact O-N 3.16Å; S534-E538 PolarHBondContact O-N 3.17Å; S534-N559 PolarHBondContact N-O 2.71Å
535	T	85.9	Confident	91.1	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.006	9%	0.09	C	C	.	.	H	α-helix	trans	-60.9	-19.5	179.9	-57.1	0	0	0	0	114.2	L435 S473 S474 L477 A533 E538 L539	L435-T535 HydrophobicContact CB-CG2 4.22Å; L435-T535 HydrophobicContact CD1-CG2 4.14Å; S473-T535 PolarHBondContact N-OG1 3.47Å; S474-T535 PolarHBondContact N-OG1 3.33Å; L477-T535 HydrophobicContact CD1-CG2 4.18Å; L477-T535 HydrophobicContact CD2-CG2 3.5Å; L477-T535 VanDerWaalsContact CD2-CG2 3.5Å; L477-T535 HydrophobicContact CG-CG2 3.69Å; A533-T535 PolarHBondContact O-N 2.77Å; T535-E538 WeakPolarHBondContact CA-OE2 3.25Å; T535-E538 PolarHBondContact OG1-OE2 3.3Å; T535-L539 WeakPolarHBondContact O-CB 3.44Å; T535-L539 PolarHBondContact O-N 2.92Å
536	G	88.9	Confident	90.6	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.01	10%	0.095	C	C	.	.	H	α-helix	trans	-66.9	-39.1	168.5	0	0	0	0	0	112.5	T532 A533 S534 A540	T532-G536 VanDerWaalsContact CG2-C 3.49Å; A533-G536 PolarHBondContact O-N 3.28Å; S534-G536 PolarHBondContact O-N 3.3Å; S534-G536 VanDerWaalsContact O-N 3.13Å; G536-A540 PolarHBondContact O-N 2.86Å; G536-A540 VanDerWaalsContact O-N 3.13Å
537	E	90.4	Very high	90.2	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-72.6	-44.5	175.2	-52.9	-168.9	-119.2	0	0	110.7	T532 A533 S534 L539 A540 Y541 T556 S557 G558 N559 L560 W590 V595	T532-E537 HydrophobicContact CG2-CG 4.24Å; T532-E537 WeakPolarHBondContact O-CG 3.37Å; A533-E537 WeakPolarHBondContact CA-OE1 3.49Å; S534-E537 WeakPolarHBondContact O-CA 3.31Å; S534-E537 WeakPolarHBondContact O-CB 3.13Å; S534-E537 PolarHBondContact O-N 3.16Å; E537-L539 PolarHBondContact O-N 3.13Å; E537-A540 PolarHBondContact O-N 3.2Å; E537-A540 VanDerWaalsContact O-N 3.14Å; E537-Y541 WeakPolarHBondContact O-CB 3.29Å; E537-Y541 PolarHBondContact O-N 3.34Å; E537-T556 VanDerWaalsContact CD-OG1 3.32Å; E537-T556 WeakPolarHBondContact CG-OG1 3.41Å; E537-T556 VanDerWaalsContact OE2-CB 3.31Å; E537-T556 WeakPolarHBondContact OE2-CB 3.1Å; E537-T556 PolarHBondContact OE2-OG1 3.47Å; E537-S557 PolarHBondContact OE1-OG 3.34Å; E537-S557 PolarHBondContact OE2-N 2.88Å; E537-G558 VanDerWaalsContact CD-N 3.35Å; E537-G558 PolarHBondContact OE1-N 3.09Å; E537-G558 VanDerWaalsContact OE1-N 3.08Å; E537-G558 WeakPolarHBondContact OE2-CA 3.47Å; E537-G558 PolarHBondContact OE2-N 2.9Å; E537-N559 PolarHBondContact OE1-N 3.01Å; E537-L560 HydrophobicContact CB-CD2 4.13Å; E537-W590 HydrophobicContact CB-CH2 3.79Å; E537-V595 HydrophobicContact CB-CG2 4.07Å; E537-V595 WeakPolarHBondContact O-CG2 3.36Å
538	E	90.7	Very high	89.6	Confident	3 Å²	3	21.9 Å²	21.9	1%	0.014	11%	0.107	C	C	.	.	H	α-helix	trans	-57	-37.9	175.2	-64.6	173.3	151.1	0	0	111.8	S474 L477 S534 T535 L542 L560 H562 F582 W590	S474-E538 VanDerWaalsContact CB-OE2 3.24Å; S474-E538 WeakPolarHBondContact CB-OE2 3.45Å; S474-E538 VanDerWaalsContact OG-CD 3.22Å; S474-E538 PolarHBondContact OG-OE1 3.23Å; S474-E538 PolarHBondContact OG-OE2 2.79Å; L477-E538 HydrophobicContact CD1-CB 3.57Å; S534-E538 PolarHBondContact O-N 3.17Å; T535-E538 WeakPolarHBondContact CA-OE2 3.25Å; T535-E538 PolarHBondContact OG1-OE2 3.3Å; E538-L542 WeakPolarHBondContact O-CB 3.38Å; E538-L542 WeakPolarHBondContact O-CD1 3.32Å; E538-L542 WeakPolarHBondContact O-CG 3.19Å; E538-L542 PolarHBondContact O-N 3.05Å; E538-L542 VanDerWaalsContact O-N 3.16Å; E538-L560 HydrophobicContact CG-CD2 4.43Å; E538-H562 IonicContact OE1-CD2 3.61Å; E538-H562 IonicContact OE1-CE1 3.54Å; E538-H562 IonicContact OE1-NE2 2.91Å; E538-H562 PolarHBondContact OE1-NE2 3Å; E538-F582 HydrophobicContact CB-CE2 4.39Å; E538-F582 HydrophobicContact CG-CE2 4.17Å; E538-W590 HydrophobicContact CB-CZ3 4.35Å; E538-W590 HydrophobicContact CG-CZ3 3.87Å
539	L	91.5	Very high	89.3	Confident	1 Å²	1	22 Å²	22	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-68.7	-47.8	173.8	-176	57.7	0	0	0	112.1	F432 L466 L477 M480 L481 T535 E537 Y541 L542 I543	F432-L539 HydrophobicContact CE2-CD2 4.32Å; F432-L539 HydrophobicContact CZ-CD2 3.67Å; L466-L539 HydrophobicContact CD1-CB 4.24Å; L466-L539 HydrophobicContact CD1-CD2 4Å; L466-L539 HydrophobicContact CD1-CG 4.23Å; L466-L539 HydrophobicContact CD2-CD2 4.3Å; L477-L539 HydrophobicContact CD2-CB 3.68Å; L477-L539 HydrophobicContact CD2-CD1 4.17Å; L477-L539 HydrophobicContact CD2-CG 4.4Å; M480-L539 HydrophobicContact CG-CD1 4.37Å; M480-L539 HydrophobicContact CG-CD2 4.23Å; L481-L539 HydrophobicContact CD2-CD1 3.84Å; L481-L539 HydrophobicContact CG-CD1 4.23Å; T535-L539 WeakPolarHBondContact O-CB 3.44Å; T535-L539 PolarHBondContact O-N 2.92Å; E537-L539 PolarHBondContact O-N 3.13Å; L539-Y541 VanDerWaalsContact C-N 3.35Å; L539-Y541 PolarHBondContact O-N 3.42Å; L539-L542 PolarHBondContact O-N 2.76Å; L539-I543 HydrophobicContact CD1-CD1 4.31Å; L539-I543 HydrophobicContact CD1-CG1 4.11Å; L539-I543 HydrophobicContact CG-CG1 4.31Å; L539-I543 WeakPolarHBondContact O-CG1 3.35Å; L539-I543 PolarHBondContact O-N 3.34Å
540	A	92.8	Very high	89.3	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60.2	-44.9	-179.4	0	0	0	0	0	111.7	V526 G536 E537 L542 I543 Q544 V551 V595	V526-A540 HydrophobicContact CG1-CB 4.32Å; G536-A540 PolarHBondContact O-N 2.86Å; G536-A540 VanDerWaalsContact O-N 3.13Å; E537-A540 PolarHBondContact O-N 3.2Å; E537-A540 VanDerWaalsContact O-N 3.14Å; A540-L542 PolarHBondContact O-N 2.84Å; A540-I543 PolarHBondContact O-N 3.47Å; A540-Q544 PolarHBondContact O-N 3.08Å; A540-V551 HydrophobicContact CB-CG1 4.37Å; A540-V551 HydrophobicContact CB-CG2 4.2Å; A540-V551 WeakPolarHBondContact O-CG2 3.42Å; A540-V595 HydrophobicContact CB-CB 4.47Å; A540-V595 HydrophobicContact CB-CG1 4.12Å; A540-V595 HydrophobicContact CB-CG2 4.28Å
541	Y	92.9	Very high	89.6	Confident	39 Å²	39	15.2 Å²	15.2	15%	0.153	8%	0.081	C	C	.	.	H	α-helix	trans	-56.8	-50.2	174.4	177.9	-102.7	0	0	0	112.1	E537 L539 I543 Q544 S545 F582 D584 W590	E537-Y541 WeakPolarHBondContact O-CB 3.29Å; E537-Y541 PolarHBondContact O-N 3.34Å; L539-Y541 VanDerWaalsContact C-N 3.35Å; L539-Y541 PolarHBondContact O-N 3.42Å; Y541-I543 VanDerWaalsContact C-N 3.27Å; Y541-I543 PolarHBondContact O-N 3.46Å; Y541-Q544 PolarHBondContact O-N 3.39Å; Y541-S545 PolarHBondContact O-N 3.32Å; Y541-F582 AromaticContact CD1-CE1 3.99Å; Y541-F582 HydrophobicContact CD1-CE1 3.99Å; Y541-F582 HydrophobicContact CE1-CD1 4.47Å; Y541-F582 HydrophobicContact CE1-CE1 4.08Å; Y541-D584 HydrophobicContact CE1-CB 4.09Å; Y541-W590 HydrophobicContact CD1-CB 4.39Å; Y541-W590 AromaticContact CD1-CD2 3.96Å; Y541-W590 HydrophobicContact CD1-CD2 3.96Å; Y541-W590 AromaticContact CD1-CE3 3.97Å; Y541-W590 HydrophobicContact CD1-CE3 3.97Å; Y541-W590 HydrophobicContact CD1-CG 4.16Å; Y541-W590 AromaticContact CD2-CD1 3.82Å; Y541-W590 AromaticContact CD2-CD2 3.94Å; Y541-W590 HydrophobicContact CD2-CD2 3.94Å; Y541-W590 AromaticContact CD2-CE2 3.8Å; Y541-W590 AromaticContact CD2-CG 3.98Å; Y541-W590 HydrophobicContact CD2-CG 3.98Å; Y541-W590 HydrophobicContact CD2-CZ2 4.37Å; Y541-W590 AromaticContact CD2-NE1 3.75Å; Y541-W590 HydrophobicContact CE1-CB 3.83Å; Y541-W590 HydrophobicContact CE1-CD2 4.28Å; Y541-W590 AromaticContact CE1-CG 3.99Å; Y541-W590 HydrophobicContact CE1-CG 3.99Å; Y541-W590 HydrophobicContact CE2-CB 4.23Å; Y541-W590 AromaticContact CE2-CD1 3.57Å; Y541-W590 HydrophobicContact CE2-CD2 4.24Å; Y541-W590 AromaticContact CE2-CG 3.78Å; Y541-W590 HydrophobicContact CE2-CG 3.78Å; Y541-W590 AromaticContact CE2-NE1 3.96Å; Y541-W590 AromaticContact CG-CD2 3.8Å; Y541-W590 HydrophobicContact CG-CD2 3.8Å; Y541-W590 AromaticContact CG-CE2 3.92Å; Y541-W590 HydrophobicContact CG-CE3 4.03Å; Y541-W590 HydrophobicContact CG-CG 4.17Å; Y541-W590 HydrophobicContact CG-CH2 4.46Å; Y541-W590 HydrophobicContact CG-CZ2 4.27Å; Y541-W590 HydrophobicContact CG-CZ3 4.36Å; Y541-W590 AromaticContact CZ-CD1 3.99Å; Y541-W590 AromaticContact CZ-CG 3.8Å
542	L	91.1	Very high	90	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-65.7	-28.8	-179.4	-71.3	173.8	0	0	0	113.1	L477 L481 F494 E538 L539 A540 Q544 S545 L546 F582	L477-L542 HydrophobicContact CD1-CD1 4.18Å; L481-L542 HydrophobicContact CD1-CB 4.31Å; L481-L542 HydrophobicContact CD1-CD1 3.57Å; L481-L542 HydrophobicContact CD2-CB 4.36Å; F494-L542 HydrophobicContact CB-CD2 3.98Å; F494-L542 HydrophobicContact CD1-CD1 3.35Å; F494-L542 HydrophobicContact CD1-CD2 4.06Å; F494-L542 HydrophobicContact CD1-CG 4.37Å; F494-L542 HydrophobicContact CE1-CD1 3.57Å; F494-L542 HydrophobicContact CG-CD1 4.15Å; F494-L542 HydrophobicContact CG-CD2 4.33Å; F494-L542 HydrophobicContact CZ-CD1 4.5Å; E538-L542 WeakPolarHBondContact O-CB 3.38Å; E538-L542 WeakPolarHBondContact O-CD1 3.32Å; E538-L542 WeakPolarHBondContact O-CG 3.19Å; E538-L542 PolarHBondContact O-N 3.05Å; E538-L542 VanDerWaalsContact O-N 3.16Å; L539-L542 PolarHBondContact O-N 2.76Å; A540-L542 PolarHBondContact O-N 2.84Å; L542-Q544 VanDerWaalsContact C-N 3.3Å; L542-Q544 PolarHBondContact O-N 3.37Å; L542-S545 PolarHBondContact O-N 3.22Å; L542-L546 HydrophobicContact CB-CD1 4.15Å; L542-L546 WeakPolarHBondContact O-CB 3.49Å; L542-L546 WeakPolarHBondContact O-CD1 3.31Å; L542-L546 WeakPolarHBondContact O-CG 3.37Å; L542-L546 PolarHBondContact O-N 3.07Å; L542-F582 HydrophobicContact CD1-CZ 3.98Å; L542-F582 HydrophobicContact CD2-CE1 3.95Å; L542-F582 HydrophobicContact CD2-CZ 4Å; L542-F582 HydrophobicContact CG-CE1 4.34Å; L542-F582 HydrophobicContact CG-CZ 4.03Å
543	I	90.3	Very high	90.2	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-65.9	-35.6	176.6	-66.8	-84.4	0	0	0	111	L481 L484 V526 L539 A540 Y541 C548 G549	L481-I543 HydrophobicContact CD2-CD1 4.39Å; L484-I543 HydrophobicContact CD1-CD1 3.75Å; V526-I543 HydrophobicContact CG2-CB 4.23Å; V526-I543 HydrophobicContact CG2-CD1 4.4Å; V526-I543 HydrophobicContact CG2-CG1 4.02Å; V526-I543 HydrophobicContact CG2-CG2 3.82Å; L539-I543 HydrophobicContact CD1-CD1 4.31Å; L539-I543 HydrophobicContact CD1-CG1 4.11Å; L539-I543 HydrophobicContact CG-CG1 4.31Å; L539-I543 WeakPolarHBondContact O-CG1 3.35Å; L539-I543 PolarHBondContact O-N 3.34Å; A540-I543 PolarHBondContact O-N 3.47Å; Y541-I543 VanDerWaalsContact C-N 3.27Å; Y541-I543 PolarHBondContact O-N 3.46Å; I543-C548 PolarHBondContact O-N 3.41Å; I543-C548 VanDerWaalsContact O-N 3.15Å; I543-G549 VanDerWaalsContact CG2-CA 3.46Å; I543-G549 PolarHBondContact O-N 2.9Å
544	Q	89.8	Confident	90.6	Very high	43 Å²	43	11 Å²	11	20%	0.201	6%	0.059	C	C	.	.	H	α-helix	trans	-74	-51.6	171	-67.3	171.2	-61.4	0	0	111.3	A540 Y541 L542 L546 S547 V551 V596 D598	A540-Q544 PolarHBondContact O-N 3.08Å; Y541-Q544 PolarHBondContact O-N 3.39Å; L542-Q544 VanDerWaalsContact C-N 3.3Å; L542-Q544 PolarHBondContact O-N 3.37Å; Q544-L546 VanDerWaalsContact C-N 3.31Å; Q544-L546 PolarHBondContact O-N 3.19Å; Q544-S547 WeakPolarHBondContact O-CA 3.3Å; Q544-S547 PolarHBondContact O-N 3.15Å; Q544-V551 HydrophobicContact CG-CB 4.33Å; Q544-V551 HydrophobicContact CG-CG2 3.67Å; Q544-V596 PolarHBondContact NE2-O 3.12Å; Q544-D598 VanDerWaalsContact NE2-CG 3.34Å; Q544-D598 PolarHBondContact NE2-OD1 3Å
545	S	89.1	Confident	91.1	Very high	15 Å²	15	14.1 Å²	14.1	11%	0.105	7%	0.073	C	C	.	.	H	α-helix	trans	-64.3	-32.2	-173.6	86.2	0	0	0	0	113.9	Y541 L542 S547 D584 N585 N586	Y541-S545 PolarHBondContact O-N 3.32Å; L542-S545 PolarHBondContact O-N 3.22Å; S545-S547 VanDerWaalsContact C-N 3.3Å; S545-D584 WeakPolarHBondContact CB-OD2 3.29Å; S545-N585 PolarHBondContact O-ND2 2.92Å; S545-N585 PolarHBondContact O-OD1 3.3Å; S545-N585 PolarHBondContact OG-OD1 3.2Å; S545-N585 VanDerWaalsContact OG-OD1 3.14Å; S545-N586 PolarHBondContact O-ND2 3.48Å
546	L	86.3	Confident	91.4	Very high	22 Å²	22	14.3 Å²	14.3	12%	0.115	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-0.6	174.1	-66.7	161.9	0	0	0	112.9	L481 F493 L542 Q544 C548 N585	L481-L546 HydrophobicContact CD1-CD1 4.32Å; L481-L546 HydrophobicContact CD2-CD1 3.98Å; F493-L546 HydrophobicContact CB-CD1 4.23Å; F493-L546 HydrophobicContact CD1-CD1 3.73Å; F493-L546 HydrophobicContact CD1-CD2 3.91Å; F493-L546 HydrophobicContact CE1-CD1 4.48Å; F493-L546 HydrophobicContact CG-CD1 4.27Å; L542-L546 HydrophobicContact CB-CD1 4.15Å; L542-L546 WeakPolarHBondContact O-CB 3.49Å; L542-L546 WeakPolarHBondContact O-CD1 3.31Å; L542-L546 WeakPolarHBondContact O-CG 3.37Å; L542-L546 PolarHBondContact O-N 3.07Å; Q544-L546 VanDerWaalsContact C-N 3.31Å; Q544-L546 PolarHBondContact O-N 3.19Å; L546-C548 HydrophobicContact CB-CB 4.49Å; L546-C548 PolarHBondContact O-N 3.4Å; L546-C548 VanDerWaalsContact O-N 3.16Å; L546-N585 HydrophobicContact CD2-CB 3.72Å; L546-N585 VanDerWaalsContact CD2-OD1 3.23Å; L546-N585 WeakPolarHBondContact CD2-OD1 3.3Å; L546-N585 WeakPolarHBondContact CG-OD1 3.25Å
547	S	86.3	Confident	91.2	Very high	32 Å²	32	15 Å²	15	22%	0.224	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	39.9	-176.6	-66.7	0	0	0	0	113.3	Q544 S545 L656 R658	Q544-S547 WeakPolarHBondContact O-CA 3.3Å; Q544-S547 PolarHBondContact O-N 3.15Å; S545-S547 VanDerWaalsContact C-N 3.3Å; S547-L656 WeakPolarHBondContact OG-CD2 3.2Å; S547-R658 WeakPolarHBondContact O-CD 3.41Å
548	C	84.8	Confident	90.8	Very high	4 Å²	4	16 Å²	16	3%	0.027	9%	0.09	C	C	.	.	S	Bend	trans	-105.2	-12.4	-176.7	67.9	0	0	0	0	113.4	I543 L546 R658	I543-C548 PolarHBondContact O-N 3.41Å; I543-C548 VanDerWaalsContact O-N 3.15Å; L546-C548 HydrophobicContact CB-CB 4.49Å; L546-C548 PolarHBondContact O-N 3.4Å; L546-C548 VanDerWaalsContact O-N 3.16Å; C548-R658 PolarHBondContact O-NH1 2.58Å
549	G	90.4	Very high	90.1	Very high	2 Å²	2	19.7 Å²	19.7	2%	0.021	11%	0.11	C	C	.	.			trans	-158	-167.1	173.7	0	0	0	0	0	113.4	V524 I543	V524-G549 CarbonylContact O-C 3.5Å; V524-G549 WeakPolarHBondContact O-CA 3.28Å; I543-G549 VanDerWaalsContact CG2-CA 3.46Å; I543-G549 PolarHBondContact O-N 2.9Å
550	T	94.6	Very high	89.3	Confident	1 Å²	1	20.8 Å²	20.8	1%	0.006	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	130.4	-178	-44.5	0	0	0	0	109.3	V524 Y525 V526 V552 D598 V613 H617 R658 V661	V524-T550 PolarHBondContact O-N 2.93Å; Y525-T550 CarbonylContact C-O 3.33Å; Y525-T550 VanDerWaalsContact CA-O 3.28Å; Y525-T550 WeakPolarHBondContact CA-O 3.3Å; V526-T550 PolarHBondContact N-O 2.75Å; T550-V552 HydrophobicContact CG2-CG2 4.37Å; T550-D598 VanDerWaalsContact CA-OD2 3.29Å; T550-D598 WeakPolarHBondContact CA-OD2 3.5Å; T550-D598 HydrophobicContact CG2-CB 3.81Å; T550-V613 HydrophobicContact CG2-CG1 4.43Å; T550-H617 PolarHBondContact OG1-CE1 2.8Å; T550-R658 WeakPolarHBondContact CB-O 3.49Å; T550-R658 VanDerWaalsContact CG2-O 3.25Å; T550-R658 WeakPolarHBondContact CG2-O 3.48Å; T550-R658 PolarHBondContact OG1-O 2.73Å; T550-V661 HydrophobicContact CG2-CG1 3.82Å
551	V	96.6	Very high	88.4	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	134.9	177.4	-176.3	0	0	0	0	109.8	V526 A528 A540 Q544 P597 D598 A599	V526-V551 HydrophobicContact CB-CG2 4.14Å; V526-V551 CarbonylContact O-C 3.48Å; V526-V551 WeakPolarHBondContact O-CA 3.31Å; A528-V551 HydrophobicContact CB-CG1 3.87Å; A540-V551 HydrophobicContact CB-CG1 4.37Å; A540-V551 HydrophobicContact CB-CG2 4.2Å; A540-V551 WeakPolarHBondContact O-CG2 3.42Å; Q544-V551 HydrophobicContact CG-CB 4.33Å; Q544-V551 HydrophobicContact CG-CG2 3.67Å; V551-P597 HydrophobicContact CB-CB 4.38Å; V551-P597 HydrophobicContact CG1-CB 3.91Å; V551-P597 HydrophobicContact CG1-CG 4.01Å; V551-D598 PolarHBondContact N-OD2 2.8Å; V551-D598 PolarHBondContact O-N 2.88Å; V551-A599 PolarHBondContact O-N 2.93Å
552	V	97	Very high	88	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	133.7	-176	-176.7	0	0	0	0	110.2	V526 L527 A528 T550 A599 V601 A606 R609 V610	V526-V552 PolarHBondContact O-N 3.04Å; L527-V552 WeakPolarHBondContact CA-O 3.46Å; A528-V552 PolarHBondContact N-O 2.6Å; T550-V552 HydrophobicContact CG2-CG2 4.37Å; V552-A599 WeakPolarHBondContact CA-O 3.34Å; V552-A599 HydrophobicContact CB-CB 4.48Å; V552-A599 HydrophobicContact CG1-CB 4.04Å; V552-A599 HydrophobicContact CG2-CB 4.11Å; V552-V601 HydrophobicContact CG1-CG2 3.94Å; V552-A606 HydrophobicContact CG1-CB 4.32Å; V552-R609 HydrophobicContact CG1-CB 3.92Å; V552-R609 HydrophobicContact CG1-CG 3.78Å; V552-V610 HydrophobicContact CB-CG2 3.75Å; V552-V610 HydrophobicContact CG1-CG2 4.03Å; V552-V610 HydrophobicContact CG2-CG2 3.6Å
553	G	95.6	Very high	87.8	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	131.8	-142.4	179.2	0	0	0	0	0	113.1	A528 P597 A599 I600 V601	A528-G553 WeakPolarHBondContact O-CA 3.41Å; G553-P597 WeakPolarHBondContact O-CG 3.31Å; G553-A599 PolarHBondContact N-O 3.16Å; G553-I600 VanDerWaalsContact O-CA 3.28Å; G553-I600 WeakPolarHBondContact O-CA 3.33Å; G553-V601 CarbonylContact C-O 3.56Å; G553-V601 WeakPolarHBondContact CA-O 3.33Å; G553-V601 PolarHBondContact O-N 2.87Å
554	E	94.6	Very high	87.6	Confident	52 Å²	52	29.7 Å²	29.7	24%	0.243	16%	0.163	C	C	.	.	S	Bend	trans	-94.3	159.7	-175.8	-53.1	162.8	168.5	0	0	111.8	A528 S529 Y530 T556 P597 V601 A603	A528-E554 PolarHBondContact O-N 3.2Å; S529-E554 WeakPolarHBondContact CA-OE2 3.42Å; Y530-E554 PolarHBondContact N-OE2 3.01Å; E554-T556 PolarHBondContact O-N 2.87Å; E554-P597 VanDerWaalsContact O-CG 3.22Å; E554-P597 WeakPolarHBondContact O-CG 3.46Å; E554-V601 WeakPolarHBondContact CG-O 3.28Å; E554-V601 PolarHBondContact N-O 3.15Å; E554-A603 VanDerWaalsContact CD-CB 3.41Å; E554-A603 HydrophobicContact CG-CB 4.02Å; E554-A603 VanDerWaalsContact OE1-CB 3.29Å; E554-A603 WeakPolarHBondContact OE1-CB 3.42Å; E554-A603 PolarHBondContact OE1-N 3.09Å
555	I	92.7	Very high	87.6	Confident	80 Å²	80	31.4 Å²	31.4	41%	0.41	18%	0.176	S	C	.	.			trans	-60.2	131.4	167.8	-58.3	175.9	0	0	0	108.8	Y530 V595 V596	Y530-I555 WeakPolarHBondContact CA-O 3.33Å; I555-V595 WeakPolarHBondContact CA-O 3.39Å; I555-V596 HydrophobicContact CD1-CG2 4.47Å; I555-V596 HydrophobicContact CG1-CG2 4.46Å
556	T	92.3	Very high	87.7	Confident	5 Å²	5	33.2 Å²	33.2	3%	0.031	18%	0.183	C	C	.	.			trans	-78.7	175.5	-172.3	65.2	0	0	0	0	113.2	A528 S529 T532 E537 E554 G558 V595	A528-T556 HydrophobicContact CB-CG2 3.86Å; S529-T556 WeakPolarHBondContact O-CA 3.24Å; T532-T556 HydrophobicContact CG2-CG2 3.98Å; T532-T556 WeakPolarHBondContact O-CB 3.44Å; E537-T556 VanDerWaalsContact CD-OG1 3.32Å; E537-T556 WeakPolarHBondContact CG-OG1 3.41Å; E537-T556 VanDerWaalsContact OE2-CB 3.31Å; E537-T556 WeakPolarHBondContact OE2-CB 3.1Å; E537-T556 PolarHBondContact OE2-OG1 3.47Å; E554-T556 PolarHBondContact O-N 2.87Å; T556-G558 VanDerWaalsContact C-N 3.28Å; T556-G558 PolarHBondContact O-N 3.36Å; T556-G558 VanDerWaalsContact O-N 3.15Å; T556-V595 HydrophobicContact CG2-CB 4.09Å; T556-V595 PolarHBondContact N-O 3.46Å; T556-V595 WeakPolarHBondContact OG1-CB 3.42Å; T556-V595 PolarHBondContact OG1-N 3.08Å
557	S	85.3	Confident	87.9	Confident	16 Å²	16	38.7 Å²	38.7	11%	0.112	21%	0.207	C	C	.	.			trans	-64.1	-25.6	-162.4	90.2	0	0	0	0	115.8	Y530 T532 A533 E537 N559	Y530-S557 VanDerWaalsContact O-CB 3.22Å; Y530-S557 WeakPolarHBondContact O-CB 3.37Å; T532-S557 WeakPolarHBondContact O-CB 3.37Å; T532-S557 PolarHBondContact O-N 2.89Å; T532-S557 PolarHBondContact O-OG 3.1Å; A533-S557 WeakPolarHBondContact CB-OG 3.16Å; E537-S557 PolarHBondContact OE1-OG 3.34Å; E537-S557 PolarHBondContact OE2-N 2.88Å; S557-N559 VanDerWaalsContact CB-ND2 3.3Å; S557-N559 WeakPolarHBondContact CB-ND2 3.39Å; S557-N559 PolarHBondContact O-N 3.25Å; S557-N559 PolarHBondContact O-ND2 3.41Å; S557-N559 WeakPolarHBondContact OG-CB 3.25Å; S557-N559 PolarHBondContact OG-N 3.49Å; S557-N559 PolarHBondContact OG-ND2 2.7Å
558	G	83.2	Confident	88	Confident	22 Å²	22	37.3 Å²	37.3	23%	0.227	20%	0.198	C	C	.	.			trans	76.9	-1.7	-173.9	0	0	0	0	0	115	E537 T556 L560	E537-G558 VanDerWaalsContact CD-N 3.35Å; E537-G558 PolarHBondContact OE1-N 3.09Å; E537-G558 VanDerWaalsContact OE1-N 3.08Å; E537-G558 WeakPolarHBondContact OE2-CA 3.47Å; E537-G558 PolarHBondContact OE2-N 2.9Å; T556-G558 VanDerWaalsContact C-N 3.28Å; T556-G558 PolarHBondContact O-N 3.36Å; T556-G558 VanDerWaalsContact O-N 3.15Å; G558-L560 PolarHBondContact O-N 3.11Å
559	N	75.8	Confident	87.7	Confident	80 Å²	80	44.5 Å²	44.5	43%	0.428	23%	0.231	S	C	.	.			trans	-85.2	82.6	-173.9	-56.6	-57.1	0	0	0	110.7	S534 E537 S557	S534-N559 PolarHBondContact N-O 2.71Å; E537-N559 PolarHBondContact OE1-N 3.01Å; S557-N559 VanDerWaalsContact CB-ND2 3.3Å; S557-N559 WeakPolarHBondContact CB-ND2 3.39Å; S557-N559 PolarHBondContact O-N 3.25Å; S557-N559 PolarHBondContact O-ND2 3.41Å; S557-N559 WeakPolarHBondContact OG-CB 3.25Å; S557-N559 PolarHBondContact OG-N 3.49Å; S557-N559 PolarHBondContact OG-ND2 2.7Å
560	L	74.6	Confident	87	Confident	24 Å²	24	48.3 Å²	48.3	13%	0.126	27%	0.27	C	S	.	.			trans	-96.7	135.3	176.2	-58.1	-176.8	0	0	0	111.4	E537 E538 G558 H562 W590 G592	E537-L560 HydrophobicContact CB-CD2 4.13Å; E538-L560 HydrophobicContact CG-CD2 4.43Å; G558-L560 PolarHBondContact O-N 3.11Å; L560-H562 HydrophobicContact CB-CB 4.42Å; L560-H562 PolarHBondContact O-N 2.78Å; L560-W590 HydrophobicContact CD1-CD2 4.13Å; L560-W590 HydrophobicContact CD1-CE3 3.8Å; L560-W590 HydrophobicContact CD1-CH2 3.69Å; L560-W590 HydrophobicContact CD1-CZ2 4Å; L560-W590 HydrophobicContact CD1-CZ3 3.56Å; L560-W590 HydrophobicContact CD2-CH2 3.7Å; L560-W590 HydrophobicContact CD2-CZ3 3.83Å; L560-W590 HydrophobicContact CG-CH2 4.27Å; L560-W590 HydrophobicContact CG-CZ3 4.37Å; L560-G592 VanDerWaalsContact CD1-CA 3.47Å
561	M	74.1	Confident	86.4	Confident	97 Å²	97	49.1 Å²	49.1	48%	0.478	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	26.7	178.5	-59.9	-61.5	-63.6	0	0	113.6	H398	H398-M561 HydrophobicContact CB-CE 4.35Å
562	H	84.6	Confident	85.9	Confident	4 Å²	4	52 Å²	52	2%	0.019	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-5.8	-170	-58.4	176.4	0	0	0	113.5	E538 L560 P578 F579 I580 F582	E538-H562 IonicContact OE1-CD2 3.61Å; E538-H562 IonicContact OE1-CE1 3.54Å; E538-H562 IonicContact OE1-NE2 2.91Å; E538-H562 PolarHBondContact OE1-NE2 3Å; L560-H562 HydrophobicContact CB-CB 4.42Å; L560-H562 PolarHBondContact O-N 2.78Å; H562-P578 WeakPolarHBondContact O-CA 3.43Å; H562-F579 WeakPolarHBondContact O-CD1 3.41Å; H562-F579 PolarHBondContact O-N 3.01Å; H562-I580 HydrophobicContact CB-CB 3.88Å; H562-I580 HydrophobicContact CB-CG2 4.1Å; H562-I580 PolarHBondContact O-N 3.17Å; H562-F582 AromaticContact CE1-CD2 3.9Å
563	S	86.3	Confident	85.5	Confident	40 Å²	40	52 Å²	52	28%	0.28	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	158.8	-175.1	-53.8	0	0	0	0	112.8	V577	S563-V577 CarbonylContact C-O 3.6Å; S563-V577 WeakPolarHBondContact CA-O 3.21Å
564	K	86.8	Confident	85.3	Confident	84 Å²	84	52.4 Å²	52.4	37%	0.365	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	141.3	174.5	-173	159.3	-172.8	122.1	0	111.5	D397 F566 T576 V577 F579	D397-K564 IonicContact OD1-NZ 3.18Å; K564-F566 HydrophobicContact CB-CE2 3.98Å; K564-F566 HydrophobicContact CB-CZ 4.14Å; K564-F566 HydrophobicContact CD-CZ 4.12Å; K564-F566 HydrophobicContact CG-CE1 4.48Å; K564-F566 HydrophobicContact CG-CE2 4.04Å; K564-F566 HydrophobicContact CG-CZ 3.92Å; K564-F566 WeakPolarHBondContact O-CE2 3.5Å; K564-T576 WeakPolarHBondContact O-CA 3.16Å; K564-V577 PolarHBondContact N-O 3.24Å; K564-V577 PolarHBondContact O-N 3.05Å; K564-F579 HydrophobicContact CB-CD1 4.12Å; K564-F579 HydrophobicContact CB-CE1 4.32Å
565	T	89.3	Confident	85.1	Confident	80 Å²	80	49.9 Å²	49.9	49%	0.491	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	141.3	179.1	-58.9	0	0	0	0	111.4	A574 I575 T576	T565-A574 HydrophobicContact CG2-CB 4.06Å; T565-I575 CarbonylContact C-O 2.97Å; T565-I575 WeakPolarHBondContact CA-O 3.26Å; T565-T576 PolarHBondContact OG1-OG1 3.46Å
566	F	89.9	Confident	85.1	Confident	53 Å²	53	46.7 Å²	46.7	23%	0.232	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	123.8	-178.5	-57.9	-92.5	0	0	0	110.2	I333 T337 K564 A574 I575 V577	I333-F566 HydrophobicContact CD1-CB 3.91Å; I333-F566 HydrophobicContact CD1-CG 4.4Å; I333-F566 HydrophobicContact CG2-CB 4.45Å; I333-F566 HydrophobicContact CG2-CD2 3.67Å; I333-F566 HydrophobicContact CG2-CE2 3.98Å; I333-F566 HydrophobicContact CG2-CG 3.98Å; T337-F566 HydrophobicContact CG2-CE2 4.42Å; T337-F566 HydrophobicContact CG2-CZ 3.87Å; K564-F566 HydrophobicContact CB-CE2 3.98Å; K564-F566 HydrophobicContact CB-CZ 4.14Å; K564-F566 HydrophobicContact CD-CZ 4.12Å; K564-F566 HydrophobicContact CG-CE1 4.48Å; K564-F566 HydrophobicContact CG-CE2 4.04Å; K564-F566 HydrophobicContact CG-CZ 3.92Å; K564-F566 WeakPolarHBondContact O-CE2 3.5Å; F566-A574 CarbonylContact O-C 3.57Å; F566-A574 VanDerWaalsContact O-CA 3.3Å; F566-A574 WeakPolarHBondContact O-CA 3.41Å; F566-I575 HydrophobicContact CB-CG2 4.13Å; F566-I575 PolarHBondContact N-O 3.24Å; F566-I575 PolarHBondContact O-N 2.87Å; F566-V577 HydrophobicContact CD2-CG2 4.44Å; F566-V577 HydrophobicContact CE2-CB 4.42Å
567	E	91.4	Very high	85	Confident	136 Å²	136	46.5 Å²	46.5	64%	0.636	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	144.1	175.1	-62.9	177.2	-164.3	0	0	111.4	M387 A574	M387-E567 HydrophobicContact SD-CG 3.93Å; E567-A574 HydrophobicContact CG-CB 4.5Å
568	I	87.2	Confident	85.4	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.021	26%	0.259	C	S	.	.			trans	-100.5	105.7	-177.9	-56.7	-179.8	0	0	0	110.4	I326 I329 I330 G570 T571 I573	I326-I568 HydrophobicContact CG2-CD1 4.13Å; I326-I568 HydrophobicContact CG2-CG2 4.4Å; I329-I568 HydrophobicContact CB-CG2 4.45Å; I329-I568 HydrophobicContact CD1-CG2 3.94Å; I329-I568 HydrophobicContact CG2-CG1 4.34Å; I329-I568 HydrophobicContact CG2-CG2 4.18Å; I330-I568 HydrophobicContact CD1-CD1 3.76Å; I330-I568 HydrophobicContact CG1-CD1 3.57Å; I568-G570 PolarHBondContact O-N 3.3Å; I568-G570 VanDerWaalsContact O-N 3.09Å; I568-T571 WeakPolarHBondContact CB-OG1 3.26Å; I568-T571 PolarHBondContact O-N 2.91Å; I568-T571 VanDerWaalsContact O-N 3.15Å; I568-T571 PolarHBondContact O-OG1 3.03Å; I568-I573 WeakPolarHBondContact CB-O 3.42Å; I568-I573 HydrophobicContact CD1-CB 4.29Å; I568-I573 HydrophobicContact CD1-CG2 3.83Å; I568-I573 PolarHBondContact N-O 3.4Å
569	E	80.3	Confident	85.8	Confident	155 Å²	155	46.1 Å²	46.1	72%	0.724	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	113.1	-177.6	-72	-170.4	160	0	0	114.3	K325	K325-E569 PolarHBondContact NZ-O 3.33Å; K325-E569 IonicContact NZ-OE2 2.71Å
570	G	74.8	Confident	86.5	Confident	82 Å²	82	43.2 Å²	43.2	85%	0.845	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	96.7	15.7	175.2	0	0	0	0	0	115.1	I568	I568-G570 PolarHBondContact O-N 3.3Å; I568-G570 VanDerWaalsContact O-N 3.09Å
571	T	82.9	Confident	87.3	Confident	17 Å²	17	42.3 Å²	42.3	10%	0.104	24%	0.235	C	C	.	.	S	Bend	trans	-143.1	161.2	174.6	54.6	0	0	0	0	110.6	I326 I568 I573	I326-T571 HydrophobicContact CD1-CG2 3.64Å; I326-T571 HydrophobicContact CG1-CG2 3.96Å; I568-T571 WeakPolarHBondContact CB-OG1 3.26Å; I568-T571 PolarHBondContact O-N 2.91Å; I568-T571 VanDerWaalsContact O-N 3.15Å; I568-T571 PolarHBondContact O-OG1 3.03Å; T571-I573 PolarHBondContact O-N 3.18Å; T571-I573 VanDerWaalsContact O-N 3.15Å
572	D	86.1	Confident	88	Confident	62 Å²	62	37.7 Å²	37.7	33%	0.332	21%	0.212	S	C	.	.	S	Bend	trans	-85.1	34.3	173	-63.3	-18.6	0	0	0	111.2	E362 Y386 M387 Q388	E362-D572 PolarHBondContact OE2-N 2.86Å; Y386-D572 HydrophobicContact CD2-CB 4.05Å; Y386-D572 WeakPolarHBondContact CD2-O 3.26Å; Y386-D572 HydrophobicContact CE2-CB 3.45Å; Y386-D572 VanDerWaalsContact CE2-CB 3.45Å; Y386-D572 PolarHBondContact OH-OD2 3.33Å; M387-D572 PolarHBondContact N-O 3.43Å; Q388-D572 PolarHBondContact NE2-OD2 2.89Å
573	I	88.4	Confident	88.4	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.6	-173.8	-56.3	178.4	0	0	0	110.2	E362 L365 I384 R385 I568 T571	E362-I573 HydrophobicContact CB-CD1 3.98Å; E362-I573 HydrophobicContact CB-CG1 4.14Å; E362-I573 HydrophobicContact CG-CD1 4.16Å; L365-I573 HydrophobicContact CD2-CD1 3.98Å; I384-I573 HydrophobicContact CG2-CG2 3.39Å; R385-I573 WeakPolarHBondContact O-CA 3.14Å; I568-I573 WeakPolarHBondContact CB-O 3.42Å; I568-I573 HydrophobicContact CD1-CB 4.29Å; I568-I573 HydrophobicContact CD1-CG2 3.83Å; I568-I573 PolarHBondContact N-O 3.4Å; T571-I573 PolarHBondContact O-N 3.18Å; T571-I573 VanDerWaalsContact O-N 3.15Å
574	A	90.7	Very high	88.5	Confident	7 Å²	7	37 Å²	37	6%	0.058	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	157.5	169.4	0	0	0	0	0	111	I384 R385 M387 T565 F566 E567	I384-A574 CarbonylContact C-O 2.94Å; I384-A574 WeakPolarHBondContact CA-O 3.26Å; R385-A574 PolarHBondContact N-O 3.36Å; R385-A574 PolarHBondContact O-N 2.72Å; R385-A574 VanDerWaalsContact O-N 3.08Å; M387-A574 HydrophobicContact CG-CB 4.07Å; M387-A574 HydrophobicContact SD-CB 3.97Å; T565-A574 HydrophobicContact CG2-CB 4.06Å; F566-A574 CarbonylContact O-C 3.57Å; F566-A574 VanDerWaalsContact O-CA 3.3Å; F566-A574 WeakPolarHBondContact O-CA 3.41Å; E567-A574 HydrophobicContact CG-CB 4.5Å
575	I	91.5	Very high	88.3	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	125.6	173.9	-172.9	172.9	0	0	0	110.9	I330 I333 M334 L382 I384 T565 F566 V577	I330-I575 HydrophobicContact CG2-CD1 3.88Å; I333-I575 HydrophobicContact CD1-CG2 4.03Å; I333-I575 HydrophobicContact CG2-CG2 4.29Å; M334-I575 HydrophobicContact CG-CD1 4.32Å; L382-I575 HydrophobicContact CD1-CD1 4.28Å; I384-I575 HydrophobicContact CD1-CD1 4.26Å; I384-I575 HydrophobicContact CG1-CB 4.05Å; I384-I575 HydrophobicContact CG1-CD1 3.77Å; I384-I575 HydrophobicContact CG1-CG1 3.71Å; T565-I575 CarbonylContact C-O 2.97Å; T565-I575 WeakPolarHBondContact CA-O 3.26Å; F566-I575 HydrophobicContact CB-CG2 4.13Å; F566-I575 PolarHBondContact N-O 3.24Å; F566-I575 PolarHBondContact O-N 2.87Å; I575-V577 HydrophobicContact CD1-CG2 3.95Å; I575-V577 HydrophobicContact CG1-CG2 3.79Å; I575-V577 HydrophobicContact CG2-CG2 4.39Å
576	T	91	Very high	88.1	Confident	13 Å²	13	36.6 Å²	36.6	8%	0.08	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	127.9	167.8	-53.3	0	0	0	0	108.6	I383 K564 T565	I383-T576 PolarHBondContact N-O 3.44Å; I383-T576 VanDerWaalsContact N-O 3.09Å; I383-T576 PolarHBondContact O-N 3.16Å; K564-T576 WeakPolarHBondContact O-CA 3.16Å; T565-T576 PolarHBondContact OG1-OG1 3.46Å
577	V	91.9	Very high	87.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	126.8	-177.3	-175.9	0	0	0	0	109.7	I333 Y338 L382 S563 K564 F566 I575 F579	I333-V577 HydrophobicContact CG2-CG2 3.99Å; Y338-V577 HydrophobicContact CD2-CG1 3.92Å; Y338-V577 HydrophobicContact CG-CG1 4.33Å; L382-V577 HydrophobicContact CD1-CB 4.35Å; L382-V577 HydrophobicContact CD1-CG1 4.21Å; L382-V577 HydrophobicContact CD1-CG2 3.96Å; S563-V577 CarbonylContact C-O 3.6Å; S563-V577 WeakPolarHBondContact CA-O 3.21Å; K564-V577 PolarHBondContact N-O 3.24Å; K564-V577 PolarHBondContact O-N 3.05Å; F566-V577 HydrophobicContact CD2-CG2 4.44Å; F566-V577 HydrophobicContact CE2-CB 4.42Å; I575-V577 HydrophobicContact CD1-CG2 3.95Å; I575-V577 HydrophobicContact CG1-CG2 3.79Å; I575-V577 HydrophobicContact CG2-CG2 4.39Å; V577-F579 PolarHBondContact O-N 2.92Å
578	P	92.1	Very high	87.7	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	126.4	170.5	29.9	-34	0	0	0	110.3	Y338 A339 D379 R381 H562	Y338-P578 WeakPolarHBondContact CA-O 3.38Å; Y338-P578 HydrophobicContact CD2-CG 3.78Å; Y338-P578 HydrophobicContact CE2-CG 3.58Å; A339-P578 PolarHBondContact N-O 3.4Å; D379-P578 WeakPolarHBondContact OD2-CG 3.36Å; R381-P578 HydrophobicContact CB-CB 3.85Å; R381-P578 HydrophobicContact CB-CG 3.87Å; H562-P578 WeakPolarHBondContact O-CA 3.43Å
579	F	91.6	Very high	87.8	Confident	30 Å²	30	39.8 Å²	39.8	13%	0.132	23%	0.225	C	C	.	.			trans	-113.6	-11.8	179.2	75.1	-86.3	0	0	0	113	T337 R499 I500 H562 K564 V577	T337-F579 VanDerWaalsContact O-CA 3.31Å; T337-F579 WeakPolarHBondContact O-CA 3.48Å; T337-F579 VanDerWaalsContact O-CB 3.27Å; T337-F579 WeakPolarHBondContact O-CB 3.22Å; R499-F579 HydrophobicContact CB-CB 4.41Å; R499-F579 WeakPolarHBondContact CB-O 3.45Å; R499-F579 PolarHBondContact N-O 3.49Å; I500-F579 HydrophobicContact CB-CD2 4.3Å; I500-F579 HydrophobicContact CD1-CB 3.85Å; I500-F579 HydrophobicContact CD1-CD1 4.19Å; I500-F579 HydrophobicContact CD1-CD2 3.58Å; I500-F579 HydrophobicContact CD1-CE2 4.19Å; I500-F579 HydrophobicContact CD1-CG 3.59Å; I500-F579 HydrophobicContact CG1-CB 3.96Å; I500-F579 HydrophobicContact CG1-CD2 3.87Å; I500-F579 HydrophobicContact CG1-CG 4.08Å; H562-F579 WeakPolarHBondContact O-CD1 3.41Å; H562-F579 PolarHBondContact O-N 3.01Å; K564-F579 HydrophobicContact CB-CD1 4.12Å; K564-F579 HydrophobicContact CB-CE1 4.32Å; V577-F579 PolarHBondContact O-N 2.92Å
580	I	90.3	Very high	88.2	Confident	20 Å²	20	33.3 Å²	33.3	10%	0.103	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.6	168	-76.6	163.1	0	0	0	109.5	R381 I496 N497 D498 H562	R381-I580 PolarHBondContact NH1-O 2.84Å; I496-I580 HydrophobicContact CG2-CG1 4.39Å; I496-I580 HydrophobicContact CG2-CG2 4.03Å; N497-I580 WeakPolarHBondContact O-CA 3.41Å; D498-I580 HydrophobicContact CB-CG1 4.33Å; H562-I580 HydrophobicContact CB-CB 3.88Å; H562-I580 HydrophobicContact CB-CG2 4.1Å; H562-I580 PolarHBondContact O-N 3.17Å
581	N	91.6	Very high	88.8	Confident	5 Å²	5	31.4 Å²	31.4	3%	0.027	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	118.7	158.4	-86.4	-10.1	0	0	0	108.9	A339 F340 R381 N497 Y589	A339-N581 HydrophobicContact CB-CB 4.18Å; A339-N581 VanDerWaalsContact CB-CG 3.45Å; A339-N581 WeakPolarHBondContact CB-OD1 3.47Å; F340-N581 VanDerWaalsContact CD1-ND2 3.32Å; F340-N581 WeakPolarHBondContact CD1-ND2 3.35Å; F340-N581 WeakPolarHBondContact CD2-ND2 3.32Å; F340-N581 WeakPolarHBondContact CE1-ND2 3.49Å; F340-N581 WeakPolarHBondContact CE2-ND2 3.35Å; F340-N581 VanDerWaalsContact CE2-OD1 3.31Å; F340-N581 WeakPolarHBondContact CE2-OD1 3.16Å; F340-N581 WeakPolarHBondContact CG-ND2 3.39Å; F340-N581 WeakPolarHBondContact CZ-ND2 3.44Å; R381-N581 PolarHBondContact NH2-OD1 2.73Å; N497-N581 HydrophobicContact CB-CB 4.25Å; N497-N581 PolarHBondContact N-O 2.86Å; N497-N581 PolarHBondContact O-N 3.18Å; N581-Y589 HydrophobicContact CB-CD1 3.92Å; N581-Y589 HydrophobicContact CB-CE1 4.04Å
582	F	90.4	Very high	88.6	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	118.7	172.3	-172.5	-77.8	0	0	0	107.8	F494 I496 E538 Y541 L542 H562 W590	F494-F582 HydrophobicContact CB-CE1 4.08Å; F494-F582 HydrophobicContact CB-CZ 3.98Å; F494-F582 HydrophobicContact CD1-CZ 4.38Å; F494-F582 HydrophobicContact CD2-CD2 4.28Å; F494-F582 AromaticContact CD2-CE2 3.61Å; F494-F582 HydrophobicContact CD2-CE2 3.61Å; F494-F582 AromaticContact CD2-CZ 3.78Å; F494-F582 HydrophobicContact CD2-CZ 3.78Å; F494-F582 AromaticContact CE2-CE2 3.89Å; F494-F582 HydrophobicContact CE2-CE2 3.89Å; F494-F582 HydrophobicContact CE2-CZ 4.32Å; F494-F582 HydrophobicContact CG-CE1 4.4Å; F494-F582 HydrophobicContact CG-CE2 4.14Å; F494-F582 AromaticContact CG-CZ 3.81Å; F494-F582 HydrophobicContact CG-CZ 3.81Å; I496-F582 HydrophobicContact CD1-CD2 4.42Å; I496-F582 HydrophobicContact CG1-CD2 4.15Å; E538-F582 HydrophobicContact CB-CE2 4.39Å; E538-F582 HydrophobicContact CG-CE2 4.17Å; Y541-F582 AromaticContact CD1-CE1 3.99Å; Y541-F582 HydrophobicContact CD1-CE1 3.99Å; Y541-F582 HydrophobicContact CE1-CD1 4.47Å; Y541-F582 HydrophobicContact CE1-CE1 4.08Å; L542-F582 HydrophobicContact CD1-CZ 3.98Å; L542-F582 HydrophobicContact CD2-CE1 3.95Å; L542-F582 HydrophobicContact CD2-CZ 4Å; L542-F582 HydrophobicContact CG-CE1 4.34Å; L542-F582 HydrophobicContact CG-CZ 4.03Å; H562-F582 AromaticContact CE1-CD2 3.9Å; F582-W590 HydrophobicContact CD1-CB 4.05Å; F582-W590 HydrophobicContact CD1-CE3 4.14Å; F582-W590 HydrophobicContact CE1-CE3 4.34Å; F582-W590 HydrophobicContact CG-CE3 4.46Å; F582-W590 PolarHBondContact O-N 3.36Å
583	I	91	Very high	88.2	Confident	21 Å²	21	32 Å²	32	11%	0.108	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	128.8	-175.6	-52.3	174.1	0	0	0	108.2	F494 T495 N497 E588 Y589	F494-I583 CarbonylContact C-O 3.6Å; F494-I583 WeakPolarHBondContact CA-O 3.5Å; F494-I583 VanDerWaalsContact CB-O 3.24Å; F494-I583 WeakPolarHBondContact CB-O 3.29Å; T495-I583 PolarHBondContact N-O 3.22Å; T495-I583 PolarHBondContact O-N 3.34Å; N497-I583 WeakPolarHBondContact ND2-CD1 3.49Å; I583-E588 VanDerWaalsContact CA-O 3.32Å; I583-E588 WeakPolarHBondContact CA-O 3.48Å; I583-Y589 HydrophobicContact CD1-CD1 4.19Å; I583-Y589 HydrophobicContact CD1-CE1 3.5Å; I583-Y589 HydrophobicContact CG1-CD1 3.77Å; I583-Y589 HydrophobicContact CG1-CE1 3.62Å; I583-Y589 HydrophobicContact CG1-CG 4.4Å
584	D	88.4	Confident	88.1	Confident	9 Å²	9	32.4 Å²	32.4	5%	0.048	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	-171.2	-179.1	80.4	-5.2	0	0	0	113.5	Y541 S545 N586 G587 E588	Y541-D584 HydrophobicContact CE1-CB 4.09Å; S545-D584 WeakPolarHBondContact CB-OD2 3.29Å; D584-N586 VanDerWaalsContact C-N 3.3Å; D584-N586 VanDerWaalsContact OD1-CA 3.32Å; D584-N586 WeakPolarHBondContact OD1-CA 3.49Å; D584-N586 WeakPolarHBondContact OD1-CB 3.41Å; D584-N586 PolarHBondContact OD1-N 3.23Å; D584-N586 PolarHBondContact OD2-ND2 3.08Å; D584-G587 PolarHBondContact OD1-N 3.27Å; D584-E588 PolarHBondContact N-O 2.99Å; D584-E588 PolarHBondContact OD1-N 3.42Å
585	N	84	Confident	88.1	Confident	50 Å²	50	32.2 Å²	32.2	27%	0.267	19%	0.191	S	C	.	.	S	Bend	trans	-72.5	-17.4	175.7	59.6	-80	0	0	0	114.7	F493 S545 L546	F493-N585 PolarHBondContact O-N 3.45Å; S545-N585 PolarHBondContact O-ND2 2.92Å; S545-N585 PolarHBondContact O-OD1 3.3Å; S545-N585 PolarHBondContact OG-OD1 3.2Å; S545-N585 VanDerWaalsContact OG-OD1 3.14Å; L546-N585 HydrophobicContact CD2-CB 3.72Å; L546-N585 VanDerWaalsContact CD2-OD1 3.23Å; L546-N585 WeakPolarHBondContact CD2-OD1 3.3Å; L546-N585 WeakPolarHBondContact CG-OD1 3.25Å
586	N	83.6	Confident	88.2	Confident	104 Å²	104	36 Å²	36	56%	0.556	21%	0.214	S	C	*	.	S	Bend	trans	-89.4	-21.8	179.5	-52.7	-58.4	0	0	0	111	S545 D584	S545-N586 PolarHBondContact O-ND2 3.48Å; D584-N586 VanDerWaalsContact C-N 3.3Å; D584-N586 VanDerWaalsContact OD1-CA 3.32Å; D584-N586 WeakPolarHBondContact OD1-CA 3.49Å; D584-N586 WeakPolarHBondContact OD1-CB 3.41Å; D584-N586 PolarHBondContact OD1-N 3.23Å; D584-N586 PolarHBondContact OD2-ND2 3.08Å
587	G	85.4	Confident	88.4	Confident	37 Å²	37	35.6 Å²	35.6	38%	0.381	21%	0.212	S	C	.	.	S	Bend	trans	105.8	3.6	-176.7	0	0	0	0	0	113.5	D584	D584-G587 PolarHBondContact OD1-N 3.27Å
588	E	88.9	Confident	88.5	Confident	124 Å²	124	37.4 Å²	37.4	58%	0.579	22%	0.221	S	C	*	.			trans	-81	143.4	-176.8	-69.8	-55.8	146.1	0	0	112.1	I583 D584	I583-E588 VanDerWaalsContact CA-O 3.32Å; I583-E588 WeakPolarHBondContact CA-O 3.48Å; D584-E588 PolarHBondContact N-O 2.99Å; D584-E588 PolarHBondContact OD1-N 3.42Å
589	Y	89.6	Confident	88.7	Confident	99 Å²	99	37.7 Å²	37.7	39%	0.388	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	111.7	-179	-71	-99.2	0	0	0	109.8	F340 N581 I583 L591	F340-Y589 HydrophobicContact CD1-CE1 4.38Å; F340-Y589 AromaticContact CE1-CD1 3.43Å; F340-Y589 HydrophobicContact CE1-CD1 3.43Å; F340-Y589 VanDerWaalsContact CE1-CD1 3.43Å; F340-Y589 HydrophobicContact CE1-CD2 4.33Å; F340-Y589 AromaticContact CE1-CE1 3.49Å; F340-Y589 HydrophobicContact CE1-CE1 3.49Å; F340-Y589 VanDerWaalsContact CE1-CE1 3.49Å; F340-Y589 HydrophobicContact CE1-CE2 4.39Å; F340-Y589 AromaticContact CE1-CG 3.88Å; F340-Y589 HydrophobicContact CE1-CG 3.88Å; F340-Y589 AromaticContact CE1-CZ 3.99Å; F340-Y589 AromaticContact CZ-CD1 3.43Å; F340-Y589 HydrophobicContact CZ-CD1 3.43Å; F340-Y589 VanDerWaalsContact CZ-CD1 3.43Å; F340-Y589 AromaticContact CZ-CE1 3.99Å; F340-Y589 HydrophobicContact CZ-CE1 3.99Å; F340-Y589 AromaticContact CZ-CG 3.77Å; F340-Y589 HydrophobicContact CZ-CG 3.77Å; N581-Y589 HydrophobicContact CB-CD1 3.92Å; N581-Y589 HydrophobicContact CB-CE1 4.04Å; I583-Y589 HydrophobicContact CD1-CD1 4.19Å; I583-Y589 HydrophobicContact CD1-CE1 3.5Å; I583-Y589 HydrophobicContact CG1-CD1 3.77Å; I583-Y589 HydrophobicContact CG1-CE1 3.62Å; I583-Y589 HydrophobicContact CG1-CG 4.4Å; Y589-L591 PolarHBondContact O-N 3.49Å
590	W	88.6	Confident	88.8	Confident	19 Å²	19	41.2 Å²	41.2	7%	0.072	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	115.6	176	-170.8	38.8	0	0	0	110.8	E537 E538 Y541 L560 F582 V595	E537-W590 HydrophobicContact CB-CH2 3.79Å; E538-W590 HydrophobicContact CB-CZ3 4.35Å; E538-W590 HydrophobicContact CG-CZ3 3.87Å; Y541-W590 HydrophobicContact CD1-CB 4.39Å; Y541-W590 AromaticContact CD1-CD2 3.96Å; Y541-W590 HydrophobicContact CD1-CD2 3.96Å; Y541-W590 AromaticContact CD1-CE3 3.97Å; Y541-W590 HydrophobicContact CD1-CE3 3.97Å; Y541-W590 HydrophobicContact CD1-CG 4.16Å; Y541-W590 AromaticContact CD2-CD1 3.82Å; Y541-W590 AromaticContact CD2-CD2 3.94Å; Y541-W590 HydrophobicContact CD2-CD2 3.94Å; Y541-W590 AromaticContact CD2-CE2 3.8Å; Y541-W590 AromaticContact CD2-CG 3.98Å; Y541-W590 HydrophobicContact CD2-CG 3.98Å; Y541-W590 HydrophobicContact CD2-CZ2 4.37Å; Y541-W590 AromaticContact CD2-NE1 3.75Å; Y541-W590 HydrophobicContact CE1-CB 3.83Å; Y541-W590 HydrophobicContact CE1-CD2 4.28Å; Y541-W590 AromaticContact CE1-CG 3.99Å; Y541-W590 HydrophobicContact CE1-CG 3.99Å; Y541-W590 HydrophobicContact CE2-CB 4.23Å; Y541-W590 AromaticContact CE2-CD1 3.57Å; Y541-W590 HydrophobicContact CE2-CD2 4.24Å; Y541-W590 AromaticContact CE2-CG 3.78Å; Y541-W590 HydrophobicContact CE2-CG 3.78Å; Y541-W590 AromaticContact CE2-NE1 3.96Å; Y541-W590 AromaticContact CG-CD2 3.8Å; Y541-W590 HydrophobicContact CG-CD2 3.8Å; Y541-W590 AromaticContact CG-CE2 3.92Å; Y541-W590 HydrophobicContact CG-CE3 4.03Å; Y541-W590 HydrophobicContact CG-CG 4.17Å; Y541-W590 HydrophobicContact CG-CH2 4.46Å; Y541-W590 HydrophobicContact CG-CZ2 4.27Å; Y541-W590 HydrophobicContact CG-CZ3 4.36Å; Y541-W590 AromaticContact CZ-CD1 3.99Å; Y541-W590 AromaticContact CZ-CG 3.8Å; L560-W590 HydrophobicContact CD1-CD2 4.13Å; L560-W590 HydrophobicContact CD1-CE3 3.8Å; L560-W590 HydrophobicContact CD1-CH2 3.69Å; L560-W590 HydrophobicContact CD1-CZ2 4Å; L560-W590 HydrophobicContact CD1-CZ3 3.56Å; L560-W590 HydrophobicContact CD2-CH2 3.7Å; L560-W590 HydrophobicContact CD2-CZ3 3.83Å; L560-W590 HydrophobicContact CG-CH2 4.27Å; L560-W590 HydrophobicContact CG-CZ3 4.37Å; F582-W590 HydrophobicContact CD1-CB 4.05Å; F582-W590 HydrophobicContact CD1-CE3 4.14Å; F582-W590 HydrophobicContact CE1-CE3 4.34Å; F582-W590 HydrophobicContact CG-CE3 4.46Å; F582-W590 PolarHBondContact O-N 3.36Å; W590-V595 HydrophobicContact CH2-CG2 3.95Å; W590-V595 HydrophobicContact CZ2-CG2 3.62Å
591	L	86.1	Confident	89	Confident	43 Å²	43	41.8 Å²	41.8	23%	0.225	25%	0.247	C	C	.	.			trans	-95.1	10.2	-177.8	-53.2	178	0	0	0	113	F340 P380 R381 Y589	F340-L591 HydrophobicContact CE2-CD2 4.07Å; F340-L591 HydrophobicContact CZ-CD2 4.25Å; P380-L591 HydrophobicContact CG-CB 4.39Å; R381-L591 VanDerWaalsContact CD-O 3.24Å; R381-L591 WeakPolarHBondContact CD-O 3.39Å; R381-L591 WeakPolarHBondContact CG-O 3.19Å; Y589-L591 PolarHBondContact O-N 3.49Å
592	G	79.1	Confident	89.2	Confident	20 Å²	20	45.9 Å²	45.9	21%	0.206	27%	0.268	C	S	.	.			trans	72.1	-143.3	179.9	0	0	0	0	0	113.5	L560 G594	L560-G592 VanDerWaalsContact CD1-CA 3.47Å; G592-G594 VanDerWaalsContact C-N 3.34Å
593	G	77.1	Confident	89.2	Confident	70 Å²	70	46.7 Å²	46.7	72%	0.722	28%	0.275	S	S	*	.	S	Bend	trans	84.6	2.9	-176.6	0	0	0	0	0	115.2
594	G	87	Confident	89.2	Confident	9 Å²	9	53.1 Å²	53.1	9%	0.093	31%	0.305	C	S	.	.			trans	101.9	141.3	-176.3	0	0	0	0	0	111.8	G592	G592-G594 VanDerWaalsContact C-N 3.34Å
595	V	91	Very high	89.5	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.018	33%	0.325	C	S	.	.			trans	-73.3	133.5	166.9	-176	0	0	0	0	107.9	E537 A540 I555 T556 W590 P597	E537-V595 HydrophobicContact CB-CG2 4.07Å; E537-V595 WeakPolarHBondContact O-CG2 3.36Å; A540-V595 HydrophobicContact CB-CB 4.47Å; A540-V595 HydrophobicContact CB-CG1 4.12Å; A540-V595 HydrophobicContact CB-CG2 4.28Å; I555-V595 WeakPolarHBondContact CA-O 3.39Å; T556-V595 HydrophobicContact CG2-CB 4.09Å; T556-V595 PolarHBondContact N-O 3.46Å; T556-V595 WeakPolarHBondContact OG1-CB 3.42Å; T556-V595 PolarHBondContact OG1-N 3.08Å; W590-V595 HydrophobicContact CH2-CG2 3.95Å; W590-V595 HydrophobicContact CZ2-CG2 3.62Å; V595-P597 WeakPolarHBondContact O-CD 3.37Å
596	V	93.8	Very high	90	Very high	80 Å²	80	55.2 Å²	55.2	49%	0.485	31%	0.312	S	S	.	.			trans	-98.1	114.1	174.1	-177.2	0	0	0	0	108.1	Q544 I555 I600	Q544-V596 PolarHBondContact NE2-O 3.12Å; I555-V596 HydrophobicContact CD1-CG2 4.47Å; I555-V596 HydrophobicContact CG1-CG2 4.46Å; V596-I600 HydrophobicContact CG1-CD1 3.76Å; V596-I600 HydrophobicContact CG1-CG1 4.39Å
597	P	94.6	Very high	90.5	Very high	5 Å²	5	52.5 Å²	52.5	3%	0.032	30%	0.298	C	S	.	.			trans	-61	148.2	178.4	-28.7	39	0	0	0	113.3	A528 V551 G553 E554 V595 A599 I600	A528-P597 HydrophobicContact CB-CG 4.35Å; V551-P597 HydrophobicContact CB-CB 4.38Å; V551-P597 HydrophobicContact CG1-CB 3.91Å; V551-P597 HydrophobicContact CG1-CG 4.01Å; G553-P597 WeakPolarHBondContact O-CG 3.31Å; E554-P597 VanDerWaalsContact O-CG 3.22Å; E554-P597 WeakPolarHBondContact O-CG 3.46Å; V595-P597 WeakPolarHBondContact O-CD 3.37Å; P597-A599 VanDerWaalsContact C-N 3.28Å; P597-A599 PolarHBondContact O-N 3.26Å; P597-I600 HydrophobicContact CB-CG1 4.47Å; P597-I600 WeakPolarHBondContact O-CG1 3.29Å
598	D	95.2	Very high	90.8	Very high	38 Å²	38	56.1 Å²	56.1	20%	0.203	31%	0.308	C	S	.	.	S	Bend	trans	-63.9	-35.6	174.2	-52.1	-56.1	0	0	0	111.3	Q544 T550 V551 S659 V661	Q544-D598 VanDerWaalsContact NE2-CG 3.34Å; Q544-D598 PolarHBondContact NE2-OD1 3Å; T550-D598 VanDerWaalsContact CA-OD2 3.29Å; T550-D598 WeakPolarHBondContact CA-OD2 3.5Å; T550-D598 HydrophobicContact CG2-CB 3.81Å; V551-D598 PolarHBondContact N-OD2 2.8Å; V551-D598 PolarHBondContact O-N 2.88Å; D598-S659 VanDerWaalsContact OD1-CB 3.25Å; D598-S659 WeakPolarHBondContact OD1-CB 3.36Å; D598-V661 HydrophobicContact CB-CG1 3.91Å; D598-V661 VanDerWaalsContact O-CG2 3.31Å; D598-V661 WeakPolarHBondContact O-CG2 3.29Å
599	A	94.6	Very high	91.1	Very high	5 Å²	5	52.6 Å²	52.6	4%	0.041	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	104.7	166	0	0	0	0	0	110.8	V551 V552 G553 P597 V601 R609 V661	V551-A599 PolarHBondContact O-N 2.93Å; V552-A599 WeakPolarHBondContact CA-O 3.34Å; V552-A599 HydrophobicContact CB-CB 4.48Å; V552-A599 HydrophobicContact CG1-CB 4.04Å; V552-A599 HydrophobicContact CG2-CB 4.11Å; G553-A599 PolarHBondContact N-O 3.16Å; P597-A599 VanDerWaalsContact C-N 3.28Å; P597-A599 PolarHBondContact O-N 3.26Å; A599-V601 PolarHBondContact O-N 3.43Å; A599-R609 HydrophobicContact CB-CG 4.06Å; A599-V661 HydrophobicContact CB-CB 4.09Å; A599-V661 HydrophobicContact CB-CG1 3.93Å; A599-V661 HydrophobicContact CB-CG2 4.07Å
600	I	94.4	Very high	91.4	Very high	104 Å²	104	47.9 Å²	47.9	53%	0.533	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	118.7	178.1	-51.3	178.8	0	0	0	110.2	G553 V596 P597	G553-I600 VanDerWaalsContact O-CA 3.28Å; G553-I600 WeakPolarHBondContact O-CA 3.33Å; V596-I600 HydrophobicContact CG1-CD1 3.76Å; V596-I600 HydrophobicContact CG1-CG1 4.39Å; P597-I600 HydrophobicContact CB-CG1 4.47Å; P597-I600 WeakPolarHBondContact O-CG1 3.29Å
601	V	95.5	Very high	91.6	Very high	33 Å²	33	50.8 Å²	50.8	20%	0.2	28%	0.283	C	S	.	.			trans	-150.1	168.1	175.9	-68.8	0	0	0	0	110	V552 G553 E554 A599 E605 A606 R609	V552-V601 HydrophobicContact CG1-CG2 3.94Å; G553-V601 CarbonylContact C-O 3.56Å; G553-V601 WeakPolarHBondContact CA-O 3.33Å; G553-V601 PolarHBondContact O-N 2.87Å; E554-V601 WeakPolarHBondContact CG-O 3.28Å; E554-V601 PolarHBondContact N-O 3.15Å; A599-V601 PolarHBondContact O-N 3.43Å; V601-E605 HydrophobicContact CB-CB 4.44Å; V601-A606 HydrophobicContact CG2-CB 4.03Å; V601-R609 HydrophobicContact CG1-CB 4.17Å; V601-R609 HydrophobicContact CG1-CG 3.83Å; V601-R609 HydrophobicContact CG2-CB 3.97Å; V601-R609 HydrophobicContact CG2-CG 4.14Å
602	L	94.1	Very high	91.9	Very high	90 Å²	90	54.2 Å²	54.2	47%	0.471	30%	0.297	S	S	.	.			trans	-63.8	147.5	174.6	-65	176.4	0	0	0	111	E604 E605 A606	L602-E604 HydrophobicContact CB-CG 4.29Å; L602-E604 PolarHBondContact O-N 2.88Å; L602-E605 HydrophobicContact CB-CG 4.3Å; L602-E605 PolarHBondContact O-N 3.15Å; L602-A606 PolarHBondContact O-N 2.92Å; L602-A606 VanDerWaalsContact O-N 3.1Å
603	A	91.5	Very high	92.6	Very high	17 Å²	17	53.2 Å²	53.2	14%	0.14	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.7	-174.8	0	0	0	0	0	113.2	R467 E554	R467-A603 WeakPolarHBondContact CD-O 3.37Å; R467-A603 PolarHBondContact NH1-O 2.75Å; E554-A603 VanDerWaalsContact CD-CB 3.41Å; E554-A603 HydrophobicContact CG-CB 4.02Å; E554-A603 VanDerWaalsContact OE1-CB 3.29Å; E554-A603 WeakPolarHBondContact OE1-CB 3.42Å; E554-A603 PolarHBondContact OE1-N 3.09Å
604	E	91.4	Very high	93.3	Very high	157 Å²	157	50.3 Å²	50.3	73%	0.734	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-34.3	173.3	58.6	-169.9	172.9	0	0	113.4	L602	L602-E604 HydrophobicContact CB-CG 4.29Å; L602-E604 PolarHBondContact O-N 2.88Å
605	E	94.8	Very high	93.5	Very high	102 Å²	102	52.8 Å²	52.8	48%	0.477	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-19.3	-179.7	-59.3	177.5	145.4	0	0	113.1	V601 L602 L607 D608 R609	V601-E605 HydrophobicContact CB-CB 4.44Å; L602-E605 HydrophobicContact CB-CG 4.3Å; L602-E605 PolarHBondContact O-N 3.15Å; E605-L607 PolarHBondContact O-N 2.95Å; E605-D608 PolarHBondContact O-N 2.95Å; E605-R609 PolarHBondContact O-N 3.34Å; E605-R609 VanDerWaalsContact O-N 3.11Å
606	A	93.8	Very high	93.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-52.7	-32.1	-172	0	0	0	0	0	115.4	L527 V552 V601 L602 V610	L527-A606 HydrophobicContact CD2-CB 4.04Å; L527-A606 WeakPolarHBondContact CD2-O 3.32Å; V552-A606 HydrophobicContact CG1-CB 4.32Å; V601-A606 HydrophobicContact CG2-CB 4.03Å; L602-A606 PolarHBondContact O-N 2.92Å; L602-A606 VanDerWaalsContact O-N 3.1Å; A606-V610 WeakPolarHBondContact O-CG2 3.44Å; A606-V610 PolarHBondContact O-N 3.07Å; A606-V610 VanDerWaalsContact O-N 3.14Å
607	L	93.3	Very high	93.4	Very high	48 Å²	48	51.9 Å²	51.9	25%	0.251	27%	0.265	S	S	.	.	H	α-helix	trans	-71.6	-39.6	177.9	178.6	62.4	0	0	0	112.4	I463 L527 E605 V610 Y611	I463-L607 HydrophobicContact CD1-CD1 3.73Å; I463-L607 HydrophobicContact CG2-CD1 4.39Å; L527-L607 HydrophobicContact CD1-CB 4.22Å; L527-L607 HydrophobicContact CD1-CD1 4.25Å; E605-L607 PolarHBondContact O-N 2.95Å; L607-V610 PolarHBondContact O-N 3.25Å; L607-Y611 HydrophobicContact CD1-CE2 4.11Å; L607-Y611 HydrophobicContact CG-CE2 4.18Å; L607-Y611 VanDerWaalsContact O-CD2 3.28Å; L607-Y611 WeakPolarHBondContact O-CD2 3.45Å; L607-Y611 PolarHBondContact O-N 3.41Å
608	D	93.2	Very high	93.2	Very high	112 Å²	112	59.1 Å²	59.1	60%	0.599	30%	0.295	S	S	*	.	H	α-helix	trans	-71.9	-39.9	178.3	-70	-28.5	0	0	0	110.3	E605 V610 Y611 E612	E605-D608 PolarHBondContact O-N 2.95Å; D608-V610 VanDerWaalsContact C-N 3.29Å; D608-V610 PolarHBondContact O-N 2.95Å; D608-Y611 WeakPolarHBondContact O-CB 3.42Å; D608-Y611 PolarHBondContact O-N 3.49Å; D608-E612 PolarHBondContact O-N 3.29Å
609	R	95	Very high	92.9	Very high	51 Å²	51	58.8 Å²	58.8	19%	0.192	30%	0.301	C	S	.	.	H	α-helix	trans	-59	-37.2	173.3	-175.7	60.9	-179.2	142.2	7.5	112.6	V552 A599 V601 E605 Y611 E612 V613 V661 D662	V552-R609 HydrophobicContact CG1-CB 3.92Å; V552-R609 HydrophobicContact CG1-CG 3.78Å; A599-R609 HydrophobicContact CB-CG 4.06Å; V601-R609 HydrophobicContact CG1-CB 4.17Å; V601-R609 HydrophobicContact CG1-CG 3.83Å; V601-R609 HydrophobicContact CG2-CB 3.97Å; V601-R609 HydrophobicContact CG2-CG 4.14Å; E605-R609 PolarHBondContact O-N 3.34Å; E605-R609 VanDerWaalsContact O-N 3.11Å; R609-Y611 VanDerWaalsContact C-N 3.31Å; R609-Y611 PolarHBondContact O-N 3.43Å; R609-E612 VanDerWaalsContact CD-OE2 3.23Å; R609-E612 WeakPolarHBondContact CD-OE2 3.31Å; R609-E612 IonicContact CZ-OE2 3.83Å; R609-E612 IonicContact NE-OE2 2.69Å; R609-E612 IonicContact NH1-OE2 3.13Å; R609-E612 PolarHBondContact NH1-OE2 3.37Å; R609-E612 WeakPolarHBondContact O-CB 3.33Å; R609-E612 PolarHBondContact O-N 3.1Å; R609-V613 WeakPolarHBondContact O-CG2 3.32Å; R609-V613 PolarHBondContact O-N 2.85Å; R609-V661 PolarHBondContact NH2-O 3.05Å; R609-D662 IonicContact NH2-OD2 2.68Å
610	V	94.6	Very high	92.8	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.9	-38.8	173.3	160.6	0	0	0	0	112.1	I463 Y525 L527 V552 A606 L607 D608 E612 V613 M614	I463-V610 HydrophobicContact CD1-CG1 3.71Å; I463-V610 HydrophobicContact CG1-CG1 3.97Å; Y525-V610 HydrophobicContact CD1-CG1 4.18Å; Y525-V610 HydrophobicContact CD2-CG1 4.26Å; Y525-V610 HydrophobicContact CG-CG1 3.78Å; Y525-V610 HydrophobicContact CG-CG2 4.49Å; L527-V610 HydrophobicContact CD2-CB 4.43Å; L527-V610 HydrophobicContact CD2-CG2 3.53Å; V552-V610 HydrophobicContact CB-CG2 3.75Å; V552-V610 HydrophobicContact CG1-CG2 4.03Å; V552-V610 HydrophobicContact CG2-CG2 3.6Å; A606-V610 WeakPolarHBondContact O-CG2 3.44Å; A606-V610 PolarHBondContact O-N 3.07Å; A606-V610 VanDerWaalsContact O-N 3.14Å; L607-V610 PolarHBondContact O-N 3.25Å; D608-V610 VanDerWaalsContact C-N 3.29Å; D608-V610 PolarHBondContact O-N 2.95Å; V610-E612 VanDerWaalsContact C-N 3.33Å; V610-E612 PolarHBondContact O-N 2.79Å; V610-V613 PolarHBondContact O-N 2.81Å; V610-M614 HydrophobicContact CG1-CG 4.18Å; V610-M614 HydrophobicContact CG1-SD 3.66Å; V610-M614 VanDerWaalsContact O-CB 3.3Å; V610-M614 WeakPolarHBondContact O-CB 3.49Å; V610-M614 VanDerWaalsContact O-CG 3.22Å; V610-M614 WeakPolarHBondContact O-CG 3.48Å; V610-M614 PolarHBondContact O-N 2.72Å
611	Y	93.3	Very high	92.7	Very high	80 Å²	80	61.2 Å²	61.2	31%	0.314	30%	0.302	S	S	.	.	H	α-helix	trans	-67.2	-32.3	177.4	-73.3	-63.6	0	0	0	113.2	L423 L607 D608 R609 M614 A615	L423-Y611 WeakPolarHBondContact CD1-OH 3.39Å; L607-Y611 HydrophobicContact CD1-CE2 4.11Å; L607-Y611 HydrophobicContact CG-CE2 4.18Å; L607-Y611 VanDerWaalsContact O-CD2 3.28Å; L607-Y611 WeakPolarHBondContact O-CD2 3.45Å; L607-Y611 PolarHBondContact O-N 3.41Å; D608-Y611 WeakPolarHBondContact O-CB 3.42Å; D608-Y611 PolarHBondContact O-N 3.49Å; R609-Y611 VanDerWaalsContact C-N 3.31Å; R609-Y611 PolarHBondContact O-N 3.43Å; Y611-M614 HydrophobicContact CD1-CE 4.22Å; Y611-M614 HydrophobicContact CD1-SD 4.16Å; Y611-M614 HydrophobicContact CE1-CE 4.38Å; Y611-M614 HydrophobicContact CE1-SD 4.49Å; Y611-A615 PolarHBondContact O-N 3.3Å; Y611-A615 VanDerWaalsContact O-N 3.13Å
612	E	93.1	Very high	92.6	Very high	114 Å²	114	63.7 Å²	63.7	53%	0.533	32%	0.318	S	S	.	.	H	α-helix	trans	-65.9	-49.5	172	-59.3	-177.2	157.5	0	0	111.5	D608 R609 V610 M614 A615 F616	D608-E612 PolarHBondContact O-N 3.29Å; R609-E612 VanDerWaalsContact CD-OE2 3.23Å; R609-E612 WeakPolarHBondContact CD-OE2 3.31Å; R609-E612 IonicContact CZ-OE2 3.83Å; R609-E612 IonicContact NE-OE2 2.69Å; R609-E612 IonicContact NH1-OE2 3.13Å; R609-E612 PolarHBondContact NH1-OE2 3.37Å; R609-E612 WeakPolarHBondContact O-CB 3.33Å; R609-E612 PolarHBondContact O-N 3.1Å; V610-E612 VanDerWaalsContact C-N 3.33Å; V610-E612 PolarHBondContact O-N 2.79Å; E612-M614 VanDerWaalsContact C-N 3.32Å; E612-M614 PolarHBondContact O-N 3.31Å; E612-A615 WeakPolarHBondContact O-CA 3.44Å; E612-A615 WeakPolarHBondContact O-CB 3.39Å; E612-A615 PolarHBondContact O-N 3.16Å; E612-F616 PolarHBondContact O-N 2.93Å
613	V	93.9	Very high	92.7	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.5	-41.2	178	176.5	0	0	0	0	110.8	Y525 T550 R609 V610 A615 F616 H617 V661	Y525-V613 HydrophobicContact CE1-CG1 4.02Å; T550-V613 HydrophobicContact CG2-CG1 4.43Å; R609-V613 WeakPolarHBondContact O-CG2 3.32Å; R609-V613 PolarHBondContact O-N 2.85Å; V610-V613 PolarHBondContact O-N 2.81Å; V613-A615 PolarHBondContact O-N 2.76Å; V613-F616 PolarHBondContact O-N 3.43Å; V613-H617 VanDerWaalsContact CG1-CE1 3.46Å; V613-H617 WeakPolarHBondContact CG1-CE1 3.38Å; V613-H617 WeakPolarHBondContact CG1-NE2 3.3Å; V613-H617 WeakPolarHBondContact O-CB 3.46Å; V613-H617 VanDerWaalsContact O-CG 3.31Å; V613-H617 PolarHBondContact O-N 3Å; V613-V661 HydrophobicContact CG1-CB 4.32Å; V613-V661 HydrophobicContact CG1-CG1 4.01Å; V613-V661 HydrophobicContact CG2-CB 3.83Å; V613-V661 HydrophobicContact CG2-CG1 4.05Å
614	M	91.8	Very high	92.9	Very high	9 Å²	9	59.4 Å²	59.4	4%	0.044	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-27	171.8	-78.6	173.1	56.2	0	0	114	T427 N461 Y525 V610 Y611 E612 K618	T427-M614 HydrophobicContact CG2-CE 4.04Å; T427-M614 HydrophobicContact CG2-SD 4.41Å; T427-M614 WeakPolarHBondContact OG1-CE 3.42Å; N461-M614 HydrophobicContact CB-CE 3.79Å; N461-M614 HydrophobicContact CB-SD 4.34Å; Y525-M614 HydrophobicContact CD1-CG 4.4Å; Y525-M614 HydrophobicContact CD2-CG 3.91Å; Y525-M614 HydrophobicContact CD2-SD 4.09Å; Y525-M614 HydrophobicContact CE1-CG 3.9Å; Y525-M614 HydrophobicContact CE2-CG 3.35Å; Y525-M614 HydrophobicContact CE2-SD 3.99Å; Y525-M614 HydrophobicContact CG-CG 4.42Å; V610-M614 HydrophobicContact CG1-CG 4.18Å; V610-M614 HydrophobicContact CG1-SD 3.66Å; V610-M614 VanDerWaalsContact O-CB 3.3Å; V610-M614 WeakPolarHBondContact O-CB 3.49Å; V610-M614 VanDerWaalsContact O-CG 3.22Å; V610-M614 WeakPolarHBondContact O-CG 3.48Å; V610-M614 PolarHBondContact O-N 2.72Å; Y611-M614 HydrophobicContact CD1-CE 4.22Å; Y611-M614 HydrophobicContact CD1-SD 4.16Å; Y611-M614 HydrophobicContact CE1-CE 4.38Å; Y611-M614 HydrophobicContact CE1-SD 4.49Å; E612-M614 VanDerWaalsContact C-N 3.32Å; E612-M614 PolarHBondContact O-N 3.31Å; M614-K618 WeakPolarHBondContact O-CD 3.22Å; M614-K618 VanDerWaalsContact O-CE 3.22Å; M614-K618 WeakPolarHBondContact O-CE 3.4Å; M614-K618 WeakPolarHBondContact O-CG 3.09Å
615	A	91.1	Very high	93.1	Very high	60 Å²	60	53 Å²	53	50%	0.496	27%	0.267	S	S	.	.	H	α-helix	trans	-78.4	-43.9	173.2	0	0	0	0	0	110.9	Y611 E612 V613 K618	Y611-A615 PolarHBondContact O-N 3.3Å; Y611-A615 VanDerWaalsContact O-N 3.13Å; E612-A615 WeakPolarHBondContact O-CA 3.44Å; E612-A615 WeakPolarHBondContact O-CB 3.39Å; E612-A615 PolarHBondContact O-N 3.16Å; V613-A615 PolarHBondContact O-N 2.76Å; A615-K618 PolarHBondContact O-N 2.82Å
616	F	92	Very high	93.1	Very high	33 Å²	33	48.2 Å²	48.2	15%	0.145	24%	0.244	C	C	.	.	H	α-helix	trans	-62	-46.5	177.6	178.8	-108.9	0	0	0	112.9	E612 V613 K618 G619 L620 V660 D662 F663 L666	E612-F616 PolarHBondContact O-N 2.93Å; V613-F616 PolarHBondContact O-N 3.43Å; F616-K618 PolarHBondContact O-N 3.22Å; F616-G619 PolarHBondContact O-N 2.91Å; F616-L620 HydrophobicContact CD1-CD2 4.34Å; F616-L620 HydrophobicContact CE1-CD2 3.59Å; F616-L620 HydrophobicContact CE1-CG 4.3Å; F616-L620 HydrophobicContact CZ-CD2 3.85Å; F616-V660 HydrophobicContact CE1-CG1 4.25Å; F616-V660 VanDerWaalsContact CE1-O 3.3Å; F616-V660 WeakPolarHBondContact CE1-O 3.18Å; F616-D662 WeakPolarHBondContact CE1-O 3.46Å; F616-D662 WeakPolarHBondContact CZ-O 3.49Å; F616-F663 HydrophobicContact CD2-CZ 4.5Å; F616-F663 AromaticContact CE2-CD1 3.78Å; F616-F663 HydrophobicContact CE2-CD1 3.78Å; F616-F663 HydrophobicContact CE2-CD2 4.32Å; F616-F663 AromaticContact CE2-CE1 3.83Å; F616-F663 HydrophobicContact CE2-CE1 3.83Å; F616-F663 HydrophobicContact CE2-CE2 4.36Å; F616-F663 HydrophobicContact CE2-CG 4.04Å; F616-F663 HydrophobicContact CE2-CZ 4.12Å; F616-F663 HydrophobicContact CZ-CD1 4.42Å; F616-L666 HydrophobicContact CZ-CB 4.09Å; F616-L666 HydrophobicContact CZ-CD2 3.85Å
617	H	91.5	Very high	93.2	Very high	32 Å²	32	48.2 Å²	48.2	15%	0.148	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-27	179.5	-78.2	-178.5	0	0	0	114.3	Y525 T550 V613 G619 L620 V660	Y525-H617 AromaticContact CE1-CE1 3.76Å; Y525-H617 AromaticContact CE1-ND1 3.56Å; Y525-H617 AromaticContact CZ-ND1 3.7Å; Y525-H617 PolarHBondContact OH-ND1 2.95Å; T550-H617 PolarHBondContact OG1-CE1 2.8Å; V613-H617 VanDerWaalsContact CG1-CE1 3.46Å; V613-H617 WeakPolarHBondContact CG1-CE1 3.38Å; V613-H617 WeakPolarHBondContact CG1-NE2 3.3Å; V613-H617 WeakPolarHBondContact O-CB 3.46Å; V613-H617 VanDerWaalsContact O-CG 3.31Å; V613-H617 PolarHBondContact O-N 3Å; H617-G619 VanDerWaalsContact C-N 3.25Å; H617-G619 PolarHBondContact O-N 3.18Å; H617-L620 HydrophobicContact CB-CD1 4.45Å; H617-L620 PolarHBondContact O-N 3.42Å; H617-V660 PolarHBondContact CD2-O 2.93Å; H617-V660 PolarHBondContact NE2-O 3.13Å
618	K	88.9	Confident	93.3	Very high	157 Å²	157	46 Å²	46	68%	0.683	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-24.8	176.3	-66.1	165.3	-175.6	165.5	0	112.9	M614 A615 F616	M614-K618 WeakPolarHBondContact O-CD 3.22Å; M614-K618 VanDerWaalsContact O-CE 3.22Å; M614-K618 WeakPolarHBondContact O-CE 3.4Å; M614-K618 WeakPolarHBondContact O-CG 3.09Å; A615-K618 PolarHBondContact O-N 2.82Å; F616-K618 PolarHBondContact O-N 3.22Å
619	G	89.2	Confident	93.4	Very high	30 Å²	30	44.3 Å²	44.3	31%	0.309	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-27.4	178.7	0	0	0	0	0	114.6	F616 H617 R621 T622 L623	F616-G619 PolarHBondContact O-N 2.91Å; H617-G619 VanDerWaalsContact C-N 3.25Å; H617-G619 PolarHBondContact O-N 3.18Å; G619-R621 PolarHBondContact O-N 3.32Å; G619-R621 VanDerWaalsContact O-N 3.17Å; G619-T622 WeakPolarHBondContact O-CB 3.49Å; G619-T622 PolarHBondContact O-N 3.23Å; G619-L623 PolarHBondContact O-N 2.8Å
620	L	91.6	Very high	93.4	Very high	6 Å²	6	43 Å²	43	3%	0.031	22%	0.218	C	C	.	.	H	α-helix	trans	-45.8	-53.3	-168	-76.8	-179.8	0	0	0	114.1	F616 H617 T622 L623 I624 V660 L666	F616-L620 HydrophobicContact CD1-CD2 4.34Å; F616-L620 HydrophobicContact CE1-CD2 3.59Å; F616-L620 HydrophobicContact CE1-CG 4.3Å; F616-L620 HydrophobicContact CZ-CD2 3.85Å; H617-L620 HydrophobicContact CB-CD1 4.45Å; H617-L620 PolarHBondContact O-N 3.42Å; L620-T622 PolarHBondContact O-N 3.06Å; L620-T622 VanDerWaalsContact O-N 3.15Å; L620-L623 PolarHBondContact O-N 3.47Å; L620-L623 VanDerWaalsContact O-N 3.1Å; L620-I624 HydrophobicContact CB-CD1 4.28Å; L620-I624 VanDerWaalsContact O-CG1 3.27Å; L620-I624 WeakPolarHBondContact O-CG1 3.34Å; L620-I624 PolarHBondContact O-N 3.22Å; L620-V660 HydrophobicContact CD2-CG1 4.39Å; L620-L666 HydrophobicContact CD2-CD1 3.9Å; L620-L666 HydrophobicContact CD2-CD2 3.76Å; L620-L666 HydrophobicContact CD2-CG 4.36Å
621	R	92.4	Very high	93.4	Very high	154 Å²	154	43.1 Å²	43.1	58%	0.581	22%	0.219	S	C	*	.	H	α-helix	trans	-54.5	-38.1	-177.6	-170.5	-169	175.1	-173.3	-4.8	113	G619 A625 W652	G619-R621 PolarHBondContact O-N 3.32Å; G619-R621 VanDerWaalsContact O-N 3.17Å; R621-A625 VanDerWaalsContact O-CB 3.27Å; R621-A625 WeakPolarHBondContact O-CB 3.09Å; R621-A625 PolarHBondContact O-N 3.49Å; R621-W652 HydrophobicContact CB-CD2 4.25Å; R621-W652 HydrophobicContact CB-CH2 4.22Å; R621-W652 HydrophobicContact CB-CZ2 3.78Å; R621-W652 HydrophobicContact CG-CD2 4.1Å; R621-W652 HydrophobicContact CG-CE3 3.96Å; R621-W652 HydrophobicContact CG-CH2 3.85Å; R621-W652 HydrophobicContact CG-CZ2 3.92Å; R621-W652 HydrophobicContact CG-CZ3 3.85Å
622	T	94.6	Very high	93.4	Very high	85 Å²	85	42.7 Å²	42.7	52%	0.521	22%	0.22	S	C	.	.	H	α-helix	trans	-74.2	-33.7	-176.6	-53.6	0	0	0	0	111.9	G619 L620 G626	G619-T622 WeakPolarHBondContact O-CB 3.49Å; G619-T622 PolarHBondContact O-N 3.23Å; L620-T622 PolarHBondContact O-N 3.06Å; L620-T622 VanDerWaalsContact O-N 3.15Å; T622-G626 PolarHBondContact O-N 3.45Å; T622-G626 VanDerWaalsContact O-N 3.15Å
623	L	95.6	Very high	93.3	Very high	17 Å²	17	42.6 Å²	42.6	9%	0.089	22%	0.219	C	C	.	.	H	α-helix	trans	-71.8	-50.5	174.5	-61.1	173.2	0	0	0	110.4	G619 L620 A625 G626 V627 F663 L666 I865	G619-L623 PolarHBondContact O-N 2.8Å; L620-L623 PolarHBondContact O-N 3.47Å; L620-L623 VanDerWaalsContact O-N 3.1Å; L623-A625 VanDerWaalsContact C-N 3.33Å; L623-A625 PolarHBondContact O-N 2.85Å; L623-G626 WeakPolarHBondContact O-CA 3.46Å; L623-G626 PolarHBondContact O-N 3.29Å; L623-V627 PolarHBondContact O-N 2.84Å; L623-F663 HydrophobicContact CD1-CE1 3.99Å; L623-L666 HydrophobicContact CB-CD2 4.31Å; L623-L666 HydrophobicContact CD1-CD2 3.62Å; L623-I865 HydrophobicContact CB-CG2 4.48Å; L623-I865 HydrophobicContact CD2-CG2 4.35Å
624	I	95.4	Very high	93.3	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-57.9	-44.5	178.9	-62.4	164.8	0	0	0	111	L620 G626 V627 G628 L648 L649 W652 Y657 L666 L670	L620-I624 HydrophobicContact CB-CD1 4.28Å; L620-I624 VanDerWaalsContact O-CG1 3.27Å; L620-I624 WeakPolarHBondContact O-CG1 3.34Å; L620-I624 PolarHBondContact O-N 3.22Å; I624-G626 VanDerWaalsContact C-N 3.33Å; I624-G626 PolarHBondContact O-N 3.14Å; I624-V627 PolarHBondContact O-N 3Å; I624-G628 PolarHBondContact O-N 3.45Å; I624-L648 HydrophobicContact CG2-CB 3.82Å; I624-L649 HydrophobicContact CG2-CD2 4.3Å; I624-W652 HydrophobicContact CD1-CB 4Å; I624-W652 HydrophobicContact CD1-CG 3.96Å; I624-Y657 HydrophobicContact CD1-CD1 3.51Å; I624-Y657 HydrophobicContact CD1-CD2 4.32Å; I624-Y657 HydrophobicContact CD1-CE1 3.67Å; I624-Y657 HydrophobicContact CD1-CE2 4.48Å; I624-Y657 HydrophobicContact CD1-CG 3.87Å; I624-Y657 HydrophobicContact CG1-CD1 4.27Å; I624-Y657 HydrophobicContact CG1-CE1 3.98Å; I624-L666 HydrophobicContact CG1-CD1 4.49Å; I624-L670 HydrophobicContact CG1-CD2 4.32Å
625	A	95.6	Very high	93.3	Very high	22 Å²	22	44.4 Å²	44.4	18%	0.182	23%	0.228	C	C	.	.	H	α-helix	trans	-63.2	-36.5	173.2	0	0	0	0	0	113	R621 L623 V627 G628 E629 L649	R621-A625 VanDerWaalsContact O-CB 3.27Å; R621-A625 WeakPolarHBondContact O-CB 3.09Å; R621-A625 PolarHBondContact O-N 3.49Å; L623-A625 VanDerWaalsContact C-N 3.33Å; L623-A625 PolarHBondContact O-N 2.85Å; A625-V627 VanDerWaalsContact C-N 3.34Å; A625-V627 PolarHBondContact O-N 3.4Å; A625-G628 PolarHBondContact O-N 3Å; A625-E629 PolarHBondContact O-N 3.29Å; A625-L649 HydrophobicContact CB-CD2 4.19Å
626	G	95.9	Very high	93.3	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-63.2	-36.4	175.8	0	0	0	0	0	113.3	T622 L623 I624 L630	T622-G626 PolarHBondContact O-N 3.45Å; T622-G626 VanDerWaalsContact O-N 3.15Å; L623-G626 WeakPolarHBondContact O-CA 3.46Å; L623-G626 PolarHBondContact O-N 3.29Å; I624-G626 VanDerWaalsContact C-N 3.33Å; I624-G626 PolarHBondContact O-N 3.14Å; G626-L630 VanDerWaalsContact O-CG 3.31Å; G626-L630 WeakPolarHBondContact O-CG 3.29Å; G626-L630 PolarHBondContact O-N 3.37Å; G626-L630 VanDerWaalsContact O-N 3.09Å
627	V	95.8	Very high	93.1	Very high	1 Å²	1	42 Å²	42	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-65.2	-44.9	174.3	179.9	0	0	0	0	111.3	L623 I624 A625 E629 L630 L631 L648 L670 L674 V685 I865	L623-V627 PolarHBondContact O-N 2.84Å; I624-V627 PolarHBondContact O-N 3Å; A625-V627 VanDerWaalsContact C-N 3.34Å; A625-V627 PolarHBondContact O-N 3.4Å; V627-E629 PolarHBondContact O-N 2.89Å; V627-L630 PolarHBondContact O-N 3.44Å; V627-L631 PolarHBondContact O-N 3.27Å; V627-L648 HydrophobicContact CG1-CD1 4.3Å; V627-L670 HydrophobicContact CG2-CD1 4.04Å; V627-L670 HydrophobicContact CG2-CD2 4.28Å; V627-L674 HydrophobicContact CG1-CD1 4.02Å; V627-L674 HydrophobicContact CG1-CD2 3.87Å; V627-L674 HydrophobicContact CG1-CG 4.46Å; V627-V685 HydrophobicContact CG1-CG2 4.42Å; V627-V685 HydrophobicContact CG2-CG2 4.43Å; V627-I865 HydrophobicContact CG2-CD1 3.69Å; V627-I865 HydrophobicContact CG2-CG1 3.99Å; V627-I865 HydrophobicContact CG2-CG2 3.91Å
628	G	94.9	Very high	93	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.4	-47.1	175.8	0	0	0	0	0	112.6	I624 A625 L630 L631 E632	I624-G628 PolarHBondContact O-N 3.45Å; A625-G628 PolarHBondContact O-N 3Å; G628-L630 VanDerWaalsContact C-N 3.33Å; G628-L630 PolarHBondContact O-N 3.46Å; G628-L631 PolarHBondContact O-N 3.32Å; G628-E632 WeakPolarHBondContact O-CG 3.16Å; G628-E632 PolarHBondContact O-N 3.01Å
629	E	95.1	Very high	93.1	Very high	78 Å²	78	45.8 Å²	45.8	36%	0.364	23%	0.228	S	C	.	.	H	α-helix	trans	-61.3	-37	176.4	-75.8	173.5	-141.6	0	0	113.3	A625 V627 Q633 R866	A625-E629 PolarHBondContact O-N 3.29Å; V627-E629 PolarHBondContact O-N 2.89Å; E629-Q633 WeakPolarHBondContact O-CB 3.37Å; E629-Q633 VanDerWaalsContact O-CG 3.27Å; E629-Q633 WeakPolarHBondContact O-CG 3.34Å; E629-Q633 PolarHBondContact O-N 3.34Å; E629-Q633 PolarHBondContact O-NE2 2.99Å; E629-R866 IonicContact OE1-CZ 3.93Å; E629-R866 IonicContact OE1-NH1 3.69Å; E629-R866 IonicContact OE1-NH2 3.91Å; E629-R866 PolarHBondContact OE1-NH2 3.04Å; E629-R866 IonicContact OE2-CZ 2.72Å; E629-R866 VanDerWaalsContact OE2-CZ 3.31Å; E629-R866 IonicContact OE2-NH1 2.62Å; E629-R866 PolarHBondContact OE2-NH1 3.46Å; E629-R866 IonicContact OE2-NH2 3.95Å; E629-R866 PolarHBondContact OE2-NH2 3.08Å; E629-R866 VanDerWaalsContact OE2-NH2 3.08Å
630	L	95.3	Very high	93.3	Very high	23 Å²	23	46.1 Å²	46.1	12%	0.12	22%	0.224	C	C	.	.	H	α-helix	trans	-69.5	-37.3	176.4	-73.6	171.8	0	0	0	112.2	G626 V627 G628 H634 Y863 I865 I874	G626-L630 VanDerWaalsContact O-CG 3.31Å; G626-L630 WeakPolarHBondContact O-CG 3.29Å; G626-L630 PolarHBondContact O-N 3.37Å; G626-L630 VanDerWaalsContact O-N 3.09Å; V627-L630 PolarHBondContact O-N 3.44Å; G628-L630 VanDerWaalsContact C-N 3.33Å; G628-L630 PolarHBondContact O-N 3.46Å; L630-H634 WeakPolarHBondContact O-CB 3.48Å; L630-H634 PolarHBondContact O-CD2 3.26Å; L630-H634 PolarHBondContact O-N 2.94Å; L630-Y863 HydrophobicContact CD2-CG 4.4Å; L630-I865 HydrophobicContact CD1-CG1 3.86Å; L630-I874 HydrophobicContact CB-CD1 3.8Å
631	L	94.2	Very high	93.3	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-51.1	172.3	-72.9	177.9	0	0	0	111.5	V627 G628 Q633 H634 Y635 A641 V644 L674 I683 I874	V627-L631 PolarHBondContact O-N 3.27Å; G628-L631 PolarHBondContact O-N 3.32Å; L631-Q633 PolarHBondContact O-N 3.18Å; L631-H634 PolarHBondContact O-N 3.01Å; L631-Y635 HydrophobicContact CD2-CG 4.42Å; L631-Y635 WeakPolarHBondContact O-CB 3.12Å; L631-Y635 PolarHBondContact O-N 2.84Å; L631-A641 HydrophobicContact CB-CB 3.91Å; L631-V644 HydrophobicContact CD1-CB 3.98Å; L631-V644 HydrophobicContact CD1-CG1 3.51Å; L631-L674 HydrophobicContact CD1-CD2 3.62Å; L631-L674 HydrophobicContact CG-CD2 4.41Å; L631-I683 HydrophobicContact CD2-CD1 4.18Å; L631-I683 HydrophobicContact CD2-CG2 4.22Å; L631-I874 HydrophobicContact CD2-CD1 4.19Å; L631-I874 HydrophobicContact CD2-CG1 4.3Å; L631-I874 HydrophobicContact CD2-CG2 4.25Å
632	E	92.9	Very high	93.4	Very high	72 Å²	72	41.5 Å²	41.5	34%	0.336	21%	0.211	S	C	.	.	H	α-helix	trans	-59.5	-33.3	-177.6	-71.1	175.4	-142.1	0	0	111.9	G628 A641 I642 S645 R796	G628-E632 WeakPolarHBondContact O-CG 3.16Å; G628-E632 PolarHBondContact O-N 3.01Å; E632-A641 HydrophobicContact CG-CB 4.27Å; E632-I642 HydrophobicContact CG-CG1 4.06Å; E632-S645 WeakPolarHBondContact OE1-CB 3.42Å; E632-S645 PolarHBondContact OE1-OG 2.82Å; E632-R796 PolarHBondContact O-NH2 3.17Å
633	Q	92.3	Very high	93.3	Very high	111 Å²	111	41.6 Å²	41.6	52%	0.519	21%	0.208	S	C	.	.	H	α-helix	trans	-77.3	-48.5	175.4	-71.5	171.6	65.6	0	0	113.3	E629 L631 R796	E629-Q633 WeakPolarHBondContact O-CB 3.37Å; E629-Q633 VanDerWaalsContact O-CG 3.27Å; E629-Q633 WeakPolarHBondContact O-CG 3.34Å; E629-Q633 PolarHBondContact O-N 3.34Å; E629-Q633 PolarHBondContact O-NE2 2.99Å; L631-Q633 PolarHBondContact O-N 3.18Å; Q633-R796 WeakPolarHBondContact O-CG 3.39Å; Q633-R796 PolarHBondContact O-NE 3.14Å
634	H	92.8	Very high	93.3	Very high	46 Å²	46	40.8 Å²	40.8	21%	0.213	20%	0.204	C	C	.	.	H	α-helix	trans	-110.9	-20.6	-162.9	-57.7	-47.7	0	0	0	115.8	L630 L631 Y863 I874 N876	L630-H634 WeakPolarHBondContact O-CB 3.48Å; L630-H634 PolarHBondContact O-CD2 3.26Å; L630-H634 PolarHBondContact O-N 2.94Å; L631-H634 PolarHBondContact O-N 3.01Å; H634-Y863 HydrophobicContact CB-CD2 4.41Å; H634-Y863 HydrophobicContact CB-CE1 4.43Å; H634-Y863 HydrophobicContact CB-CE2 3.7Å; H634-Y863 AromaticContact CD2-CD1 3.51Å; H634-Y863 AromaticContact CD2-CD2 3.93Å; H634-Y863 AromaticContact CD2-CE1 3.41Å; H634-Y863 VanDerWaalsContact CD2-CE1 3.41Å; H634-Y863 WeakPolarHBondContact CD2-CE1 3.04Å; H634-Y863 AromaticContact CD2-CE2 3.83Å; H634-Y863 AromaticContact CD2-CG 3.78Å; H634-Y863 AromaticContact CD2-CZ 3.57Å; H634-Y863 AromaticContact CE1-CE1 3.78Å; H634-Y863 AromaticContact CG-CE1 3.66Å; H634-Y863 AromaticContact CG-CE2 3.8Å; H634-Y863 AromaticContact CG-CZ 3.42Å; H634-Y863 VanDerWaalsContact CG-CZ 3.42Å; H634-Y863 AromaticContact ND1-CE1 3.89Å; H634-Y863 AromaticContact ND1-CZ 3.88Å; H634-Y863 AromaticContact NE2-CD1 3.59Å; H634-Y863 AromaticContact NE2-CE1 3.49Å; H634-Y863 WeakPolarHBondContact NE2-CE1 3.25Å; H634-I874 HydrophobicContact CB-CG2 4.23Å; H634-N876 WeakPolarHBondContact O-CA 3.47Å; H634-N876 WeakPolarHBondContact O-CB 3.43Å
635	Y	93.3	Very high	93.3	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.008	21%	0.207	C	C	.	.			trans	-72.8	143.9	-179.3	-172.7	-130.1	0	0	0	111.7	L631 I637 V640 A641 D680 I683 R796 I874 P875	L631-Y635 HydrophobicContact CD2-CG 4.42Å; L631-Y635 WeakPolarHBondContact O-CB 3.12Å; L631-Y635 PolarHBondContact O-N 2.84Å; Y635-I637 VanDerWaalsContact C-N 3.28Å; Y635-I637 HydrophobicContact CD1-CB 4.18Å; Y635-I637 WeakPolarHBondContact CD1-O 3.5Å; Y635-I637 HydrophobicContact CE1-CB 3.72Å; Y635-I637 HydrophobicContact CE1-CG1 4.26Å; Y635-I637 PolarHBondContact O-N 3.14Å; Y635-V640 HydrophobicContact CE1-CB 4.07Å; Y635-V640 HydrophobicContact CE1-CG1 3.92Å; Y635-A641 HydrophobicContact CD1-CB 4.18Å; Y635-D680 WeakPolarHBondContact OH-CB 3.47Å; Y635-D680 PolarHBondContact OH-OD2 2.93Å; Y635-I683 HydrophobicContact CD2-CD1 4.09Å; Y635-I683 HydrophobicContact CE1-CD1 4.29Å; Y635-I683 HydrophobicContact CE2-CD1 3.75Å; Y635-I683 HydrophobicContact CE2-CG1 4.18Å; Y635-R796 WeakPolarHBondContact O-CD 3.46Å; Y635-R796 WeakPolarHBondContact O-CG 3.34Å; Y635-I874 HydrophobicContact CD2-CG2 4.06Å; Y635-I874 HydrophobicContact CG-CG2 4.35Å; Y635-P875 VanDerWaalsContact CD2-O 3.29Å; Y635-P875 WeakPolarHBondContact CD2-O 3.39Å; Y635-P875 HydrophobicContact CE2-CB 4.3Å; Y635-P875 HydrophobicContact CE2-CG 4.44Å
636	A	89.3	Confident	93.2	Very high	5 Å²	5	45.9 Å²	45.9	4%	0.041	23%	0.225	C	C	.	.	S	Bend	trans	-72.8	-14.2	-174.6	0	0	0	0	0	115	P875 I878	A636-P875 PolarHBondContact N-O 3.14Å; A636-I878 HydrophobicContact CB-CB 4.35Å; A636-I878 HydrophobicContact CB-CG1 4.21Å; A636-I878 HydrophobicContact CB-CG2 3.65Å
637	I	89.8	Confident	93.2	Very high	38 Å²	38	47.7 Å²	47.7	20%	0.195	24%	0.236	C	C	.	.			trans	-122.6	93.3	-178.2	-50.1	179.4	0	0	0	109.6	Y635 E639 V640 A641 I878 F890	Y635-I637 VanDerWaalsContact C-N 3.28Å; Y635-I637 HydrophobicContact CD1-CB 4.18Å; Y635-I637 WeakPolarHBondContact CD1-O 3.5Å; Y635-I637 HydrophobicContact CE1-CB 3.72Å; Y635-I637 HydrophobicContact CE1-CG1 4.26Å; Y635-I637 PolarHBondContact O-N 3.14Å; I637-E639 PolarHBondContact O-N 2.99Å; I637-V640 HydrophobicContact CB-CB 4.24Å; I637-V640 HydrophobicContact CB-CG2 4.35Å; I637-V640 HydrophobicContact CG2-CB 3.95Å; I637-V640 HydrophobicContact CG2-CG2 3.62Å; I637-V640 PolarHBondContact O-N 2.92Å; I637-A641 PolarHBondContact O-N 2.82Å; I637-I878 HydrophobicContact CD1-CG2 4.27Å; I637-I878 HydrophobicContact CG1-CD1 4.14Å; I637-I878 HydrophobicContact CG1-CG2 4.16Å; I637-F890 HydrophobicContact CD1-CE2 4.42Å; I637-F890 HydrophobicContact CD1-CZ 3.75Å
638	E	88.9	Confident	93.2	Very high	100 Å²	100	47.7 Å²	47.7	47%	0.467	24%	0.236	S	C	.	.	H	α-helix	trans	-61.4	-41.2	-171.4	-179.7	159.1	-147.1	0	0	114.1	V640 A641 I642 R796	E638-V640 VanDerWaalsContact C-N 3.31Å; E638-V640 PolarHBondContact O-N 3.3Å; E638-A641 PolarHBondContact O-N 3.23Å; E638-I642 HydrophobicContact CG-CD1 3.99Å; E638-I642 WeakPolarHBondContact O-CG1 3.21Å; E638-I642 PolarHBondContact O-N 3.07Å; E638-R796 VanDerWaalsContact CD-NH1 3.27Å; E638-R796 IonicContact OE1-CZ 3.9Å; E638-R796 IonicContact OE1-NH1 2.7Å; E638-R796 IonicContact OE1-NH2 3.89Å; E638-R796 PolarHBondContact OE1-NH2 2.91Å; E638-R796 IonicContact OE2-CZ 2.81Å; E638-R796 IonicContact OE2-NH1 2.71Å; E638-R796 PolarHBondContact OE2-NH1 2.72Å; E638-R796 IonicContact OE2-NH2 3.74Å; E638-R796 PolarHBondContact OE2-NH2 2.99Å
639	E	90.8	Very high	93.1	Very high	167 Å²	167	50 Å²	50	78%	0.78	25%	0.248	S	C	*	.	H	α-helix	trans	-60.9	-40.3	176.6	-176.6	173.8	-165.8	0	0	112	I637 N643	I637-E639 PolarHBondContact O-N 2.99Å; E639-N643 PolarHBondContact O-N 2.83Å; E639-N643 VanDerWaalsContact O-N 3.16Å
640	V	92.3	Very high	93	Very high	37 Å²	37	48.3 Å²	48.3	22%	0.224	24%	0.243	C	C	.	.	H	α-helix	trans	-70.9	-42.4	176.9	174.1	0	0	0	0	110.7	Y635 I637 E638 I642 N643 V644	Y635-V640 HydrophobicContact CE1-CB 4.07Å; Y635-V640 HydrophobicContact CE1-CG1 3.92Å; I637-V640 HydrophobicContact CB-CB 4.24Å; I637-V640 HydrophobicContact CB-CG2 4.35Å; I637-V640 HydrophobicContact CG2-CB 3.95Å; I637-V640 HydrophobicContact CG2-CG2 3.62Å; I637-V640 PolarHBondContact O-N 2.92Å; E638-V640 VanDerWaalsContact C-N 3.31Å; E638-V640 PolarHBondContact O-N 3.3Å; V640-I642 VanDerWaalsContact C-N 3.35Å; V640-I642 PolarHBondContact O-N 3.41Å; V640-N643 PolarHBondContact O-N 2.71Å; V640-V644 HydrophobicContact CG1-CG2 3.97Å; V640-V644 WeakPolarHBondContact O-CB 3.49Å; V640-V644 WeakPolarHBondContact O-CG2 3.3Å; V640-V644 PolarHBondContact O-N 3.33Å
641	A	92.8	Very high	92.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-56	-47.8	176.2	0	0	0	0	0	112.5	L631 E632 Y635 I637 E638 N643 V644 S645	L631-A641 HydrophobicContact CB-CB 3.91Å; E632-A641 HydrophobicContact CG-CB 4.27Å; Y635-A641 HydrophobicContact CD1-CB 4.18Å; I637-A641 PolarHBondContact O-N 2.82Å; E638-A641 PolarHBondContact O-N 3.23Å; A641-N643 PolarHBondContact O-N 3Å; A641-V644 PolarHBondContact O-N 3.41Å; A641-S645 VanDerWaalsContact O-CB 3.24Å; A641-S645 WeakPolarHBondContact O-CB 3.38Å; A641-S645 PolarHBondContact O-N 3.31Å
642	I	93.3	Very high	92.6	Very high	64 Å²	64	52.6 Å²	52.6	33%	0.328	26%	0.258	S	S	.	.	H	α-helix	trans	-64	-40.3	179.2	-66.8	165.7	0	0	0	111	E632 E638 V640 Q646	E632-I642 HydrophobicContact CG-CG1 4.06Å; E638-I642 HydrophobicContact CG-CD1 3.99Å; E638-I642 WeakPolarHBondContact O-CG1 3.21Å; E638-I642 PolarHBondContact O-N 3.07Å; V640-I642 VanDerWaalsContact C-N 3.35Å; V640-I642 PolarHBondContact O-N 3.41Å; I642-Q646 VanDerWaalsContact CG2-NE2 3.32Å; I642-Q646 WeakPolarHBondContact O-CG 3.25Å; I642-Q646 PolarHBondContact O-N 3.05Å
643	N	94.5	Very high	92.3	Very high	86 Å²	86	57 Å²	57	46%	0.46	27%	0.272	S	S	.	.	H	α-helix	trans	-64.5	-50.1	176.2	-175.2	48.5	0	0	0	111.6	E639 V640 A641 S645 Q646 V647	E639-N643 PolarHBondContact O-N 2.83Å; E639-N643 VanDerWaalsContact O-N 3.16Å; V640-N643 PolarHBondContact O-N 2.71Å; A641-N643 PolarHBondContact O-N 3Å; N643-S645 PolarHBondContact O-N 2.65Å; N643-Q646 PolarHBondContact O-N 3.34Å; N643-Q646 VanDerWaalsContact O-N 3.14Å; N643-V647 WeakPolarHBondContact O-CG2 3.42Å; N643-V647 PolarHBondContact O-N 3.06Å
644	V	94.5	Very high	91.9	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-59.2	-45.7	179.3	175.2	0	0	0	0	111.1	L631 V640 A641 Q646 V647 L648 L674 S677	L631-V644 HydrophobicContact CD1-CB 3.98Å; L631-V644 HydrophobicContact CD1-CG1 3.51Å; V640-V644 HydrophobicContact CG1-CG2 3.97Å; V640-V644 WeakPolarHBondContact O-CB 3.49Å; V640-V644 WeakPolarHBondContact O-CG2 3.3Å; V640-V644 PolarHBondContact O-N 3.33Å; A641-V644 PolarHBondContact O-N 3.41Å; V644-Q646 VanDerWaalsContact C-N 3.29Å; V644-Q646 PolarHBondContact O-N 2.98Å; V644-V647 PolarHBondContact O-N 3.31Å; V644-V647 VanDerWaalsContact O-N 3.14Å; V644-L648 HydrophobicContact CG1-CD1 4.03Å; V644-L648 HydrophobicContact CG1-CG 4.27Å; V644-L648 WeakPolarHBondContact O-CG 3.47Å; V644-L648 PolarHBondContact O-N 2.94Å; V644-L674 HydrophobicContact CG1-CD2 3.74Å; V644-S677 WeakPolarHBondContact CG2-O 3.45Å
645	S	94.4	Very high	91.5	Very high	12 Å²	12	56.1 Å²	56.1	8%	0.084	27%	0.271	C	S	.	.	H	α-helix	trans	-54	-43.3	174.7	-178.7	0	0	0	0	112.5	E632 A641 N643 L649	E632-S645 WeakPolarHBondContact OE1-CB 3.42Å; E632-S645 PolarHBondContact OE1-OG 2.82Å; A641-S645 VanDerWaalsContact O-CB 3.24Å; A641-S645 WeakPolarHBondContact O-CB 3.38Å; A641-S645 PolarHBondContact O-N 3.31Å; N643-S645 PolarHBondContact O-N 2.65Å; S645-L649 WeakPolarHBondContact O-CG 3.29Å; S645-L649 PolarHBondContact O-N 3.29Å
646	Q	94.4	Very high	91.3	Very high	117 Å²	117	59.3 Å²	59.3	55%	0.547	29%	0.287	S	S	.	.	H	α-helix	trans	-71.2	-38.6	175.7	-69.4	175.5	39.2	0	0	113.1	I642 N643 V644 T650	I642-Q646 VanDerWaalsContact CG2-NE2 3.32Å; I642-Q646 WeakPolarHBondContact O-CG 3.25Å; I642-Q646 PolarHBondContact O-N 3.05Å; N643-Q646 PolarHBondContact O-N 3.34Å; N643-Q646 VanDerWaalsContact O-N 3.14Å; V644-Q646 VanDerWaalsContact C-N 3.29Å; V644-Q646 PolarHBondContact O-N 2.98Å; Q646-T650 WeakPolarHBondContact O-CB 3.24Å; Q646-T650 PolarHBondContact O-N 2.9Å; Q646-T650 VanDerWaalsContact O-N 3.1Å; Q646-T650 PolarHBondContact O-OG1 3.07Å
647	V	95.7	Very high	91.4	Very high	40 Å²	40	59.3 Å²	59.3	24%	0.242	29%	0.286	C	S	.	.	H	α-helix	trans	-64.4	-48.9	177.1	171.7	0	0	0	0	110.9	N643 V644 L649 T650 K651 S677	N643-V647 WeakPolarHBondContact O-CG2 3.42Å; N643-V647 PolarHBondContact O-N 3.06Å; V644-V647 PolarHBondContact O-N 3.31Å; V644-V647 VanDerWaalsContact O-N 3.14Å; V647-L649 VanDerWaalsContact C-N 3.34Å; V647-L649 PolarHBondContact O-N 3.09Å; V647-T650 CarbonylContact O-C 3.58Å; V647-T650 WeakPolarHBondContact O-CA 3.24Å; V647-T650 WeakPolarHBondContact O-CB 3.45Å; V647-T650 PolarHBondContact O-N 3.38Å; V647-K651 HydrophobicContact CG1-CD 4.28Å; V647-K651 HydrophobicContact CG1-CG 4.17Å; V647-K651 PolarHBondContact O-N 2.66Å; V647-S677 WeakPolarHBondContact CG1-OG 3.1Å
648	L	95	Very high	91.3	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-55.2	-47.3	177.9	-71.1	173.1	0	0	0	112.1	I624 V627 V644 T650 W652 Y657 L670 D673 L674	I624-L648 HydrophobicContact CG2-CB 3.82Å; V627-L648 HydrophobicContact CG1-CD1 4.3Å; V644-L648 HydrophobicContact CG1-CD1 4.03Å; V644-L648 HydrophobicContact CG1-CG 4.27Å; V644-L648 WeakPolarHBondContact O-CG 3.47Å; V644-L648 PolarHBondContact O-N 2.94Å; L648-T650 PolarHBondContact O-N 3.21Å; L648-W652 WeakPolarHBondContact O-CB 3.26Å; L648-W652 PolarHBondContact O-N 2.96Å; L648-Y657 WeakPolarHBondContact CD2-OH 3.05Å; L648-L670 HydrophobicContact CD2-CD2 4.15Å; L648-D673 HydrophobicContact CD2-CB 3.54Å; L648-L674 HydrophobicContact CD1-CD2 3.98Å
649	L	94.2	Very high	91.4	Very high	48 Å²	48	56.7 Å²	56.7	25%	0.251	28%	0.277	S	S	.	.	H	α-helix	trans	-70.1	-14.3	176.3	-69.5	175.3	0	0	0	113.5	I624 A625 S645 V647 R653	I624-L649 HydrophobicContact CG2-CD2 4.3Å; A625-L649 HydrophobicContact CB-CD2 4.19Å; S645-L649 WeakPolarHBondContact O-CG 3.29Å; S645-L649 PolarHBondContact O-N 3.29Å; V647-L649 VanDerWaalsContact C-N 3.34Å; V647-L649 PolarHBondContact O-N 3.09Å; L649-R653 WeakPolarHBondContact O-CG 3.43Å; L649-R653 PolarHBondContact O-NE 3.45Å; L649-R653 PolarHBondContact O-NH2 3.3Å
650	T	92.6	Very high	91.6	Very high	43 Å²	43	48.9 Å²	48.9	26%	0.264	24%	0.241	S	C	.	.	H	α-helix	trans	-87.7	-51.9	174	-54.9	0	0	0	0	110.5	Q646 V647 L648 W652 R653 E654	Q646-T650 WeakPolarHBondContact O-CB 3.24Å; Q646-T650 PolarHBondContact O-N 2.9Å; Q646-T650 VanDerWaalsContact O-N 3.1Å; Q646-T650 PolarHBondContact O-OG1 3.07Å; V647-T650 CarbonylContact O-C 3.58Å; V647-T650 WeakPolarHBondContact O-CA 3.24Å; V647-T650 WeakPolarHBondContact O-CB 3.45Å; V647-T650 PolarHBondContact O-N 3.38Å; L648-T650 PolarHBondContact O-N 3.21Å; T650-W652 PolarHBondContact O-N 3.37Å; T650-R653 WeakPolarHBondContact O-CA 3.38Å; T650-R653 WeakPolarHBondContact O-CB 3.13Å; T650-R653 PolarHBondContact O-N 3.31Å; T650-R653 PolarHBondContact OG1-NH2 2.95Å; T650-E654 WeakPolarHBondContact CG2-OE1 3.25Å; T650-E654 PolarHBondContact O-N 3.24Å
651	K	91.5	Very high	91.7	Very high	35 Å²	35	47.5 Å²	47.5	15%	0.152	23%	0.232	C	C	.	.	H	α-helix	trans	-50.2	-41.5	170.9	-70.4	-168.3	158.1	179.4	0	111.6	V647 E654 G655 L656 Y657 D673 E676	V647-K651 HydrophobicContact CG1-CD 4.28Å; V647-K651 HydrophobicContact CG1-CG 4.17Å; V647-K651 PolarHBondContact O-N 2.66Å; K651-E654 PolarHBondContact O-N 2.75Å; K651-G655 PolarHBondContact O-N 2.71Å; K651-L656 HydrophobicContact CB-CB 4.32Å; K651-L656 HydrophobicContact CB-CD1 3.98Å; K651-L656 HydrophobicContact CD-CD1 4.35Å; K651-L656 HydrophobicContact CG-CD1 3.86Å; K651-L656 WeakPolarHBondContact O-CB 3.42Å; K651-L656 PolarHBondContact O-N 3.45Å; K651-L656 VanDerWaalsContact O-N 3.07Å; K651-Y657 HydrophobicContact CB-CD2 4.41Å; K651-Y657 HydrophobicContact CB-CE2 3.93Å; K651-D673 HydrophobicContact CD-CB 4.4Å; K651-D673 VanDerWaalsContact CD-CG 3.42Å; K651-D673 WeakPolarHBondContact CD-OD1 3.36Å; K651-D673 WeakPolarHBondContact CD-OD2 3.43Å; K651-D673 VanDerWaalsContact NZ-CG 3.27Å; K651-D673 IonicContact NZ-OD1 2.81Å; K651-D673 PolarHBondContact NZ-OD1 3.19Å; K651-D673 IonicContact NZ-OD2 2.61Å; K651-E676 IonicContact NZ-OE2 2.67Å; K651-E676 PolarHBondContact NZ-OE2 3.07Å
652	W	89.9	Confident	91.7	Very high	79 Å²	79	50.1 Å²	50.1	30%	0.299	25%	0.246	S	C	.	.	H	α-helix	trans	-63.3	-43.3	172.9	174.9	73.6	0	0	0	114.1	R621 I624 L648 T650 E654 G655 Y657	R621-W652 HydrophobicContact CB-CD2 4.25Å; R621-W652 HydrophobicContact CB-CH2 4.22Å; R621-W652 HydrophobicContact CB-CZ2 3.78Å; R621-W652 HydrophobicContact CG-CD2 4.1Å; R621-W652 HydrophobicContact CG-CE3 3.96Å; R621-W652 HydrophobicContact CG-CH2 3.85Å; R621-W652 HydrophobicContact CG-CZ2 3.92Å; R621-W652 HydrophobicContact CG-CZ3 3.85Å; I624-W652 HydrophobicContact CD1-CB 4Å; I624-W652 HydrophobicContact CD1-CG 3.96Å; L648-W652 WeakPolarHBondContact O-CB 3.26Å; L648-W652 PolarHBondContact O-N 2.96Å; T650-W652 PolarHBondContact O-N 3.37Å; W652-E654 VanDerWaalsContact C-N 3.29Å; W652-E654 PolarHBondContact O-N 2.84Å; W652-G655 PolarHBondContact O-N 3.05Å; W652-Y657 HydrophobicContact CB-CD2 4.24Å
653	R	86.3	Confident	91.7	Very high	166 Å²	166	50.5 Å²	50.5	63%	0.626	25%	0.246	S	C	*	.	H	α-helix	trans	-68	-29	178.9	-84.9	177.3	-73.3	157.6	3	112.9	L649 T650 G655	L649-R653 WeakPolarHBondContact O-CG 3.43Å; L649-R653 PolarHBondContact O-NE 3.45Å; L649-R653 PolarHBondContact O-NH2 3.3Å; T650-R653 WeakPolarHBondContact O-CA 3.38Å; T650-R653 WeakPolarHBondContact O-CB 3.13Å; T650-R653 PolarHBondContact O-N 3.31Å; T650-R653 PolarHBondContact OG1-NH2 2.95Å; R653-G655 VanDerWaalsContact C-N 3.32Å
654	E	83.8	Confident	91.5	Very high	128 Å²	128	53.6 Å²	53.6	60%	0.598	26%	0.258	S	S	*	.	H	α-helix	trans	-83.8	-8.9	180	-70.6	166	167.9	0	0	112.6	T650 K651 W652	T650-E654 WeakPolarHBondContact CG2-OE1 3.25Å; T650-E654 PolarHBondContact O-N 3.24Å; K651-E654 PolarHBondContact O-N 2.75Å; W652-E654 VanDerWaalsContact C-N 3.29Å; W652-E654 PolarHBondContact O-N 2.84Å
655	G	84.3	Confident	91.5	Very high	10 Å²	10	55.1 Å²	55.1	10%	0.103	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.5	0.9	173.5	0	0	0	0	0	115.1	K651 W652 R653 Y657 R658	K651-G655 PolarHBondContact O-N 2.71Å; W652-G655 PolarHBondContact O-N 3.05Å; R653-G655 VanDerWaalsContact C-N 3.32Å; G655-Y657 PolarHBondContact O-N 3.07Å; G655-R658 WeakPolarHBondContact O-CB 3.37Å; G655-R658 VanDerWaalsContact O-CG 3.3Å; G655-R658 WeakPolarHBondContact O-CG 3.42Å; G655-R658 PolarHBondContact O-N 3.35Å
656	L	88.4	Confident	91.5	Very high	69 Å²	69	54.6 Å²	54.6	36%	0.361	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-2.7	-175.5	-54.4	-178.1	0	0	0	114.6	S547 K651	S547-L656 WeakPolarHBondContact OG-CD2 3.2Å; K651-L656 HydrophobicContact CB-CB 4.32Å; K651-L656 HydrophobicContact CB-CD1 3.98Å; K651-L656 HydrophobicContact CD-CD1 4.35Å; K651-L656 HydrophobicContact CG-CD1 3.86Å; K651-L656 WeakPolarHBondContact O-CB 3.42Å; K651-L656 PolarHBondContact O-N 3.45Å; K651-L656 VanDerWaalsContact O-N 3.07Å
657	Y	91.4	Very high	91.6	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.016	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	9.7	173.6	-79	-103.9	0	0	0	113	I624 L648 K651 W652 G655 V660 L666 Q669 L670 D673	I624-Y657 HydrophobicContact CD1-CD1 3.51Å; I624-Y657 HydrophobicContact CD1-CD2 4.32Å; I624-Y657 HydrophobicContact CD1-CE1 3.67Å; I624-Y657 HydrophobicContact CD1-CE2 4.48Å; I624-Y657 HydrophobicContact CD1-CG 3.87Å; I624-Y657 HydrophobicContact CG1-CD1 4.27Å; I624-Y657 HydrophobicContact CG1-CE1 3.98Å; L648-Y657 WeakPolarHBondContact CD2-OH 3.05Å; K651-Y657 HydrophobicContact CB-CD2 4.41Å; K651-Y657 HydrophobicContact CB-CE2 3.93Å; W652-Y657 HydrophobicContact CB-CD2 4.24Å; G655-Y657 PolarHBondContact O-N 3.07Å; Y657-V660 HydrophobicContact CD1-CG2 4.09Å; Y657-V660 WeakPolarHBondContact O-CB 3.34Å; Y657-V660 PolarHBondContact O-N 2.64Å; Y657-L666 HydrophobicContact CD1-CD1 3.98Å; Y657-L666 HydrophobicContact CE1-CD1 3.87Å; Y657-Q669 HydrophobicContact CE1-CG 4.17Å; Y657-L670 HydrophobicContact CE1-CD2 4.23Å; Y657-L670 HydrophobicContact CE1-CG 4.37Å; Y657-D673 VanDerWaalsContact CE2-OD2 3.27Å; Y657-D673 WeakPolarHBondContact CE2-OD2 3.46Å; Y657-D673 VanDerWaalsContact CZ-OD2 3.25Å; Y657-D673 PolarHBondContact OH-OD2 2.66Å
658	R	89.1	Confident	91.5	Very high	36 Å²	36	50.6 Å²	50.6	14%	0.136	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-24.3	-179.6	-77.4	-179.1	-175.5	-105	-18	114.4	S520 H522 S547 C548 T550 G655 V660	S520-R658 PolarHBondContact O-NH2 3.1Å; H522-R658 PolarHBondContact O-NH1 2.62Å; H522-R658 PolarHBondContact O-NH2 2.92Å; S547-R658 WeakPolarHBondContact O-CD 3.41Å; C548-R658 PolarHBondContact O-NH1 2.58Å; T550-R658 WeakPolarHBondContact CB-O 3.49Å; T550-R658 VanDerWaalsContact CG2-O 3.25Å; T550-R658 WeakPolarHBondContact CG2-O 3.48Å; T550-R658 PolarHBondContact OG1-O 2.73Å; G655-R658 WeakPolarHBondContact O-CB 3.37Å; G655-R658 VanDerWaalsContact O-CG 3.3Å; G655-R658 WeakPolarHBondContact O-CG 3.42Å; G655-R658 PolarHBondContact O-N 3.35Å; R658-V660 PolarHBondContact O-N 3.07Å
659	S	91.1	Very high	91.5	Very high	48 Å²	48	53 Å²	53	34%	0.336	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-0.7	173	49.4	0	0	0	0	113.4	D598 V661	D598-S659 VanDerWaalsContact OD1-CB 3.25Å; D598-S659 WeakPolarHBondContact OD1-CB 3.36Å; S659-V661 PolarHBondContact O-N 3.27Å
660	V	93.8	Very high	91.6	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.018	25%	0.251	C	S	.	.			trans	-94.4	94.3	-172	-175.2	0	0	0	0	110.2	F616 H617 L620 Y657 R658 L666 Q669	F616-V660 HydrophobicContact CE1-CG1 4.25Å; F616-V660 VanDerWaalsContact CE1-O 3.3Å; F616-V660 WeakPolarHBondContact CE1-O 3.18Å; H617-V660 PolarHBondContact CD2-O 2.93Å; H617-V660 PolarHBondContact NE2-O 3.13Å; L620-V660 HydrophobicContact CD2-CG1 4.39Å; Y657-V660 HydrophobicContact CD1-CG2 4.09Å; Y657-V660 WeakPolarHBondContact O-CB 3.34Å; Y657-V660 PolarHBondContact O-N 2.64Å; R658-V660 PolarHBondContact O-N 3.07Å; V660-L666 HydrophobicContact CG1-CB 3.49Å; V660-L666 VanDerWaalsContact CG1-CB 3.49Å; V660-L666 HydrophobicContact CG1-CD1 3.95Å; V660-L666 HydrophobicContact CG1-CG 4.28Å; V660-Q669 HydrophobicContact CG2-CB 4.06Å; V660-Q669 HydrophobicContact CG2-CG 4.18Å
661	V	94.3	Very high	91.8	Very high	7 Å²	7	50 Å²	50	4%	0.042	25%	0.246	C	C	.	.			trans	-95.7	-7.3	-164.9	-64.4	0	0	0	0	115.2	T550 D598 A599 R609 V613 S659 S665	T550-V661 HydrophobicContact CG2-CG1 3.82Å; D598-V661 HydrophobicContact CB-CG1 3.91Å; D598-V661 VanDerWaalsContact O-CG2 3.31Å; D598-V661 WeakPolarHBondContact O-CG2 3.29Å; A599-V661 HydrophobicContact CB-CB 4.09Å; A599-V661 HydrophobicContact CB-CG1 3.93Å; A599-V661 HydrophobicContact CB-CG2 4.07Å; R609-V661 PolarHBondContact NH2-O 3.05Å; V613-V661 HydrophobicContact CG1-CB 4.32Å; V613-V661 HydrophobicContact CG1-CG1 4.01Å; V613-V661 HydrophobicContact CG2-CB 3.83Å; V613-V661 HydrophobicContact CG2-CG1 4.05Å; S659-V661 PolarHBondContact O-N 3.27Å; V661-S665 PolarHBondContact N-OG 2.66Å
662	D	92.8	Very high	91.9	Very high	56 Å²	56	51.9 Å²	51.9	30%	0.299	26%	0.257	S	S	.	.	S	Bend	trans	-162.5	-177.3	-179.8	52	48	0	0	0	112.6	R609 F616 E664 S665 L666	R609-D662 IonicContact NH2-OD2 2.68Å; F616-D662 WeakPolarHBondContact CE1-O 3.46Å; F616-D662 WeakPolarHBondContact CZ-O 3.49Å; D662-E664 PolarHBondContact OD1-N 2.95Å; D662-S665 PolarHBondContact N-OG 2.72Å; D662-S665 PolarHBondContact O-OG 3.32Å; D662-S665 WeakPolarHBondContact OD1-CB 3.33Å; D662-S665 PolarHBondContact OD1-N 3.21Å; D662-S665 PolarHBondContact OD1-OG 3.18Å; D662-L666 VanDerWaalsContact O-CB 3.24Å; D662-L666 WeakPolarHBondContact O-CB 3.38Å; D662-L666 PolarHBondContact O-N 3.19Å
663	F	93.1	Very high	92.2	Very high	71 Å²	71	48.1 Å²	48.1	31%	0.311	24%	0.243	S	C	.	.	H	α-helix	trans	-69.1	-28.3	-179.5	-68.5	-70.2	0	0	0	114.1	F616 L623 A667 V869 L870	F616-F663 HydrophobicContact CD2-CZ 4.5Å; F616-F663 AromaticContact CE2-CD1 3.78Å; F616-F663 HydrophobicContact CE2-CD1 3.78Å; F616-F663 HydrophobicContact CE2-CD2 4.32Å; F616-F663 AromaticContact CE2-CE1 3.83Å; F616-F663 HydrophobicContact CE2-CE1 3.83Å; F616-F663 HydrophobicContact CE2-CE2 4.36Å; F616-F663 HydrophobicContact CE2-CG 4.04Å; F616-F663 HydrophobicContact CE2-CZ 4.12Å; F616-F663 HydrophobicContact CZ-CD1 4.42Å; L623-F663 HydrophobicContact CD1-CE1 3.99Å; F663-A667 WeakPolarHBondContact O-CB 3.37Å; F663-A667 PolarHBondContact O-N 3.13Å; F663-V869 HydrophobicContact CB-CG2 4.45Å; F663-V869 HydrophobicContact CD1-CG2 4.13Å; F663-V869 HydrophobicContact CD2-CG2 3.81Å; F663-V869 HydrophobicContact CE1-CG2 4.3Å; F663-V869 HydrophobicContact CE2-CG2 4Å; F663-V869 HydrophobicContact CG-CG2 3.89Å; F663-V869 HydrophobicContact CZ-CG2 4.24Å; F663-L870 HydrophobicContact CB-CD2 4.09Å; F663-L870 HydrophobicContact CD1-CD1 3.99Å; F663-L870 HydrophobicContact CD1-CD2 4.33Å; F663-L870 HydrophobicContact CD1-CG 3.89Å
664	E	91.8	Very high	92.6	Very high	152 Å²	152	40.3 Å²	40.3	71%	0.71	21%	0.214	S	C	*	.	H	α-helix	trans	-76.9	-47.3	-178.1	-173.8	171.1	-178.9	0	0	110.6	D662 L666 A667 S668	D662-E664 PolarHBondContact OD1-N 2.95Å; E664-L666 VanDerWaalsContact C-N 3.26Å; E664-L666 PolarHBondContact O-N 2.68Å; E664-A667 PolarHBondContact O-N 2.92Å; E664-S668 PolarHBondContact O-N 3.02Å
665	S	93.7	Very high	93	Very high	33 Å²	33	36.1 Å²	36.1	23%	0.231	19%	0.194	C	C	.	.	H	α-helix	trans	-57.8	-37.8	168.7	53.2	0	0	0	0	111.9	V661 D662 S668 Q669	V661-S665 PolarHBondContact N-OG 2.66Å; D662-S665 PolarHBondContact N-OG 2.72Å; D662-S665 PolarHBondContact O-OG 3.32Å; D662-S665 WeakPolarHBondContact OD1-CB 3.33Å; D662-S665 PolarHBondContact OD1-N 3.21Å; D662-S665 PolarHBondContact OD1-OG 3.18Å; S665-S668 PolarHBondContact O-N 3.15Å; S665-Q669 WeakPolarHBondContact O-CB 3.05Å; S665-Q669 PolarHBondContact O-N 2.84Å
666	L	95.4	Very high	93.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.8	-43	176	-179.6	57.8	0	0	0	112.7	F616 L620 L623 I624 Y657 V660 D662 E664 S668 L670 L870	F616-L666 HydrophobicContact CZ-CB 4.09Å; F616-L666 HydrophobicContact CZ-CD2 3.85Å; L620-L666 HydrophobicContact CD2-CD1 3.9Å; L620-L666 HydrophobicContact CD2-CD2 3.76Å; L620-L666 HydrophobicContact CD2-CG 4.36Å; L623-L666 HydrophobicContact CB-CD2 4.31Å; L623-L666 HydrophobicContact CD1-CD2 3.62Å; I624-L666 HydrophobicContact CG1-CD1 4.49Å; Y657-L666 HydrophobicContact CD1-CD1 3.98Å; Y657-L666 HydrophobicContact CE1-CD1 3.87Å; V660-L666 HydrophobicContact CG1-CB 3.49Å; V660-L666 VanDerWaalsContact CG1-CB 3.49Å; V660-L666 HydrophobicContact CG1-CD1 3.95Å; V660-L666 HydrophobicContact CG1-CG 4.28Å; D662-L666 VanDerWaalsContact O-CB 3.24Å; D662-L666 WeakPolarHBondContact O-CB 3.38Å; D662-L666 PolarHBondContact O-N 3.19Å; E664-L666 VanDerWaalsContact C-N 3.26Å; E664-L666 PolarHBondContact O-N 2.68Å; L666-S668 VanDerWaalsContact C-N 3.29Å; L666-S668 PolarHBondContact O-N 3.15Å; L666-L670 HydrophobicContact CD1-CD1 3.71Å; L666-L670 HydrophobicContact CD1-CG 3.85Å; L666-L670 HydrophobicContact CG-CD1 3.74Å; L666-L670 HydrophobicContact CG-CG 4.34Å; L666-L670 VanDerWaalsContact O-CB 3.22Å; L666-L670 WeakPolarHBondContact O-CB 3.48Å; L666-L670 WeakPolarHBondContact O-CD1 3.38Å; L666-L670 VanDerWaalsContact O-CG 3.25Å; L666-L670 WeakPolarHBondContact O-CG 3.45Å; L666-L670 PolarHBondContact O-N 3.09Å; L666-L870 HydrophobicContact CD2-CD1 3.72Å; L666-L870 HydrophobicContact CG-CD1 4.04Å
667	A	94.9	Very high	93.6	Very high	6 Å²	6	39.7 Å²	39.7	5%	0.05	21%	0.209	C	C	.	.	H	α-helix	trans	-61.5	-40.1	175.8	0	0	0	0	0	111.6	F663 E664 T671 V685 L870	F663-A667 WeakPolarHBondContact O-CB 3.37Å; F663-A667 PolarHBondContact O-N 3.13Å; E664-A667 PolarHBondContact O-N 2.92Å; A667-T671 VanDerWaalsContact O-CB 3.31Å; A667-T671 WeakPolarHBondContact O-CB 3.43Å; A667-T671 PolarHBondContact O-N 3.11Å; A667-T671 PolarHBondContact O-OG1 2.91Å; A667-V685 HydrophobicContact CB-CG1 4.12Å; A667-L870 HydrophobicContact CB-CD2 4.01Å
668	S	94.8	Very high	93.6	Very high	68 Å²	68	40.4 Å²	40.4	48%	0.476	22%	0.215	S	C	.	.	H	α-helix	trans	-64.7	-55.1	175.4	-167.2	0	0	0	0	112.2	E664 S665 L666 L670 T671 I672	E664-S668 PolarHBondContact O-N 3.02Å; S665-S668 PolarHBondContact O-N 3.15Å; L666-S668 VanDerWaalsContact C-N 3.29Å; L666-S668 PolarHBondContact O-N 3.15Å; S668-L670 PolarHBondContact O-N 3.09Å; S668-T671 WeakPolarHBondContact O-CB 3.49Å; S668-T671 PolarHBondContact O-N 2.88Å; S668-I672 WeakPolarHBondContact O-CG1 3.49Å; S668-I672 PolarHBondContact O-N 2.92Å
669	Q	95.2	Very high	93.5	Very high	52 Å²	52	40.8 Å²	40.8	24%	0.243	23%	0.23	C	C	.	.	H	α-helix	trans	-63.2	-40	-178.5	-171.7	60.7	52.7	0	0	112.4	Y657 V660 S665 I672 D673	Y657-Q669 HydrophobicContact CE1-CG 4.17Å; V660-Q669 HydrophobicContact CG2-CB 4.06Å; V660-Q669 HydrophobicContact CG2-CG 4.18Å; S665-Q669 WeakPolarHBondContact O-CB 3.05Å; S665-Q669 PolarHBondContact O-N 2.84Å; Q669-I672 PolarHBondContact O-N 2.98Å; Q669-D673 PolarHBondContact NE2-OD1 2.95Å; Q669-D673 WeakPolarHBondContact O-CB 3.18Å; Q669-D673 PolarHBondContact O-N 3.28Å
670	L	96.2	Very high	93.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.1	-46.5	172	-77.4	167	0	0	0	110.8	I624 V627 L648 Y657 L666 S668 I672 D673 L674 V685	I624-L670 HydrophobicContact CG1-CD2 4.32Å; V627-L670 HydrophobicContact CG2-CD1 4.04Å; V627-L670 HydrophobicContact CG2-CD2 4.28Å; L648-L670 HydrophobicContact CD2-CD2 4.15Å; Y657-L670 HydrophobicContact CE1-CD2 4.23Å; Y657-L670 HydrophobicContact CE1-CG 4.37Å; L666-L670 HydrophobicContact CD1-CD1 3.71Å; L666-L670 HydrophobicContact CD1-CG 3.85Å; L666-L670 HydrophobicContact CG-CD1 3.74Å; L666-L670 HydrophobicContact CG-CG 4.34Å; L666-L670 VanDerWaalsContact O-CB 3.22Å; L666-L670 WeakPolarHBondContact O-CB 3.48Å; L666-L670 WeakPolarHBondContact O-CD1 3.38Å; L666-L670 VanDerWaalsContact O-CG 3.25Å; L666-L670 WeakPolarHBondContact O-CG 3.45Å; L666-L670 PolarHBondContact O-N 3.09Å; S668-L670 PolarHBondContact O-N 3.09Å; L670-I672 VanDerWaalsContact C-N 3.34Å; L670-I672 PolarHBondContact O-N 3.26Å; L670-D673 PolarHBondContact O-N 2.84Å; L670-L674 HydrophobicContact CB-CD1 4.31Å; L670-L674 WeakPolarHBondContact O-CB 3.41Å; L670-L674 VanDerWaalsContact O-CD1 3.24Å; L670-L674 WeakPolarHBondContact O-CD1 3.43Å; L670-L674 WeakPolarHBondContact O-CG 3.31Å; L670-L674 PolarHBondContact O-N 3.32Å; L670-V685 HydrophobicContact CB-CB 4.16Å; L670-V685 HydrophobicContact CB-CG2 4.12Å; L670-V685 HydrophobicContact CD1-CG1 4.13Å; L670-V685 HydrophobicContact CD1-CG2 4.43Å
671	T	95.6	Very high	93.1	Very high	26 Å²	26	43.7 Å²	43.7	16%	0.16	24%	0.238	C	C	.	.	H	α-helix	trans	-59.7	-44.2	179.3	-63.9	0	0	0	0	111.8	A667 S668 Q675 H684 V685	A667-T671 VanDerWaalsContact O-CB 3.31Å; A667-T671 WeakPolarHBondContact O-CB 3.43Å; A667-T671 PolarHBondContact O-N 3.11Å; A667-T671 PolarHBondContact O-OG1 2.91Å; S668-T671 WeakPolarHBondContact O-CB 3.49Å; S668-T671 PolarHBondContact O-N 2.88Å; T671-Q675 WeakPolarHBondContact O-CB 3.22Å; T671-Q675 VanDerWaalsContact O-CG 3.25Å; T671-Q675 WeakPolarHBondContact O-CG 3.05Å; T671-Q675 PolarHBondContact O-N 3.08Å; T671-H684 HydrophobicContact CG2-CB 3.71Å; T671-V685 PolarHBondContact OG1-N 3.13Å; T671-V685 PolarHBondContact OG1-O 3.38Å
672	I	95	Very high	92.7	Very high	75 Å²	75	45.1 Å²	45.1	39%	0.385	24%	0.242	S	C	.	.	H	α-helix	trans	-60	-56.4	175.3	-65.3	164.6	0	0	0	110.2	S668 Q669 L670 L674 Q675 E676	S668-I672 WeakPolarHBondContact O-CG1 3.49Å; S668-I672 PolarHBondContact O-N 2.92Å; Q669-I672 PolarHBondContact O-N 2.98Å; L670-I672 VanDerWaalsContact C-N 3.34Å; L670-I672 PolarHBondContact O-N 3.26Å; I672-L674 VanDerWaalsContact C-N 3.28Å; I672-L674 PolarHBondContact O-N 3Å; I672-Q675 PolarHBondContact O-N 3.48Å; I672-Q675 VanDerWaalsContact O-N 3.16Å; I672-E676 HydrophobicContact CG2-CG 4.25Å; I672-E676 WeakPolarHBondContact O-CB 3.41Å; I672-E676 WeakPolarHBondContact O-CG 3.44Å; I672-E676 PolarHBondContact O-N 3.34Å
673	D	95.4	Very high	92.6	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-57.4	-40.2	-178.8	-80.6	8.4	0	0	0	112.9	L648 K651 Y657 Q669 L670 S677	L648-D673 HydrophobicContact CD2-CB 3.54Å; K651-D673 HydrophobicContact CD-CB 4.4Å; K651-D673 VanDerWaalsContact CD-CG 3.42Å; K651-D673 WeakPolarHBondContact CD-OD1 3.36Å; K651-D673 WeakPolarHBondContact CD-OD2 3.43Å; K651-D673 VanDerWaalsContact NZ-CG 3.27Å; K651-D673 IonicContact NZ-OD1 2.81Å; K651-D673 PolarHBondContact NZ-OD1 3.19Å; K651-D673 IonicContact NZ-OD2 2.61Å; Y657-D673 VanDerWaalsContact CE2-OD2 3.27Å; Y657-D673 WeakPolarHBondContact CE2-OD2 3.46Å; Y657-D673 VanDerWaalsContact CZ-OD2 3.25Å; Y657-D673 PolarHBondContact OH-OD2 2.66Å; Q669-D673 PolarHBondContact NE2-OD1 2.95Å; Q669-D673 WeakPolarHBondContact O-CB 3.18Å; Q669-D673 PolarHBondContact O-N 3.28Å; L670-D673 PolarHBondContact O-N 2.84Å; D673-S677 WeakPolarHBondContact O-CB 3.35Å; D673-S677 PolarHBondContact O-N 2.8Å; D673-S677 PolarHBondContact O-OG 3.43Å
674	L	94.4	Very high	92.6	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-64.2	-46.7	178.1	-74.5	165.2	0	0	0	111.2	V627 L631 V644 L648 L670 I672 S678 I683 V685	V627-L674 HydrophobicContact CG1-CD1 4.02Å; V627-L674 HydrophobicContact CG1-CD2 3.87Å; V627-L674 HydrophobicContact CG1-CG 4.46Å; L631-L674 HydrophobicContact CD1-CD2 3.62Å; L631-L674 HydrophobicContact CG-CD2 4.41Å; V644-L674 HydrophobicContact CG1-CD2 3.74Å; L648-L674 HydrophobicContact CD1-CD2 3.98Å; L670-L674 HydrophobicContact CB-CD1 4.31Å; L670-L674 WeakPolarHBondContact O-CB 3.41Å; L670-L674 VanDerWaalsContact O-CD1 3.24Å; L670-L674 WeakPolarHBondContact O-CD1 3.43Å; L670-L674 WeakPolarHBondContact O-CG 3.31Å; L670-L674 PolarHBondContact O-N 3.32Å; I672-L674 VanDerWaalsContact C-N 3.28Å; I672-L674 PolarHBondContact O-N 3Å; L674-S678 WeakPolarHBondContact O-CB 3.15Å; L674-S678 PolarHBondContact O-N 2.84Å; L674-S678 VanDerWaalsContact O-N 3.1Å; L674-S678 PolarHBondContact O-OG 2.87Å; L674-I683 HydrophobicContact CB-CG2 4.02Å; L674-I683 HydrophobicContact CD1-CG2 4.04Å; L674-I683 HydrophobicContact CD2-CG2 4.23Å; L674-I683 HydrophobicContact CG-CG2 4.34Å; L674-V685 HydrophobicContact CD1-CG2 3.57Å
675	Q	93.3	Very high	92.8	Very high	41 Å²	41	35.8 Å²	35.8	19%	0.192	20%	0.198	C	C	.	.	H	α-helix	trans	-71.7	-43.6	-178.2	-67.6	-174.9	15.7	0	0	111.7	T671 I672 S677 S678 G679 H681 I683	T671-Q675 WeakPolarHBondContact O-CB 3.22Å; T671-Q675 VanDerWaalsContact O-CG 3.25Å; T671-Q675 WeakPolarHBondContact O-CG 3.05Å; T671-Q675 PolarHBondContact O-N 3.08Å; I672-Q675 PolarHBondContact O-N 3.48Å; I672-Q675 VanDerWaalsContact O-N 3.16Å; Q675-S677 PolarHBondContact O-N 3.39Å; Q675-S678 PolarHBondContact O-N 2.64Å; Q675-G679 WeakPolarHBondContact O-CA 3.13Å; Q675-G679 PolarHBondContact O-N 3.43Å; Q675-H681 PolarHBondContact NE2-O 2.76Å; Q675-H681 PolarHBondContact OE1-ND1 2.82Å; Q675-I683 WeakPolarHBondContact CG-O 3.18Å; Q675-I683 PolarHBondContact NE2-O 3.25Å
676	E	92.8	Very high	92.7	Very high	127 Å²	127	37 Å²	37	59%	0.593	20%	0.199	S	C	*	.	H	α-helix	trans	-55.3	-49.5	172.3	-73.9	-177.6	162.7	0	0	112	K651 I672 S678	K651-E676 IonicContact NZ-OE2 2.67Å; K651-E676 PolarHBondContact NZ-OE2 3.07Å; I672-E676 HydrophobicContact CG2-CG 4.25Å; I672-E676 WeakPolarHBondContact O-CB 3.41Å; I672-E676 WeakPolarHBondContact O-CG 3.44Å; I672-E676 PolarHBondContact O-N 3.34Å; E676-S678 VanDerWaalsContact C-N 3.35Å; E676-S678 PolarHBondContact O-N 3.32Å
677	S	92.4	Very high	92.4	Very high	26 Å²	26	40.3 Å²	40.3	18%	0.182	22%	0.215	C	C	.	.	H	α-helix	trans	-79.8	-16.6	-171	-53.1	0	0	0	0	113.7	V644 V647 D673 Q675	V644-S677 WeakPolarHBondContact CG2-O 3.45Å; V647-S677 WeakPolarHBondContact CG1-OG 3.1Å; D673-S677 WeakPolarHBondContact O-CB 3.35Å; D673-S677 PolarHBondContact O-N 2.8Å; D673-S677 PolarHBondContact O-OG 3.43Å; Q675-S677 PolarHBondContact O-N 3.39Å
678	S	90.1	Very high	91.9	Very high	19 Å²	19	42 Å²	42	13%	0.133	23%	0.225	C	C	.	.	H	α-helix	trans	-109.9	-26.2	-178.5	68.1	0	0	0	0	114.8	L674 Q675 E676 D680	L674-S678 WeakPolarHBondContact O-CB 3.15Å; L674-S678 PolarHBondContact O-N 2.84Å; L674-S678 VanDerWaalsContact O-N 3.1Å; L674-S678 PolarHBondContact O-OG 2.87Å; Q675-S678 PolarHBondContact O-N 2.64Å; E676-S678 VanDerWaalsContact C-N 3.35Å; E676-S678 PolarHBondContact O-N 3.32Å; S678-D680 PolarHBondContact O-N 3.03Å; S678-D680 PolarHBondContact OG-N 3.36Å
679	G	88.5	Confident	91.1	Very high	44 Å²	44	44.9 Å²	44.9	45%	0.454	24%	0.236	S	C	.	.	S	Bend	trans	70.3	10.8	-167.2	0	0	0	0	0	114.6	Q675	Q675-G679 WeakPolarHBondContact O-CA 3.13Å; Q675-G679 PolarHBondContact O-N 3.43Å
680	D	88.4	Confident	90.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.255	C	S	.	.			trans	-113.8	95.8	-179	-171.7	-6.1	0	0	0	112.1	Y635 S678 R682 I683 F890	Y635-D680 WeakPolarHBondContact OH-CB 3.47Å; Y635-D680 PolarHBondContact OH-OD2 2.93Å; S678-D680 PolarHBondContact O-N 3.03Å; S678-D680 PolarHBondContact OG-N 3.36Å; D680-R682 PolarHBondContact O-N 2.94Å; D680-R682 WeakPolarHBondContact OD1-CB 3.37Å; D680-R682 VanDerWaalsContact OD1-CG 3.25Å; D680-R682 WeakPolarHBondContact OD1-CG 3.49Å; D680-R682 IonicContact OD1-CZ 3.08Å; D680-R682 PolarHBondContact OD1-N 3.28Å; D680-R682 IonicContact OD1-NE 2.79Å; D680-R682 PolarHBondContact OD1-NE 2.62Å; D680-R682 IonicContact OD1-NH2 2.71Å; D680-R682 IonicContact OD2-CZ 3.31Å; D680-R682 IonicContact OD2-NE 3.55Å; D680-R682 PolarHBondContact OD2-NE 3.11Å; D680-R682 IonicContact OD2-NH2 3.7Å; D680-R682 PolarHBondContact OD2-NH2 3.26Å; D680-I683 HydrophobicContact CB-CD1 4.06Å; D680-I683 HydrophobicContact CB-CG1 4.13Å; D680-I683 PolarHBondContact O-N 3.32Å; D680-I683 VanDerWaalsContact O-N 3.1Å; D680-F890 HydrophobicContact CB-CD2 3.74Å; D680-F890 HydrophobicContact CB-CE2 4.04Å; D680-F890 HydrophobicContact CB-CG 4.48Å
681	H	87.4	Confident	89.3	Confident	112 Å²	112	54.8 Å²	54.8	52%	0.519	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-9	177.6	-65.2	-65.3	0	0	0	115.3	Q675	Q675-H681 PolarHBondContact NE2-O 2.76Å; Q675-H681 PolarHBondContact OE1-ND1 2.82Å
682	R	86.3	Confident	88.2	Confident	38 Å²	38	56 Å²	56	14%	0.143	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-20.5	178.3	-50.1	168.3	-57.1	-177.7	3.4	111.3	D680 H684 G855 G856 P875 F890	D680-R682 PolarHBondContact O-N 2.94Å; D680-R682 WeakPolarHBondContact OD1-CB 3.37Å; D680-R682 VanDerWaalsContact OD1-CG 3.25Å; D680-R682 WeakPolarHBondContact OD1-CG 3.49Å; D680-R682 IonicContact OD1-CZ 3.08Å; D680-R682 PolarHBondContact OD1-N 3.28Å; D680-R682 IonicContact OD1-NE 2.79Å; D680-R682 PolarHBondContact OD1-NE 2.62Å; D680-R682 IonicContact OD1-NH2 2.71Å; D680-R682 IonicContact OD2-CZ 3.31Å; D680-R682 IonicContact OD2-NE 3.55Å; D680-R682 PolarHBondContact OD2-NE 3.11Å; D680-R682 IonicContact OD2-NH2 3.7Å; D680-R682 PolarHBondContact OD2-NH2 3.26Å; R682-H684 PolarHBondContact O-ND1 3.07Å; R682-G855 WeakPolarHBondContact CD-O 3.38Å; R682-G855 WeakPolarHBondContact CG-O 3.39Å; R682-G856 VanDerWaalsContact CD-C 3.46Å; R682-G856 WeakPolarHBondContact CD-O 3.35Å; R682-G856 PolarHBondContact NH1-O 3.01Å; R682-G856 VanDerWaalsContact NH1-O 3.07Å; R682-P875 HydrophobicContact CB-CG 3.75Å; R682-F890 VanDerWaalsContact NH2-CD1 3.26Å
683	I	91	Very high	86.7	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.015	32%	0.322	C	S	.	.			trans	-73.5	127.4	170.5	-53.4	176.5	0	0	0	108.7	L631 Y635 L674 Q675 D680 P875	L631-I683 HydrophobicContact CD2-CD1 4.18Å; L631-I683 HydrophobicContact CD2-CG2 4.22Å; Y635-I683 HydrophobicContact CD2-CD1 4.09Å; Y635-I683 HydrophobicContact CE1-CD1 4.29Å; Y635-I683 HydrophobicContact CE2-CD1 3.75Å; Y635-I683 HydrophobicContact CE2-CG1 4.18Å; L674-I683 HydrophobicContact CB-CG2 4.02Å; L674-I683 HydrophobicContact CD1-CG2 4.04Å; L674-I683 HydrophobicContact CD2-CG2 4.23Å; L674-I683 HydrophobicContact CG-CG2 4.34Å; Q675-I683 WeakPolarHBondContact CG-O 3.18Å; Q675-I683 PolarHBondContact NE2-O 3.25Å; D680-I683 HydrophobicContact CB-CD1 4.06Å; D680-I683 HydrophobicContact CB-CG1 4.13Å; D680-I683 PolarHBondContact O-N 3.32Å; D680-I683 VanDerWaalsContact O-N 3.1Å; I683-P875 HydrophobicContact CG1-CG 4.38Å
684	H	92.6	Very high	84.7	Confident	73 Å²	73	65.9 Å²	65.9	34%	0.338	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	155.6	173.3	55.8	-80.7	0	0	0	111.5	T671 R682 F686 A872 S873	T671-H684 HydrophobicContact CG2-CB 3.71Å; R682-H684 PolarHBondContact O-ND1 3.07Å; H684-F686 AromaticContact CD2-CD1 3.93Å; H684-A872 WeakPolarHBondContact O-CA 3.42Å; H684-S873 WeakPolarHBondContact CE1-CB 3.48Å; H684-S873 PolarHBondContact N-O 3.45Å; H684-S873 WeakPolarHBondContact NE2-CB 3.29Å; H684-S873 PolarHBondContact O-N 3Å
685	V	94.5	Very high	82.7	Confident	6 Å²	6	71.7 Å²	71.7	4%	0.036	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	137.7	171.5	174.8	0	0	0	0	108.4	V627 A667 L670 T671 L674 I865 L870 Y871 A872	V627-V685 HydrophobicContact CG1-CG2 4.42Å; V627-V685 HydrophobicContact CG2-CG2 4.43Å; A667-V685 HydrophobicContact CB-CG1 4.12Å; L670-V685 HydrophobicContact CB-CB 4.16Å; L670-V685 HydrophobicContact CB-CG2 4.12Å; L670-V685 HydrophobicContact CD1-CG1 4.13Å; L670-V685 HydrophobicContact CD1-CG2 4.43Å; T671-V685 PolarHBondContact OG1-N 3.13Å; T671-V685 PolarHBondContact OG1-O 3.38Å; L674-V685 HydrophobicContact CD1-CG2 3.57Å; V685-I865 HydrophobicContact CB-CD1 4.45Å; V685-I865 HydrophobicContact CG1-CD1 3.58Å; V685-I865 HydrophobicContact CG2-CD1 3.99Å; V685-L870 HydrophobicContact CG1-CB 4.35Å; V685-L870 HydrophobicContact CG1-CD2 4.47Å; V685-Y871 CarbonylContact C-O 3.57Å; V685-Y871 VanDerWaalsContact CA-O 3.3Å; V685-Y871 WeakPolarHBondContact CA-O 3.27Å; V685-A872 HydrophobicContact CG2-CB 4.18Å
686	F	91.7	Very high	80.4	Confident	59 Å²	59	77.6 Å²	77.6	26%	0.259	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	154.1	179.6	63.5	-86.2	0	0	0	111.8	H684 C688 P692 T862 L870 Y871	H684-F686 AromaticContact CD2-CD1 3.93Å; F686-C688 HydrophobicContact CD2-CB 4.11Å; F686-C688 HydrophobicContact CE2-CB 4.03Å; F686-P692 HydrophobicContact CE2-CG 4.36Å; F686-P692 HydrophobicContact CZ-CG 4.39Å; F686-T862 HydrophobicContact CE1-CG2 4.14Å; F686-T862 HydrophobicContact CZ-CG2 3.76Å; F686-L870 WeakPolarHBondContact O-CA 3.37Å; F686-Y871 WeakPolarHBondContact CD1-O 3.37Å; F686-Y871 HydrophobicContact CE2-CD2 4.42Å; F686-Y871 HydrophobicContact CE2-CG 4.34Å; F686-Y871 HydrophobicContact CZ-CG 4.33Å; F686-Y871 PolarHBondContact N-O 2.9Å; F686-Y871 PolarHBondContact O-N 2.73Å
687	H	88.9	Confident	78.1	Confident	70 Å²	70	79.3 Å²	79.3	32%	0.324	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	135	173.1	178.7	-95.1	0	0	0	110.4	D689 V869 L870	H687-D689 IonicContact CE1-OD1 2.62Å; H687-D689 IonicContact CE1-OD2 2.82Å; H687-D689 PolarHBondContact CE1-OD2 2.99Å; H687-D689 IonicContact NE2-OD1 2.76Å; H687-V869 VanDerWaalsContact CD2-CG2 3.49Å; H687-V869 WeakPolarHBondContact CD2-CG2 3.41Å; H687-V869 WeakPolarHBondContact NE2-CG2 3.47Å; H687-L870 HydrophobicContact CB-CD2 4.16Å
688	C	85	Confident	76.2	Confident	40 Å²	40	85.3 Å²	85.3	27%	0.27	46%	0.459	S	S	.	.			trans	-154.4	122.1	174.5	-163.9	0	0	0	0	111.8	F686 V690 V869 Y871	F686-C688 HydrophobicContact CD2-CB 4.11Å; F686-C688 HydrophobicContact CE2-CB 4.03Å; C688-V690 PolarHBondContact O-N 3.06Å; C688-V690 PolarHBondContact SG-O 3.44Å; C688-V869 PolarHBondContact N-O 3.04Å; C688-Y871 HydrophobicContact CB-CD2 4Å; C688-Y871 HydrophobicContact CB-CE2 4.12Å
689	D	79	Confident	74.5	Confident	129 Å²	129	87.1 Å²	87.1	69%	0.69	47%	0.47	S	S	*	.	S	Bend	trans	-74.7	-7.9	179.5	-58.2	-77.4	0	0	0	114.4	H687	H687-D689 IonicContact CE1-OD1 2.62Å; H687-D689 IonicContact CE1-OD2 2.82Å; H687-D689 PolarHBondContact CE1-OD2 2.99Å; H687-D689 IonicContact NE2-OD1 2.76Å
690	V	77.3	Confident	73.3	Confident	107 Å²	107	94.6 Å²	94.6	65%	0.648	49%	0.49	S	S	*	.	S	Bend	trans	-127.1	137.9	-177.6	-176.4	0	0	0	0	109	C688 P692	C688-V690 PolarHBondContact O-N 3.06Å; C688-V690 PolarHBondContact SG-O 3.44Å; V690-P692 WeakPolarHBondContact O-CD 3.47Å
691	E	74.9	Confident	72	Confident	154 Å²	154	99.7 Å²	99.7	72%	0.72	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-61.4	123.3	176.6	-170.1	177.6	-177.5	0	0	110.6	E693	E691-E693 PolarHBondContact O-N 2.96Å
692	P	72.6	Confident	71	Confident	51 Å²	51	95.9 Å²	95.9	33%	0.331	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-63.3	127.3	-178.6	-25.1	35.5	0	0	0	112.7	F686 V690 S694 T862 Y871	F686-P692 HydrophobicContact CE2-CG 4.36Å; F686-P692 HydrophobicContact CZ-CG 4.39Å; V690-P692 WeakPolarHBondContact O-CD 3.47Å; P692-S694 PolarHBondContact O-N 3.3Å; P692-T862 HydrophobicContact CG-CG2 4.24Å; P692-Y871 HydrophobicContact CG-CD1 4.2Å; P692-Y871 HydrophobicContact CG-CE1 4.26Å; P692-Y871 HydrophobicContact CG-CG 4.38Å
693	E	63.1	Low	70.3	Confident	192 Å²	192	96.1 Å²	96.1	90%	0.897	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-61.1	132	177.3	-66.7	-170.5	154.5	0	0	111.5	E691 P695	E691-E693 PolarHBondContact O-N 2.96Å; E693-P695 WeakPolarHBondContact O-CD 3.46Å
694	S	54.6	Low	69.1	Low	91 Å²	91	100.3 Å²	100.3	64%	0.636	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-84.8	120.6	175.7	49.2	0	0	0	0	110.7	P692 H696	P692-S694 PolarHBondContact O-N 3.3Å; S694-H696 PolarHBondContact O-N 2.81Å
695	P	51.5	Low	67.9	Low	124 Å²	124	104.2 Å²	104.2	81%	0.805	55%	0.554	S	S	*	*			trans	-74.3	97.7	-177.2	28.5	-33.9	0	0	0	110.6	E693	E693-P695 WeakPolarHBondContact O-CD 3.46Å
696	H	46.3	Very low	66.6	Low	165 Å²	165	109.1 Å²	109.1	76%	0.764	58%	0.576	S	S	*	*			trans	-125.2	17	-177.8	-84.1	13	0	0	0	114.2	S694	S694-H696 PolarHBondContact O-N 2.81Å
697	D	44.7	Very low	65.5	Low	162 Å²	162	106.5 Å²	106.5	87%	0.866	57%	0.565	S	S	*	*			trans	-76.6	124.3	169.2	-97.5	-28.9	0	0	0	111.7
698	I	51.8	Low	64.3	Low	152 Å²	152	104.7 Å²	104.7	78%	0.779	56%	0.564	S	S	*	*			trans	-71.9	128.5	175.3	-61	172.2	0	0	0	108.6	K700	I698-K700 PolarHBondContact O-N 2.79Å
699	P	55.4	Low	63.5	Low	57 Å²	57	110.8 Å²	110.8	37%	0.37	58%	0.583	S	S	.	*			trans	-54	113.1	178.9	-29	36.4	0	0	0	112.5	M701 Y770	P699-M701 PolarHBondContact O-N 3.24Å; P699-M701 VanDerWaalsContact O-N 3.17Å; P699-Y770 HydrophobicContact CG-CE1 4.28Å
700	K	62.3	Low	62.9	Low	201 Å²	201	107.6 Å²	107.6	87%	0.874	57%	0.565	S	S	*	*			trans	-67.5	114	178.1	-169	179.3	-177.7	-175.4	0	109	I698 P702	I698-K700 PolarHBondContact O-N 2.79Å; K700-P702 WeakPolarHBondContact O-CD 3.45Å; K700-P702 VanDerWaalsContact O-N 3.17Å
701	M	61.3	Low	62.4	Low	108 Å²	108	103.2 Å²	103.2	53%	0.532	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-49	118.8	179.5	-90.4	-81.9	-170.9	0	0	111.2	P699 E736	P699-M701 PolarHBondContact O-N 3.24Å; P699-M701 VanDerWaalsContact O-N 3.17Å; M701-E736 HydrophobicContact CE-CB 4.28Å; M701-E736 VanDerWaalsContact CE-O 3.25Å; M701-E736 WeakPolarHBondContact CE-O 3.49Å
702	P	66.5	Low	62	Low	31 Å²	31	103.7 Å²	103.7	20%	0.201	54%	0.542	C	S	.	.	P	Polyproline II helix	trans	-69.8	147.4	176.4	29	-34	0	0	0	110.5	K700 E706 I710 V737	K700-P702 WeakPolarHBondContact O-CD 3.45Å; K700-P702 VanDerWaalsContact O-N 3.17Å; P702-E706 HydrophobicContact CB-CB 4.02Å; P702-I710 HydrophobicContact CB-CD1 3.97Å; P702-I710 HydrophobicContact CG-CD1 4.37Å; P702-V737 HydrophobicContact CG-CG1 4.48Å
703	S	71.1	Confident	62	Low	44 Å²	44	105.7 Å²	105.7	31%	0.308	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-66.1	163.5	171.2	67	0	0	0	0	111.9	E705 E706 F707	S703-E705 PolarHBondContact O-N 2.8Å; S703-E705 VanDerWaalsContact O-N 3.08Å; S703-E706 WeakPolarHBondContact CB-OE2 3.48Å; S703-E706 PolarHBondContact N-OE2 3.4Å; S703-E706 PolarHBondContact O-N 2.93Å; S703-E706 VanDerWaalsContact OG-CD 3.3Å; S703-E706 WeakPolarHBondContact OG-CG 3.31Å; S703-E706 PolarHBondContact OG-N 3.07Å; S703-E706 PolarHBondContact OG-OE2 2.8Å; S703-F707 PolarHBondContact O-N 3.24Å
704	P	65.5	Low	62.6	Low	90 Å²	90	98.1 Å²	98.1	58%	0.584	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-24.2	175.9	-28.4	37.1	0	0	0	114.9	Q744	P704-Q744 PolarHBondContact O-NE2 2.57Å
705	E	67	Low	63.9	Low	156 Å²	156	94.5 Å²	94.5	73%	0.729	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-45.1	179.1	-64.8	178	-178.9	0	0	111.3	S703 F707 G708 Y709	S703-E705 PolarHBondContact O-N 2.8Å; S703-E705 VanDerWaalsContact O-N 3.08Å; E705-F707 VanDerWaalsContact C-N 3.28Å; E705-F707 PolarHBondContact O-N 3.46Å; E705-G708 WeakPolarHBondContact O-CA 3.31Å; E705-G708 PolarHBondContact O-N 3.28Å; E705-Y709 VanDerWaalsContact O-CD2 3.26Å; E705-Y709 WeakPolarHBondContact O-CD2 3.03Å; E705-Y709 PolarHBondContact O-N 3.27Å
706	E	68.2	Low	65.7	Low	109 Å²	109	93.6 Å²	93.6	51%	0.509	48%	0.479	S	S	.	.	H	α-helix	trans	-59.1	-39.9	172.2	-70.9	161.1	132.3	0	0	111.3	P702 S703 G708 Y709 I710	P702-E706 HydrophobicContact CB-CB 4.02Å; S703-E706 WeakPolarHBondContact CB-OE2 3.48Å; S703-E706 PolarHBondContact N-OE2 3.4Å; S703-E706 PolarHBondContact O-N 2.93Å; S703-E706 VanDerWaalsContact OG-CD 3.3Å; S703-E706 WeakPolarHBondContact OG-CG 3.31Å; S703-E706 PolarHBondContact OG-N 3.07Å; S703-E706 PolarHBondContact OG-OE2 2.8Å; E706-G708 PolarHBondContact O-N 3.47Å; E706-Y709 PolarHBondContact O-N 2.97Å; E706-I710 VanDerWaalsContact O-CG1 3.28Å; E706-I710 WeakPolarHBondContact O-CG1 3.39Å; E706-I710 PolarHBondContact O-N 2.63Å
707	F	68	Low	67.8	Low	4 Å²	4	87.2 Å²	87.2	2%	0.018	45%	0.452	C	S	.	.	H	α-helix	trans	-62.7	-29.1	173.3	-179.3	-105	0	0	0	112.9	S703 E705 I710 A711 V741 Q744 L745	S703-F707 PolarHBondContact O-N 3.24Å; E705-F707 VanDerWaalsContact C-N 3.28Å; E705-F707 PolarHBondContact O-N 3.46Å; F707-I710 PolarHBondContact O-N 2.74Å; F707-A711 HydrophobicContact CD1-CB 4.36Å; F707-A711 HydrophobicContact CE1-CB 3.84Å; F707-A711 HydrophobicContact CE2-CB 4.14Å; F707-A711 HydrophobicContact CZ-CB 3.72Å; F707-A711 WeakPolarHBondContact O-CB 3.47Å; F707-A711 PolarHBondContact O-N 3.02Å; F707-V741 HydrophobicContact CB-CG1 3.98Å; F707-V741 HydrophobicContact CD1-CB 3.65Å; F707-V741 HydrophobicContact CD1-CG1 4.04Å; F707-V741 HydrophobicContact CD1-CG2 4.26Å; F707-V741 HydrophobicContact CD2-CB 3.72Å; F707-V741 HydrophobicContact CD2-CG1 3.55Å; F707-V741 HydrophobicContact CD2-CG2 3.8Å; F707-V741 HydrophobicContact CE1-CB 3.7Å; F707-V741 HydrophobicContact CE1-CG2 3.87Å; F707-V741 HydrophobicContact CE2-CB 3.77Å; F707-V741 HydrophobicContact CE2-CG1 4.07Å; F707-V741 HydrophobicContact CE2-CG2 3.36Å; F707-V741 HydrophobicContact CG-CB 3.66Å; F707-V741 HydrophobicContact CG-CG1 3.53Å; F707-V741 HydrophobicContact CG-CG2 4.23Å; F707-V741 HydrophobicContact CZ-CB 3.76Å; F707-V741 HydrophobicContact CZ-CG2 3.39Å; F707-Q744 HydrophobicContact CD1-CB 3.95Å; F707-Q744 HydrophobicContact CE1-CB 3.82Å; F707-L745 HydrophobicContact CZ-CB 4.39Å; F707-L745 HydrophobicContact CZ-CD1 4.38Å
708	G	64.9	Low	70.1	Confident	31 Å²	31	83.4 Å²	83.4	32%	0.32	43%	0.429	S	S	.	.	H	α-helix	trans	-58.6	-53.3	174.2	0	0	0	0	0	111.5	E705 E706 A711 E712	E705-G708 WeakPolarHBondContact O-CA 3.31Å; E705-G708 PolarHBondContact O-N 3.28Å; E706-G708 PolarHBondContact O-N 3.47Å; G708-A711 PolarHBondContact O-N 3.21Å; G708-E712 PolarHBondContact O-N 2.99Å
709	Y	67.3	Low	72.1	Confident	169 Å²	169	79.6 Å²	79.6	66%	0.663	41%	0.413	S	S	*	.	H	α-helix	trans	-64.2	-40.6	177.2	-60.8	-73	0	0	0	112.8	E705 E706 A711 S713	E705-Y709 VanDerWaalsContact O-CD2 3.26Å; E705-Y709 WeakPolarHBondContact O-CD2 3.03Å; E705-Y709 PolarHBondContact O-N 3.27Å; E706-Y709 PolarHBondContact O-N 2.97Å; Y709-A711 VanDerWaalsContact C-N 3.34Å; Y709-A711 PolarHBondContact O-N 2.91Å; Y709-S713 VanDerWaalsContact O-CB 3.29Å; Y709-S713 WeakPolarHBondContact O-CB 3.49Å; Y709-S713 PolarHBondContact O-N 3.3Å; Y709-S713 PolarHBondContact O-OG 3.44Å
710	I	66.8	Low	73.9	Confident	62 Å²	62	77.8 Å²	77.8	32%	0.318	40%	0.4	S	S	.	.	H	α-helix	trans	-63.2	-40.7	175.7	-67.5	164.8	0	0	0	110.6	P702 E706 F707 S713 L714	P702-I710 HydrophobicContact CB-CD1 3.97Å; P702-I710 HydrophobicContact CG-CD1 4.37Å; E706-I710 VanDerWaalsContact O-CG1 3.28Å; E706-I710 WeakPolarHBondContact O-CG1 3.39Å; E706-I710 PolarHBondContact O-N 2.63Å; F707-I710 PolarHBondContact O-N 2.74Å; I710-S713 PolarHBondContact O-N 3.06Å; I710-L714 HydrophobicContact CG2-CD1 3.63Å; I710-L714 HydrophobicContact CG2-CG 4.19Å; I710-L714 VanDerWaalsContact O-CB 3.29Å; I710-L714 WeakPolarHBondContact O-CB 3.48Å; I710-L714 WeakPolarHBondContact O-CG 3.42Å; I710-L714 PolarHBondContact O-N 2.75Å
711	A	65.7	Low	75.3	Confident	14 Å²	14	73.6 Å²	73.6	12%	0.116	39%	0.393	C	S	.	.	H	α-helix	trans	-69.1	-42.4	179.7	0	0	0	0	0	112.3	F707 G708 Y709 S713 F715	F707-A711 HydrophobicContact CD1-CB 4.36Å; F707-A711 HydrophobicContact CE1-CB 3.84Å; F707-A711 HydrophobicContact CE2-CB 4.14Å; F707-A711 HydrophobicContact CZ-CB 3.72Å; F707-A711 WeakPolarHBondContact O-CB 3.47Å; F707-A711 PolarHBondContact O-N 3.02Å; G708-A711 PolarHBondContact O-N 3.21Å; Y709-A711 VanDerWaalsContact C-N 3.34Å; Y709-A711 PolarHBondContact O-N 2.91Å; A711-S713 VanDerWaalsContact C-N 3.27Å; A711-S713 PolarHBondContact O-N 3Å; A711-F715 WeakPolarHBondContact O-CB 3.4Å; A711-F715 PolarHBondContact O-N 3.09Å
712	E	67.7	Low	76.4	Confident	165 Å²	165	71.2 Å²	71.2	77%	0.771	40%	0.396	S	S	*	.	H	α-helix	trans	-66.9	-29	174.8	-70.4	-175.1	167	0	0	112.6	G708	G708-E712 PolarHBondContact O-N 2.99Å
713	S	71.6	Confident	77.7	Confident	93 Å²	93	72.6 Å²	72.6	65%	0.65	40%	0.402	S	S	*	.	H	α-helix	trans	-81.7	-38.3	177.5	-55.6	0	0	0	0	113.3	Y709 I710 A711	Y709-S713 VanDerWaalsContact O-CB 3.29Å; Y709-S713 WeakPolarHBondContact O-CB 3.49Å; Y709-S713 PolarHBondContact O-N 3.3Å; Y709-S713 PolarHBondContact O-OG 3.44Å; I710-S713 PolarHBondContact O-N 3.06Å; A711-S713 VanDerWaalsContact C-N 3.27Å; A711-S713 PolarHBondContact O-N 3Å
714	L	75.6	Confident	78.8	Confident	33 Å²	33	70.7 Å²	70.7	17%	0.173	39%	0.388	C	S	.	.	H	α-helix	trans	-92.2	-27.1	-176.2	-68.3	-178.2	0	0	0	114.4	I710 F729 D730 M731 L733	I710-L714 HydrophobicContact CG2-CD1 3.63Å; I710-L714 HydrophobicContact CG2-CG 4.19Å; I710-L714 VanDerWaalsContact O-CB 3.29Å; I710-L714 WeakPolarHBondContact O-CB 3.48Å; I710-L714 WeakPolarHBondContact O-CG 3.42Å; I710-L714 PolarHBondContact O-N 2.75Å; L714-F729 VanDerWaalsContact O-CA 3.22Å; L714-F729 WeakPolarHBondContact O-CA 3.47Å; L714-D730 PolarHBondContact O-N 3.47Å; L714-M731 HydrophobicContact CD2-CB 4.08Å; L714-L733 HydrophobicContact CD1-CD2 3.79Å; L714-L733 HydrophobicContact CD1-CG 4.45Å
715	F	83	Confident	80.3	Confident	14 Å²	14	66.4 Å²	66.4	6%	0.061	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	103.7	-174.7	-64.2	-90.6	0	0	0	112.4	A711 L727 R728 F729 L733 L745 V749	A711-F715 WeakPolarHBondContact O-CB 3.4Å; A711-F715 PolarHBondContact O-N 3.09Å; F715-L727 HydrophobicContact CD1-CD1 4.18Å; F715-R728 WeakPolarHBondContact CA-O 3.23Å; F715-F729 HydrophobicContact CD1-CB 3.55Å; F715-F729 HydrophobicContact CD1-CG 4.38Å; F715-F729 HydrophobicContact CE1-CB 3.6Å; F715-F729 HydrophobicContact CE1-CG 4.07Å; F715-F729 HydrophobicContact CG-CB 4.34Å; F715-F729 HydrophobicContact CZ-CB 4.43Å; F715-L733 HydrophobicContact CE2-CD1 3.93Å; F715-L733 HydrophobicContact CZ-CD1 4.06Å; F715-L745 HydrophobicContact CD1-CD1 4.47Å; F715-L745 HydrophobicContact CD2-CD1 4.22Å; F715-L745 HydrophobicContact CE1-CD1 4.24Å; F715-L745 HydrophobicContact CE2-CD1 3.97Å; F715-L745 HydrophobicContact CG-CD1 4.47Å; F715-L745 HydrophobicContact CZ-CD1 3.98Å; F715-V749 HydrophobicContact CB-CG2 3.98Å; F715-V749 HydrophobicContact CG-CG2 4.32Å
716	K	88.3	Confident	81.7	Confident	106 Å²	106	59.4 Å²	59.4	46%	0.461	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	124.4	167.4	-175.6	-174.6	172.8	-149.6	0	109.6	E718 Y726 R728	K716-E718 VanDerWaalsContact CE-OE2 3.3Å; K716-E718 WeakPolarHBondContact CE-OE2 3.39Å; K716-E718 IonicContact NZ-OE2 3.55Å; K716-E718 PolarHBondContact NZ-OE2 2.8Å; K716-Y726 HydrophobicContact CD-CE1 4.03Å; K716-Y726 HydrophobicContact CG-CE1 4.26Å; K716-R728 HydrophobicContact CB-CB 4.19Å; K716-R728 PolarHBondContact N-O 3.05Å; K716-R728 VanDerWaalsContact N-O 3.1Å; K716-R728 PolarHBondContact O-N 3.41Å
717	T	90.5	Very high	82.9	Confident	30 Å²	30	54.8 Å²	54.8	18%	0.184	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134.5	176	42.8	0	0	0	0	112.4	Y726 L727 V749 K752 M753	T717-Y726 WeakPolarHBondContact CA-O 3.43Å; T717-L727 HydrophobicContact CG2-CD1 3.81Å; T717-V749 HydrophobicContact CG2-CB 4.22Å; T717-V749 HydrophobicContact CG2-CG1 3.73Å; T717-V749 HydrophobicContact CG2-CG2 4.23Å; T717-K752 PolarHBondContact OG1-NZ 2.77Å; T717-M753 HydrophobicContact CG2-CE 4.43Å; T717-M753 HydrophobicContact CG2-SD 4.41Å
718	E	93.2	Very high	84.1	Confident	82 Å²	82	57.4 Å²	57.4	38%	0.383	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	149.6	180	-161.6	169	158	0	0	109.6	K716 L720 Y726 M753	K716-E718 VanDerWaalsContact CE-OE2 3.3Å; K716-E718 WeakPolarHBondContact CE-OE2 3.39Å; K716-E718 IonicContact NZ-OE2 3.55Å; K716-E718 PolarHBondContact NZ-OE2 2.8Å; E718-L720 HydrophobicContact CG-CD2 4.29Å; E718-Y726 HydrophobicContact CB-CD1 3.98Å; E718-Y726 PolarHBondContact N-O 2.89Å; E718-Y726 PolarHBondContact O-N 3.43Å; E718-M753 WeakPolarHBondContact O-CE 3.28Å
719	V	94	Very high	85.1	Confident	73 Å²	73	56.2 Å²	56.2	44%	0.442	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	110.5	168.7	-179	0	0	0	0	107.1	M753 T756	V719-M753 HydrophobicContact CG2-CE 3.81Å; V719-T756 HydrophobicContact CG1-CG2 4.19Å; V719-T756 HydrophobicContact CG2-CG2 4.18Å
720	L	93.8	Very high	86	Confident	18 Å²	18	50.2 Å²	50.2	9%	0.094	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	163.8	-175	-59.5	170.2	0	0	0	110.7	E718 G722 N723 I724 I760	E718-L720 HydrophobicContact CG-CD2 4.29Å; L720-G722 PolarHBondContact O-N 3.28Å; L720-N723 PolarHBondContact O-N 2.78Å; L720-I724 HydrophobicContact CB-CB 4.23Å; L720-I724 WeakPolarHBondContact CB-O 3.41Å; L720-I724 HydrophobicContact CD1-CG2 4.45Å; L720-I724 PolarHBondContact N-O 3.45Å; L720-I724 PolarHBondContact O-N 2.56Å; L720-I760 HydrophobicContact CD1-CD1 4.2Å
721	P	90.3	Very high	86.9	Confident	114 Å²	114	51.2 Å²	51.2	74%	0.74	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	141	171.2	-27.3	36.1	0	0	0	112.2
722	G	85.8	Confident	87.8	Confident	57 Å²	57	50.5 Å²	50.5	59%	0.588	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.5	11.7	-174.3	0	0	0	0	0	115.4	L720 I724	L720-G722 PolarHBondContact O-N 3.28Å; G722-I724 VanDerWaalsContact C-N 3.29Å; G722-I724 PolarHBondContact O-N 3Å
723	N	92.9	Very high	88.5	Confident	61 Å²	61	43.5 Å²	43.5	33%	0.326	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	41.7	-173.5	-166.6	34.2	0	0	0	112.1	L720 N755 T756 E757	L720-N723 PolarHBondContact O-N 2.78Å; N723-N755 PolarHBondContact ND2-O 3.09Å; N723-N755 VanDerWaalsContact ND2-O 3.15Å; N723-T756 CarbonylContact O-C 3.52Å; N723-T756 WeakPolarHBondContact O-CA 3.48Å; N723-T756 VanDerWaalsContact O-CB 3.23Å; N723-T756 WeakPolarHBondContact O-CB 3.49Å; N723-E757 HydrophobicContact CB-CG 4.27Å; N723-E757 PolarHBondContact ND2-OE1 3.18Å; N723-E757 PolarHBondContact O-N 3.16Å
724	I	95	Very high	89.1	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.015	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	120.2	177.3	-55.6	172.9	0	0	0	108.2	L720 G722 A758 I760 I912	L720-I724 HydrophobicContact CB-CB 4.23Å; L720-I724 WeakPolarHBondContact CB-O 3.41Å; L720-I724 HydrophobicContact CD1-CG2 4.45Å; L720-I724 PolarHBondContact N-O 3.45Å; L720-I724 PolarHBondContact O-N 2.56Å; G722-I724 VanDerWaalsContact C-N 3.29Å; G722-I724 PolarHBondContact O-N 3Å; I724-A758 HydrophobicContact CG2-CB 4.37Å; I724-I760 HydrophobicContact CG2-CD1 3.98Å; I724-I760 HydrophobicContact CG2-CG1 3.95Å; I724-I912 HydrophobicContact CD1-CB 4.15Å; I724-I912 HydrophobicContact CD1-CG2 3.58Å; I724-I912 HydrophobicContact CG1-CG2 3.92Å; I724-I912 HydrophobicContact CG2-CD1 3.96Å
725	G	96	Very high	89.5	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	143.3	173.3	0	0	0	0	0	111.3	A758 I760	G725-A758 PolarHBondContact N-O 3.47Å; G725-I760 PolarHBondContact O-N 3.32Å
726	Y	96.3	Very high	89.4	Confident	10 Å²	10	43.8 Å²	43.8	4%	0.039	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	121	169.6	170.5	-92.2	0	0	0	109.2	K716 T717 E718 R728 I760 D762 L905	K716-Y726 HydrophobicContact CD-CE1 4.03Å; K716-Y726 HydrophobicContact CG-CE1 4.26Å; T717-Y726 WeakPolarHBondContact CA-O 3.43Å; E718-Y726 HydrophobicContact CB-CD1 3.98Å; E718-Y726 PolarHBondContact N-O 2.89Å; E718-Y726 PolarHBondContact O-N 3.43Å; Y726-R728 HydrophobicContact CE1-CB 3.94Å; Y726-I760 WeakPolarHBondContact CA-O 3.35Å; Y726-I760 HydrophobicContact CD2-CB 4.39Å; Y726-I760 HydrophobicContact CD2-CG2 4.2Å; Y726-D762 HydrophobicContact CD2-CB 4.43Å; Y726-D762 HydrophobicContact CE2-CB 3.57Å; Y726-D762 WeakPolarHBondContact CE2-OD2 3.48Å; Y726-D762 PolarHBondContact OH-OD2 2.91Å; Y726-L905 HydrophobicContact CD2-CD1 3.97Å; Y726-L905 HydrophobicContact CE2-CD1 4.08Å; Y726-L905 HydrophobicContact CE2-CD2 4.4Å
727	L	94.3	Very high	89	Confident	12 Å²	12	39.7 Å²	39.7	6%	0.063	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	98.7	-178.5	174.7	59.8	0	0	0	109.1	F715 T717 F729 V749 M753 L759 I760 I761 D762	F715-L727 HydrophobicContact CD1-CD1 4.18Å; T717-L727 HydrophobicContact CG2-CD1 3.81Å; L727-F729 HydrophobicContact CG-CD1 4.4Å; L727-V749 HydrophobicContact CD1-CG1 3.62Å; L727-M753 HydrophobicContact CB-SD 4.27Å; L727-L759 HydrophobicContact CB-CD1 4.1Å; L727-I760 PolarHBondContact N-O 2.76Å; L727-I761 CarbonylContact O-C 3.49Å; L727-I761 VanDerWaalsContact O-CA 3.31Å; L727-I761 WeakPolarHBondContact O-CA 3.45Å; L727-D762 PolarHBondContact O-N 3.27Å
728	R	92.3	Very high	88.5	Confident	58 Å²	58	38.6 Å²	38.6	22%	0.219	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	138.2	168.5	174.3	173.7	157.2	168.1	-4	109.5	F715 K716 Y726 D730 D762	F715-R728 WeakPolarHBondContact CA-O 3.23Å; K716-R728 HydrophobicContact CB-CB 4.19Å; K716-R728 PolarHBondContact N-O 3.05Å; K716-R728 VanDerWaalsContact N-O 3.1Å; K716-R728 PolarHBondContact O-N 3.41Å; Y726-R728 HydrophobicContact CE1-CB 3.94Å; R728-D730 VanDerWaalsContact CG-OD1 3.29Å; R728-D730 WeakPolarHBondContact CG-OD1 3.38Å; R728-D730 IonicContact CZ-OD1 3.03Å; R728-D730 IonicContact CZ-OD2 3.96Å; R728-D730 IonicContact NE-OD1 3.51Å; R728-D730 PolarHBondContact NE-OD1 3.47Å; R728-D730 IonicContact NE-OD2 2.86Å; R728-D730 PolarHBondContact NE-OD2 3.46Å; R728-D730 IonicContact NH2-OD1 3.55Å; R728-D730 PolarHBondContact NH2-OD1 2.98Å; R728-D730 IonicContact NH2-OD2 3.72Å; R728-D730 PolarHBondContact NH2-OD2 2.77Å; R728-D762 WeakPolarHBondContact CA-O 3.3Å; R728-D762 HydrophobicContact CB-CB 3.88Å; R728-D762 HydrophobicContact CG-CB 4.3Å
729	F	87.4	Confident	88	Confident	6 Å²	6	39.1 Å²	39.1	3%	0.026	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	130.7	164.4	63.5	-87.8	0	0	0	112.8	L714 F715 L727 M732 I761 D762 M763 N766	L714-F729 VanDerWaalsContact O-CA 3.22Å; L714-F729 WeakPolarHBondContact O-CA 3.47Å; F715-F729 HydrophobicContact CD1-CB 3.55Å; F715-F729 HydrophobicContact CD1-CG 4.38Å; F715-F729 HydrophobicContact CE1-CB 3.6Å; F715-F729 HydrophobicContact CE1-CG 4.07Å; F715-F729 HydrophobicContact CG-CB 4.34Å; F715-F729 HydrophobicContact CZ-CB 4.43Å; L727-F729 HydrophobicContact CG-CD1 4.4Å; F729-M732 HydrophobicContact CE2-CE 3.77Å; F729-M732 HydrophobicContact CE2-SD 3.93Å; F729-M732 HydrophobicContact CZ-CE 4.21Å; F729-I761 HydrophobicContact CD1-CG2 4.27Å; F729-I761 HydrophobicContact CE1-CG2 3.59Å; F729-I761 HydrophobicContact CZ-CG2 4.42Å; F729-D762 PolarHBondContact N-O 2.74Å; F729-M763 HydrophobicContact CE2-CE 3.92Å; F729-M763 HydrophobicContact CZ-CE 3.65Å; F729-M763 HydrophobicContact CZ-SD 4.33Å; F729-N766 VanDerWaalsContact CD2-ND2 3.27Å; F729-N766 WeakPolarHBondContact CD2-ND2 3.44Å; F729-N766 WeakPolarHBondContact CE2-ND2 3.38Å; F729-N766 WeakPolarHBondContact O-CB 3.49Å; F729-N766 PolarHBondContact O-ND2 2.96Å
730	D	85.7	Confident	87.2	Confident	43 Å²	43	37.8 Å²	37.8	23%	0.23	22%	0.218	C	C	.	.	S	Bend	trans	-94.7	-4.8	-164.7	-67.9	2.6	0	0	0	113.9	L714 R728 N766	L714-D730 PolarHBondContact O-N 3.47Å; R728-D730 VanDerWaalsContact CG-OD1 3.29Å; R728-D730 WeakPolarHBondContact CG-OD1 3.38Å; R728-D730 IonicContact CZ-OD1 3.03Å; R728-D730 IonicContact CZ-OD2 3.96Å; R728-D730 IonicContact NE-OD1 3.51Å; R728-D730 PolarHBondContact NE-OD1 3.47Å; R728-D730 IonicContact NE-OD2 2.86Å; R728-D730 PolarHBondContact NE-OD2 3.46Å; R728-D730 IonicContact NH2-OD1 3.55Å; R728-D730 PolarHBondContact NH2-OD1 2.98Å; R728-D730 IonicContact NH2-OD2 3.72Å; R728-D730 PolarHBondContact NH2-OD2 2.77Å; D730-N766 WeakPolarHBondContact O-CA 3.48Å
731	M	84.9	Confident	86.3	Confident	83 Å²	83	37.2 Å²	37.2	41%	0.409	22%	0.216	S	C	.	.	S	Bend	trans	-150.9	143.2	176.1	-173.6	179.3	-72.6	0	0	110.8	L714 N766 G768	L714-M731 HydrophobicContact CD2-CB 4.08Å; M731-N766 PolarHBondContact N-ND2 3.3Å; M731-G768 WeakPolarHBondContact CA-O 3.36Å; M731-G768 WeakPolarHBondContact CG-O 3.29Å
732	M	85.4	Confident	85.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-82.5	113.7	169.7	-159.7	70.6	66.3	0	0	110.4	F729 M763 G768 G769 Y770 V774 F777 P832 F836	F729-M732 HydrophobicContact CE2-CE 3.77Å; F729-M732 HydrophobicContact CE2-SD 3.93Å; F729-M732 HydrophobicContact CZ-CE 4.21Å; M732-M763 HydrophobicContact CE-CE 4.03Å; M732-G768 PolarHBondContact N-O 3.32Å; M732-G769 WeakPolarHBondContact O-CA 3.46Å; M732-Y770 WeakPolarHBondContact CG-O 3.28Å; M732-Y770 PolarHBondContact O-N 3.12Å; M732-V774 HydrophobicContact CE-CG2 3.94Å; M732-V774 HydrophobicContact CG-CG2 4.05Å; M732-V774 HydrophobicContact SD-CG2 4.03Å; M732-F777 HydrophobicContact SD-CD2 3.57Å; M732-F777 VanDerWaalsContact SD-CD2 3.57Å; M732-F777 HydrophobicContact SD-CE2 3.62Å; M732-P832 HydrophobicContact CB-CB 3.75Å; M732-P832 HydrophobicContact CB-CG 4.27Å; M732-P832 HydrophobicContact CE-CB 4.25Å; M732-P832 WeakPolarHBondContact CE-O 3.37Å; M732-P832 HydrophobicContact CG-CB 3.68Å; M732-F836 HydrophobicContact CE-CB 4.09Å
733	L	82.5	Confident	85.4	Confident	18 Å²	18	32.6 Å²	32.6	9%	0.094	18%	0.177	C	C	.	.			trans	-76.1	157.8	-179.7	-68.5	177.7	0	0	0	112.7	L714 F715 V738 A773	L714-L733 HydrophobicContact CD1-CD2 3.79Å; L714-L733 HydrophobicContact CD1-CG 4.45Å; F715-L733 HydrophobicContact CE2-CD1 3.93Å; F715-L733 HydrophobicContact CZ-CD1 4.06Å; L733-V738 HydrophobicContact CB-CG2 3.68Å; L733-V738 HydrophobicContact CD1-CG2 4.24Å; L733-A773 WeakPolarHBondContact O-CB 3.5Å
734	D	83.1	Confident	84.7	Confident	28 Å²	28	32.8 Å²	32.8	15%	0.15	18%	0.176	C	C	.	.			trans	-68.9	147	169.4	175.3	-102.5	0	0	0	112.4	E736 V737 V738 Y770 T772	D734-E736 PolarHBondContact O-N 2.83Å; D734-E736 WeakPolarHBondContact OD1-CB 3.46Å; D734-E736 PolarHBondContact OD1-N 2.75Å; D734-V737 HydrophobicContact CB-CG2 4.22Å; D734-V737 WeakPolarHBondContact O-CB 3.3Å; D734-V737 PolarHBondContact O-N 3.09Å; D734-V738 WeakPolarHBondContact O-CG2 3.49Å; D734-V738 PolarHBondContact O-N 3.36Å; D734-Y770 HydrophobicContact CB-CD1 4.13Å; D734-Y770 HydrophobicContact CB-CD2 3.99Å; D734-Y770 HydrophobicContact CB-CG 3.78Å; D734-T772 PolarHBondContact OD2-OG1 2.57Å
735	I	83.9	Confident	84	Confident	25 Å²	25	33.5 Å²	33.5	13%	0.128	18%	0.18	C	C	.	.	H	α-helix	trans	-62.7	-35	-177.4	-162.9	176	0	0	0	114	V738 K739 T772 A773 L776	I735-V738 PolarHBondContact O-N 3.05Å; I735-K739 HydrophobicContact CG1-CD 4.31Å; I735-K739 WeakPolarHBondContact O-CB 3.16Å; I735-K739 WeakPolarHBondContact O-CD 3.43Å; I735-K739 WeakPolarHBondContact O-CG 3.24Å; I735-K739 PolarHBondContact O-N 3.25Å; I735-T772 PolarHBondContact N-OG1 2.67Å; I735-A773 HydrophobicContact CB-CB 4.35Å; I735-L776 HydrophobicContact CG1-CD2 4.17Å
736	E	82.8	Confident	83.5	Confident	93 Å²	93	35 Å²	35	44%	0.435	19%	0.187	S	C	.	.	H	α-helix	trans	-73.3	-36.9	178	-60.9	-49	134.5	0	0	111.1	M701 D734 K739 G740	M701-E736 HydrophobicContact CE-CB 4.28Å; M701-E736 VanDerWaalsContact CE-O 3.25Å; M701-E736 WeakPolarHBondContact CE-O 3.49Å; D734-E736 PolarHBondContact O-N 2.83Å; D734-E736 WeakPolarHBondContact OD1-CB 3.46Å; D734-E736 PolarHBondContact OD1-N 2.75Å; E736-K739 PolarHBondContact O-N 3.45Å; E736-K739 IonicContact OE1-NZ 2.69Å; E736-K739 PolarHBondContact OE1-NZ 2.94Å; E736-K739 WeakPolarHBondContact OE2-CD 3.14Å; E736-K739 IonicContact OE2-NZ 3.71Å; E736-G740 PolarHBondContact O-N 2.78Å
737	V	78.8	Confident	82.8	Confident	19 Å²	19	39.5 Å²	39.5	12%	0.115	21%	0.212	C	C	.	.	H	α-helix	trans	-58.3	-51.5	169.3	-179.6	0	0	0	0	109.8	P702 D734 K739 G740 V741	P702-V737 HydrophobicContact CG-CG1 4.48Å; D734-V737 HydrophobicContact CB-CG2 4.22Å; D734-V737 WeakPolarHBondContact O-CB 3.3Å; D734-V737 PolarHBondContact O-N 3.09Å; V737-K739 VanDerWaalsContact C-N 3.31Å; V737-K739 PolarHBondContact O-N 2.94Å; V737-G740 PolarHBondContact O-N 3.23Å; V737-V741 VanDerWaalsContact O-CG2 3.23Å; V737-V741 WeakPolarHBondContact O-CG2 3.26Å; V737-V741 PolarHBondContact O-N 2.77Å
738	V	80.9	Confident	82.1	Confident	8 Å²	8	41.9 Å²	41.9	5%	0.048	23%	0.23	C	C	.	.	H	α-helix	trans	-60.3	-36.6	178	175.9	0	0	0	0	112.4	L733 D734 I735 G742 L745 A773 L776 F777	L733-V738 HydrophobicContact CB-CG2 3.68Å; L733-V738 HydrophobicContact CD1-CG2 4.24Å; D734-V738 WeakPolarHBondContact O-CG2 3.49Å; D734-V738 PolarHBondContact O-N 3.36Å; I735-V738 PolarHBondContact O-N 3.05Å; V738-G742 VanDerWaalsContact O-CA 3.22Å; V738-G742 WeakPolarHBondContact O-CA 3.48Å; V738-G742 PolarHBondContact O-N 3.47Å; V738-L745 HydrophobicContact CG1-CD2 4.46Å; V738-A773 HydrophobicContact CG2-CB 4.28Å; V738-L776 HydrophobicContact CB-CD2 4.46Å; V738-L776 HydrophobicContact CG1-CD2 3.7Å; V738-F777 HydrophobicContact CG2-CZ 4.16Å
739	K	81	Confident	81.8	Confident	93 Å²	93	39.7 Å²	39.7	40%	0.404	22%	0.223	S	C	.	.	H	α-helix	trans	-67.4	-41.1	175	-77.9	162.5	175.5	174	0	112.8	I735 E736 V737 R811	I735-K739 HydrophobicContact CG1-CD 4.31Å; I735-K739 WeakPolarHBondContact O-CB 3.16Å; I735-K739 WeakPolarHBondContact O-CD 3.43Å; I735-K739 WeakPolarHBondContact O-CG 3.24Å; I735-K739 PolarHBondContact O-N 3.25Å; E736-K739 PolarHBondContact O-N 3.45Å; E736-K739 IonicContact OE1-NZ 2.69Å; E736-K739 PolarHBondContact OE1-NZ 2.94Å; E736-K739 WeakPolarHBondContact OE2-CD 3.14Å; E736-K739 IonicContact OE2-NZ 3.71Å; V737-K739 VanDerWaalsContact C-N 3.31Å; V737-K739 PolarHBondContact O-N 2.94Å; K739-R811 PolarHBondContact O-NH1 2.76Å
740	G	77.1	Confident	81.9	Confident	45 Å²	45	40.4 Å²	40.4	46%	0.464	23%	0.226	S	C	.	.	H	α-helix	trans	-64.7	-50.4	178.5	0	0	0	0	0	112	E736 V737	E736-G740 PolarHBondContact O-N 2.78Å; V737-G740 PolarHBondContact O-N 3.23Å
741	V	75.9	Confident	82.1	Confident	6 Å²	6	45.3 Å²	45.3	4%	0.036	25%	0.245	C	C	.	.	H	α-helix	trans	-88.9	-5.7	-174.4	-50.4	0	0	0	0	113.9	F707 V737 P743 Q744 L745	F707-V741 HydrophobicContact CB-CG1 3.98Å; F707-V741 HydrophobicContact CD1-CB 3.65Å; F707-V741 HydrophobicContact CD1-CG1 4.04Å; F707-V741 HydrophobicContact CD1-CG2 4.26Å; F707-V741 HydrophobicContact CD2-CB 3.72Å; F707-V741 HydrophobicContact CD2-CG1 3.55Å; F707-V741 HydrophobicContact CD2-CG2 3.8Å; F707-V741 HydrophobicContact CE1-CB 3.7Å; F707-V741 HydrophobicContact CE1-CG2 3.87Å; F707-V741 HydrophobicContact CE2-CB 3.77Å; F707-V741 HydrophobicContact CE2-CG1 4.07Å; F707-V741 HydrophobicContact CE2-CG2 3.36Å; F707-V741 HydrophobicContact CG-CB 3.66Å; F707-V741 HydrophobicContact CG-CG1 3.53Å; F707-V741 HydrophobicContact CG-CG2 4.23Å; F707-V741 HydrophobicContact CZ-CB 3.76Å; F707-V741 HydrophobicContact CZ-CG2 3.39Å; V737-V741 VanDerWaalsContact O-CG2 3.23Å; V737-V741 WeakPolarHBondContact O-CG2 3.26Å; V737-V741 PolarHBondContact O-N 2.77Å; V741-P743 VanDerWaalsContact C-N 3.35Å; V741-P743 VanDerWaalsContact O-N 3.11Å; V741-Q744 WeakPolarHBondContact O-CA 3.31Å; V741-Q744 WeakPolarHBondContact O-CB 3.22Å; V741-Q744 PolarHBondContact O-N 3.29Å; V741-L745 PolarHBondContact O-N 2.98Å; V741-L745 VanDerWaalsContact O-N 3.15Å
742	G	76.9	Confident	82.2	Confident	9 Å²	9	46.5 Å²	46.5	9%	0.093	25%	0.248	C	C	.	.	H	α-helix	trans	-46.8	-40.8	-173.9	0	0	0	0	0	116.4	V738 Q744 L745 L746	V738-G742 VanDerWaalsContact O-CA 3.22Å; V738-G742 WeakPolarHBondContact O-CA 3.48Å; V738-G742 PolarHBondContact O-N 3.47Å; G742-Q744 VanDerWaalsContact C-N 3.28Å; G742-Q744 PolarHBondContact O-N 3.16Å; G742-L745 PolarHBondContact O-N 2.91Å; G742-L746 WeakPolarHBondContact O-CB 3.39Å; G742-L746 VanDerWaalsContact O-CG 3.27Å; G742-L746 WeakPolarHBondContact O-CG 3.24Å; G742-L746 PolarHBondContact O-N 2.88Å
743	P	80.9	Confident	82.5	Confident	65 Å²	65	46.5 Å²	46.5	42%	0.422	25%	0.248	S	C	.	.	H	α-helix	trans	-62.3	-31	175.4	-23.7	35.3	0	0	0	114.2	V741 N747	V741-P743 VanDerWaalsContact C-N 3.35Å; V741-P743 VanDerWaalsContact O-N 3.11Å; P743-N747 PolarHBondContact O-N 3.3Å; P743-N747 PolarHBondContact O-ND2 2.96Å
744	Q	77.6	Confident	83	Confident	64 Å²	64	46.1 Å²	46.1	30%	0.299	25%	0.246	S	C	.	.	H	α-helix	trans	-79.7	-42.8	177.9	-62.2	168.2	-69.5	0	0	110.6	P704 F707 V741 G742 L746 N747 S748	P704-Q744 PolarHBondContact O-NE2 2.57Å; F707-Q744 HydrophobicContact CD1-CB 3.95Å; F707-Q744 HydrophobicContact CE1-CB 3.82Å; V741-Q744 WeakPolarHBondContact O-CA 3.31Å; V741-Q744 WeakPolarHBondContact O-CB 3.22Å; V741-Q744 PolarHBondContact O-N 3.29Å; G742-Q744 VanDerWaalsContact C-N 3.28Å; G742-Q744 PolarHBondContact O-N 3.16Å; Q744-L746 VanDerWaalsContact C-N 3.34Å; Q744-L746 PolarHBondContact O-N 3.49Å; Q744-N747 PolarHBondContact O-N 2.89Å; Q744-S748 VanDerWaalsContact O-CB 3.32Å; Q744-S748 WeakPolarHBondContact O-CB 3.16Å; Q744-S748 PolarHBondContact O-N 2.82Å; Q744-S748 PolarHBondContact O-OG 2.97Å
745	L	80.7	Confident	83.3	Confident	19 Å²	19	49.6 Å²	49.6	10%	0.099	26%	0.264	C	S	.	.	H	α-helix	trans	-58.9	-44.8	173.6	-171.6	71.5	0	0	0	111.2	F707 F715 V738 V741 G742 N747 V749 W750	F707-L745 HydrophobicContact CZ-CB 4.39Å; F707-L745 HydrophobicContact CZ-CD1 4.38Å; F715-L745 HydrophobicContact CD1-CD1 4.47Å; F715-L745 HydrophobicContact CD2-CD1 4.22Å; F715-L745 HydrophobicContact CE1-CD1 4.24Å; F715-L745 HydrophobicContact CE2-CD1 3.97Å; F715-L745 HydrophobicContact CG-CD1 4.47Å; F715-L745 HydrophobicContact CZ-CD1 3.98Å; V738-L745 HydrophobicContact CG1-CD2 4.46Å; V741-L745 PolarHBondContact O-N 2.98Å; V741-L745 VanDerWaalsContact O-N 3.15Å; G742-L745 PolarHBondContact O-N 2.91Å; L745-N747 PolarHBondContact O-N 2.86Å; L745-V749 HydrophobicContact CD1-CB 4.07Å; L745-V749 HydrophobicContact CD1-CG1 4.48Å; L745-V749 HydrophobicContact CD1-CG2 3.9Å; L745-V749 WeakPolarHBondContact O-CA 3.36Å; L745-V749 WeakPolarHBondContact O-CB 3.33Å; L745-V749 PolarHBondContact O-N 3.48Å; L745-W750 PolarHBondContact O-N 3.41Å; L745-W750 VanDerWaalsContact O-N 3.12Å
746	L	84.8	Confident	83.8	Confident	30 Å²	30	48.4 Å²	48.4	16%	0.157	26%	0.259	C	S	.	.	I	π-helix	trans	-61.6	-41.3	177.3	-76.7	171	0	0	0	112.7	G742 Q744 W750 K751 Y780 R811	G742-L746 WeakPolarHBondContact O-CB 3.39Å; G742-L746 VanDerWaalsContact O-CG 3.27Å; G742-L746 WeakPolarHBondContact O-CG 3.24Å; G742-L746 PolarHBondContact O-N 2.88Å; Q744-L746 VanDerWaalsContact C-N 3.34Å; Q744-L746 PolarHBondContact O-N 3.49Å; L746-W750 HydrophobicContact CD2-CB 3.89Å; L746-W750 HydrophobicContact CD2-CG 3.98Å; L746-K751 VanDerWaalsContact O-CB 3.3Å; L746-K751 WeakPolarHBondContact O-CB 3.39Å; L746-K751 PolarHBondContact O-N 2.76Å; L746-Y780 HydrophobicContact CD2-CE1 4.17Å; L746-R811 HydrophobicContact CD1-CB 3.71Å
747	N	81.9	Confident	84.2	Confident	105 Å²	105	49.8 Å²	49.8	56%	0.561	27%	0.265	S	S	*	.	I	π-helix	trans	-76	-38	-179.5	-81.2	-56	0	0	0	113.7	P743 Q744 L745	P743-N747 PolarHBondContact O-N 3.3Å; P743-N747 PolarHBondContact O-ND2 2.96Å; Q744-N747 PolarHBondContact O-N 2.89Å; L745-N747 PolarHBondContact O-N 2.86Å
748	S	80.4	Confident	85	Confident	63 Å²	63	49.1 Å²	49.1	44%	0.441	26%	0.261	S	S	.	.	I	π-helix	trans	-94.3	-30.8	-169.4	-46.6	0	0	0	0	113.5	Q744 K752	Q744-S748 VanDerWaalsContact O-CB 3.32Å; Q744-S748 WeakPolarHBondContact O-CB 3.16Å; Q744-S748 PolarHBondContact O-N 2.82Å; Q744-S748 PolarHBondContact O-OG 2.97Å; S748-K752 WeakPolarHBondContact O-CD 3.34Å; S748-K752 WeakPolarHBondContact O-CE 3.05Å; S748-K752 PolarHBondContact O-NZ 3.14Å
749	V	85.7	Confident	85.7	Confident	11 Å²	11	48.7 Å²	48.7	7%	0.067	26%	0.259	C	S	.	.	I	π-helix	trans	-108.7	-66.7	-179.6	171.3	0	0	0	0	109.6	F715 T717 L727 L745 K751 K752	F715-V749 HydrophobicContact CB-CG2 3.98Å; F715-V749 HydrophobicContact CG-CG2 4.32Å; T717-V749 HydrophobicContact CG2-CB 4.22Å; T717-V749 HydrophobicContact CG2-CG1 3.73Å; T717-V749 HydrophobicContact CG2-CG2 4.23Å; L727-V749 HydrophobicContact CD1-CG1 3.62Å; L745-V749 HydrophobicContact CD1-CB 4.07Å; L745-V749 HydrophobicContact CD1-CG1 4.48Å; L745-V749 HydrophobicContact CD1-CG2 3.9Å; L745-V749 WeakPolarHBondContact O-CA 3.36Å; L745-V749 WeakPolarHBondContact O-CB 3.33Å; L745-V749 PolarHBondContact O-N 3.48Å; V749-K751 PolarHBondContact O-N 3.34Å; V749-K752 WeakPolarHBondContact O-CB 3.33Å; V749-K752 PolarHBondContact O-N 3.44Å
750	W	89.9	Confident	86.5	Confident	22 Å²	22	44.3 Å²	44.3	8%	0.083	24%	0.24	C	C	.	.	I	π-helix	trans	-66.8	-37.8	-164.3	-164.8	-116.5	0	0	0	114.4	L745 L746 K752 M753 V754 Y780 F781 Q813 Y815	L745-W750 PolarHBondContact O-N 3.41Å; L745-W750 VanDerWaalsContact O-N 3.12Å; L746-W750 HydrophobicContact CD2-CB 3.89Å; L746-W750 HydrophobicContact CD2-CG 3.98Å; W750-K752 PolarHBondContact O-N 3.42Å; W750-K752 VanDerWaalsContact O-N 3.16Å; W750-M753 HydrophobicContact CE3-CB 4.38Å; W750-M753 PolarHBondContact O-N 2.95Å; W750-V754 HydrophobicContact CZ2-CG2 4.45Å; W750-V754 PolarHBondContact O-N 3.26Å; W750-Y780 HydrophobicContact CD2-CD1 4.33Å; W750-Y780 AromaticContact CE2-CD1 3.61Å; W750-Y780 HydrophobicContact CH2-CD1 4.35Å; W750-Y780 HydrophobicContact CH2-CG 4.4Å; W750-Y780 AromaticContact CZ2-CD1 3.63Å; W750-Y780 HydrophobicContact CZ2-CD1 3.63Å; W750-Y780 HydrophobicContact CZ2-CG 4.08Å; W750-Y780 AromaticContact NE1-CD1 3.71Å; W750-Y780 AromaticContact NE1-CE1 3.89Å; W750-F781 AromaticContact CH2-CE1 3.72Å; W750-F781 HydrophobicContact CH2-CE1 3.72Å; W750-F781 AromaticContact CH2-CZ 3.88Å; W750-F781 HydrophobicContact CH2-CZ 3.88Å; W750-F781 HydrophobicContact CZ3-CE1 4.32Å; W750-F781 HydrophobicContact CZ3-CZ 4.13Å; W750-Q813 PolarHBondContact NE1-O 2.93Å; W750-Y815 HydrophobicContact CH2-CD2 4.31Å; W750-Y815 HydrophobicContact CH2-CG 4.4Å; W750-Y815 HydrophobicContact CZ2-CD2 4.4Å
751	K	88.1	Confident	87.4	Confident	145 Å²	145	42.2 Å²	42.2	63%	0.63	22%	0.218	S	C	*	.	H	α-helix	trans	-59	-25.8	178.2	-176.7	176.2	178.7	-178	0	113.8	L746 V749	L746-K751 VanDerWaalsContact O-CB 3.3Å; L746-K751 WeakPolarHBondContact O-CB 3.39Å; L746-K751 PolarHBondContact O-N 2.76Å; V749-K751 PolarHBondContact O-N 3.34Å
752	K	88.4	Confident	88.3	Confident	109 Å²	109	41.9 Å²	41.9	47%	0.474	22%	0.216	S	C	.	.	H	α-helix	trans	-76.5	-33.9	173	-62	168.5	177.8	156.5	0	112.1	T717 S748 V749 W750	T717-K752 PolarHBondContact OG1-NZ 2.77Å; S748-K752 WeakPolarHBondContact O-CD 3.34Å; S748-K752 WeakPolarHBondContact O-CE 3.05Å; S748-K752 PolarHBondContact O-NZ 3.14Å; V749-K752 WeakPolarHBondContact O-CB 3.33Å; V749-K752 PolarHBondContact O-N 3.44Å; W750-K752 PolarHBondContact O-N 3.42Å; W750-K752 VanDerWaalsContact O-N 3.16Å
753	M	91.9	Very high	89.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-90.6	-38.1	-170.8	-57.4	-65.7	94.8	0	0	113	T717 E718 V719 L727 W750 N755 T756 L759 Y815	T717-M753 HydrophobicContact CG2-CE 4.43Å; T717-M753 HydrophobicContact CG2-SD 4.41Å; E718-M753 WeakPolarHBondContact O-CE 3.28Å; V719-M753 HydrophobicContact CG2-CE 3.81Å; L727-M753 HydrophobicContact CB-SD 4.27Å; W750-M753 HydrophobicContact CE3-CB 4.38Å; W750-M753 PolarHBondContact O-N 2.95Å; M753-N755 PolarHBondContact O-N 3.33Å; M753-T756 PolarHBondContact O-N 2.83Å; M753-T756 PolarHBondContact O-OG1 2.86Å; M753-L759 HydrophobicContact CB-CD1 4.35Å; M753-L759 HydrophobicContact CG-CD1 4.37Å; M753-L759 HydrophobicContact SD-CD1 3.85Å; M753-Y815 WeakPolarHBondContact O-CE2 3.46Å
754	V	91.7	Very high	89.8	Confident	9 Å²	9	39.1 Å²	39.1	6%	0.055	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.3	-166	72	0	0	0	0	115.3	W750 Q813 K819	W750-V754 HydrophobicContact CZ2-CG2 4.45Å; W750-V754 PolarHBondContact O-N 3.26Å; V754-Q813 HydrophobicContact CG2-CB 4.06Å; V754-Q813 HydrophobicContact CG2-CG 3.86Å; V754-K819 PolarHBondContact O-NZ 2.95Å
755	N	90.9	Very high	90.4	Very high	101 Å²	101	40.3 Å²	40.3	54%	0.54	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	12.5	-179.7	-61.4	-40.2	0	0	0	114.4	N723 M753	N723-N755 PolarHBondContact ND2-O 3.09Å; N723-N755 VanDerWaalsContact ND2-O 3.15Å; M753-N755 PolarHBondContact O-N 3.33Å
756	T	94.5	Very high	90.8	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.006	19%	0.192	C	C	.	.			trans	-76.5	156.6	170	59.5	0	0	0	0	110.7	V719 N723 M753 A758 Y815 K819	V719-T756 HydrophobicContact CG1-CG2 4.19Å; V719-T756 HydrophobicContact CG2-CG2 4.18Å; N723-T756 CarbonylContact O-C 3.52Å; N723-T756 WeakPolarHBondContact O-CA 3.48Å; N723-T756 VanDerWaalsContact O-CB 3.23Å; N723-T756 WeakPolarHBondContact O-CB 3.49Å; M753-T756 PolarHBondContact O-N 2.83Å; M753-T756 PolarHBondContact O-OG1 2.86Å; T756-A758 WeakPolarHBondContact CB-O 3.29Å; T756-A758 PolarHBondContact OG1-O 2.78Å; T756-A758 VanDerWaalsContact OG1-O 3.07Å; T756-Y815 PolarHBondContact O-OH 3.23Å; T756-Y815 PolarHBondContact OG1-OH 3.39Å; T756-Y815 VanDerWaalsContact OG1-OH 3.05Å; T756-K819 WeakPolarHBondContact O-CD 3.45Å; T756-K819 WeakPolarHBondContact O-CE 3.46Å; T756-K819 PolarHBondContact O-NZ 2.94Å
757	E	91	Very high	90.7	Very high	121 Å²	121	42.4 Å²	42.4	57%	0.565	21%	0.212	S	C	*	.	S	Bend	trans	-78.3	-36.8	178.6	-56.8	-44.2	136.1	0	0	111.9	N723 K819	N723-E757 HydrophobicContact CB-CG 4.27Å; N723-E757 PolarHBondContact ND2-OE1 3.18Å; N723-E757 PolarHBondContact O-N 3.16Å; E757-K819 WeakPolarHBondContact O-CB 3.47Å
758	A	93.9	Very high	90.7	Very high	5 Å²	5	37.5 Å²	37.5	4%	0.041	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	157.8	174.8	0	0	0	0	0	110.2	I724 G725 T756 Y815 D820 I912	I724-A758 HydrophobicContact CG2-CB 4.37Å; G725-A758 PolarHBondContact N-O 3.47Å; T756-A758 WeakPolarHBondContact CB-O 3.29Å; T756-A758 PolarHBondContact OG1-O 2.78Å; T756-A758 VanDerWaalsContact OG1-O 3.07Å; A758-Y815 WeakPolarHBondContact CA-OH 3.29Å; A758-Y815 PolarHBondContact N-OH 3.17Å; A758-Y815 PolarHBondContact O-OH 3.42Å; A758-D820 WeakPolarHBondContact CA-O 3.14Å; A758-D820 HydrophobicContact CB-CB 4.02Å; A758-I912 HydrophobicContact CB-CD1 4.08Å; A758-I912 HydrophobicContact CB-CG1 4.26Å; A758-I912 HydrophobicContact CB-CG2 3.53Å
759	L	96.1	Very high	90.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	130.4	177.6	-179.8	67.2	0	0	0	110.9	L727 M753 I761 F781 Y815 D820 L821 V822	L727-L759 HydrophobicContact CB-CD1 4.1Å; M753-L759 HydrophobicContact CB-CD1 4.35Å; M753-L759 HydrophobicContact CG-CD1 4.37Å; M753-L759 HydrophobicContact SD-CD1 3.85Å; L759-I761 HydrophobicContact CD2-CD1 4.33Å; L759-I761 HydrophobicContact CD2-CG1 4Å; L759-I761 HydrophobicContact CG-CG1 4.15Å; L759-F781 HydrophobicContact CD2-CE1 3.66Å; L759-F781 HydrophobicContact CD2-CZ 4.1Å; L759-Y815 HydrophobicContact CB-CE1 3.82Å; L759-Y815 HydrophobicContact CB-CE2 4.29Å; L759-Y815 PolarHBondContact N-OH 3.41Å; L759-D820 PolarHBondContact N-O 2.98Å; L759-L821 HydrophobicContact CB-CD1 3.91Å; L759-L821 HydrophobicContact CD2-CD1 3.91Å; L759-L821 HydrophobicContact CG-CD1 4.08Å; L759-L821 WeakPolarHBondContact O-CA 3.28Å; L759-V822 PolarHBondContact O-N 3.1Å
760	I	97.3	Very high	90.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	116.6	167.9	-57.4	177.4	0	0	0	107.7	L720 I724 G725 Y726 L727 V822 L824 L905 A908 Q909 I912	L720-I760 HydrophobicContact CD1-CD1 4.2Å; I724-I760 HydrophobicContact CG2-CD1 3.98Å; I724-I760 HydrophobicContact CG2-CG1 3.95Å; G725-I760 PolarHBondContact O-N 3.32Å; Y726-I760 WeakPolarHBondContact CA-O 3.35Å; Y726-I760 HydrophobicContact CD2-CB 4.39Å; Y726-I760 HydrophobicContact CD2-CG2 4.2Å; L727-I760 PolarHBondContact N-O 2.76Å; I760-V822 CarbonylContact C-O 3.59Å; I760-V822 WeakPolarHBondContact CA-O 3.37Å; I760-V822 HydrophobicContact CG1-CB 4.46Å; I760-L824 HydrophobicContact CG2-CD1 3.72Å; I760-L824 HydrophobicContact CG2-CD2 4.12Å; I760-L824 HydrophobicContact CG2-CG 3.72Å; I760-L905 HydrophobicContact CD1-CD1 3.85Å; I760-L905 HydrophobicContact CG2-CD1 4.2Å; I760-A908 HydrophobicContact CD1-CB 3.97Å; I760-A908 HydrophobicContact CG1-CB 4.46Å; I760-Q909 HydrophobicContact CD1-CG 4.17Å; I760-I912 HydrophobicContact CD1-CD1 3.96Å; I760-I912 HydrophobicContact CG1-CD1 3.66Å
761	I	96.4	Very high	90.3	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	120	168.8	-57.2	-178.7	0	0	0	107.8	L727 F729 L759 M763 F781 L821 V822 I823 L824 F836	L727-I761 CarbonylContact O-C 3.49Å; L727-I761 VanDerWaalsContact O-CA 3.31Å; L727-I761 WeakPolarHBondContact O-CA 3.45Å; F729-I761 HydrophobicContact CD1-CG2 4.27Å; F729-I761 HydrophobicContact CE1-CG2 3.59Å; F729-I761 HydrophobicContact CZ-CG2 4.42Å; L759-I761 HydrophobicContact CD2-CD1 4.33Å; L759-I761 HydrophobicContact CD2-CG1 4Å; L759-I761 HydrophobicContact CG-CG1 4.15Å; I761-M763 HydrophobicContact CG2-CG 3.81Å; I761-M763 HydrophobicContact CG2-SD 3.99Å; I761-F781 HydrophobicContact CD1-CE1 4.28Å; I761-F781 HydrophobicContact CD1-CE2 4.01Å; I761-F781 HydrophobicContact CD1-CZ 3.66Å; I761-L821 HydrophobicContact CD1-CD1 3.87Å; I761-L821 HydrophobicContact CG1-CD1 4.03Å; I761-V822 PolarHBondContact N-O 3.12Å; I761-I823 HydrophobicContact CB-CG1 4.33Å; I761-I823 CarbonylContact O-C 3.56Å; I761-I823 WeakPolarHBondContact O-CA 3.09Å; I761-L824 PolarHBondContact O-N 2.94Å; I761-F836 HydrophobicContact CD1-CE1 3.93Å; I761-F836 HydrophobicContact CD1-CZ 3.81Å; I761-F836 HydrophobicContact CG2-CE1 4.48Å
762	D	95.9	Very high	90.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	111.6	-176.3	-176	7.1	0	0	0	110.9	Y726 L727 R728 F729 R764 L824	Y726-D762 HydrophobicContact CD2-CB 4.43Å; Y726-D762 HydrophobicContact CE2-CB 3.57Å; Y726-D762 WeakPolarHBondContact CE2-OD2 3.48Å; Y726-D762 PolarHBondContact OH-OD2 2.91Å; L727-D762 PolarHBondContact O-N 3.27Å; R728-D762 WeakPolarHBondContact CA-O 3.3Å; R728-D762 HydrophobicContact CB-CB 3.88Å; R728-D762 HydrophobicContact CG-CB 4.3Å; F729-D762 PolarHBondContact N-O 2.74Å; D762-R764 WeakPolarHBondContact OD1-CB 3.29Å; D762-R764 WeakPolarHBondContact OD1-CG 3.38Å; D762-R764 IonicContact OD1-CZ 3.44Å; D762-R764 PolarHBondContact OD1-N 2.9Å; D762-R764 IonicContact OD1-NE 3.34Å; D762-R764 PolarHBondContact OD1-NE 2.93Å; D762-R764 IonicContact OD1-NH2 3.33Å; D762-R764 IonicContact OD2-CZ 2.63Å; D762-R764 IonicContact OD2-NE 3.72Å; D762-R764 IonicContact OD2-NH2 2.7Å; D762-R764 PolarHBondContact OD2-NH2 3.37Å; D762-L824 HydrophobicContact CB-CD1 4.19Å
763	M	94.3	Very high	90.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.18	C	C	.	.			trans	-118.9	11.5	-174.7	-50.5	-175.1	73.8	0	0	111.8	F729 M732 I761 Y765 N766 I823 L824 T829 A833 F836	F729-M763 HydrophobicContact CE2-CE 3.92Å; F729-M763 HydrophobicContact CZ-CE 3.65Å; F729-M763 HydrophobicContact CZ-SD 4.33Å; M732-M763 HydrophobicContact CE-CE 4.03Å; I761-M763 HydrophobicContact CG2-CG 3.81Å; I761-M763 HydrophobicContact CG2-SD 3.99Å; M763-Y765 PolarHBondContact O-N 3.13Å; M763-N766 HydrophobicContact CB-CB 4.31Å; M763-N766 PolarHBondContact O-N 2.98Å; M763-I823 HydrophobicContact CG-CG2 4.18Å; M763-I823 HydrophobicContact SD-CG2 3.74Å; M763-L824 CarbonylContact C-O 3.59Å; M763-L824 WeakPolarHBondContact CA-O 3.34Å; M763-L824 WeakPolarHBondContact CB-O 3.47Å; M763-L824 PolarHBondContact N-O 3.25Å; M763-T829 HydrophobicContact CB-CG2 4.26Å; M763-T829 PolarHBondContact O-OG1 2.92Å; M763-A833 HydrophobicContact CE-CB 3.78Å; M763-F836 HydrophobicContact CE-CB 4.32Å; M763-F836 HydrophobicContact CE-CD1 3.9Å; M763-F836 HydrophobicContact CE-CG 4.4Å; M763-F836 HydrophobicContact SD-CD1 3.55Å; M763-F836 VanDerWaalsContact SD-CD1 3.55Å; M763-F836 HydrophobicContact SD-CE1 4Å
764	R	94.1	Very high	90.2	Very high	15 Å²	15	33.1 Å²	33.1	6%	0.057	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-6.5	179.6	-66.2	176.9	-65.8	168	2.6	114.7	D762 L824 S826 V901	D762-R764 WeakPolarHBondContact OD1-CB 3.29Å; D762-R764 WeakPolarHBondContact OD1-CG 3.38Å; D762-R764 IonicContact OD1-CZ 3.44Å; D762-R764 PolarHBondContact OD1-N 2.9Å; D762-R764 IonicContact OD1-NE 3.34Å; D762-R764 PolarHBondContact OD1-NE 2.93Å; D762-R764 IonicContact OD1-NH2 3.33Å; D762-R764 IonicContact OD2-CZ 2.63Å; D762-R764 IonicContact OD2-NE 3.72Å; D762-R764 IonicContact OD2-NH2 2.7Å; D762-R764 PolarHBondContact OD2-NH2 3.37Å; R764-L824 HydrophobicContact CG-CB 3.78Å; R764-L824 PolarHBondContact N-O 3.45Å; R764-S826 VanDerWaalsContact C-OG 3.22Å; R764-S826 WeakPolarHBondContact CA-OG 3.27Å; R764-S826 WeakPolarHBondContact O-CB 3.4Å; R764-S826 PolarHBondContact O-OG 3.04Å; R764-V901 HydrophobicContact CG-CG2 4.48Å; R764-V901 PolarHBondContact NH1-O 2.88Å
765	Y	89.9	Confident	90.2	Very high	89 Å²	89	33.3 Å²	33.3	35%	0.349	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.3	4.4	-178.5	-54.5	-84.2	0	0	0	112.4	M763 T767	M763-Y765 PolarHBondContact O-N 3.13Å; Y765-T767 PolarHBondContact O-N 3.25Å
766	N	89.1	Confident	90.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.161	C	C	.	.			trans	-97.9	93	-171.2	-167.8	-37.8	0	0	0	111.5	F729 D730 M731 M763 G768 T829 G830 A833	F729-N766 VanDerWaalsContact CD2-ND2 3.27Å; F729-N766 WeakPolarHBondContact CD2-ND2 3.44Å; F729-N766 WeakPolarHBondContact CE2-ND2 3.38Å; F729-N766 WeakPolarHBondContact O-CB 3.49Å; F729-N766 PolarHBondContact O-ND2 2.96Å; D730-N766 WeakPolarHBondContact O-CA 3.48Å; M731-N766 PolarHBondContact N-ND2 3.3Å; M763-N766 HydrophobicContact CB-CB 4.31Å; M763-N766 PolarHBondContact O-N 2.98Å; N766-G768 PolarHBondContact O-N 3.49Å; N766-G768 PolarHBondContact OD1-N 3.08Å; N766-G768 VanDerWaalsContact OD1-N 3.1Å; N766-G768 PolarHBondContact OD1-O 3.16Å; N766-T829 CarbonylContact O-C 3.57Å; N766-T829 WeakPolarHBondContact O-CA 3.43Å; N766-G830 PolarHBondContact O-N 3.48Å; N766-A833 HydrophobicContact CB-CB 4.09Å; N766-A833 WeakPolarHBondContact O-CB 3.47Å
767	T	83.9	Confident	90	Very high	93 Å²	93	30.8 Å²	30.8	57%	0.571	17%	0.166	S	C	*	.			trans	-73.2	-2.9	179.6	59.3	0	0	0	0	113.8	Y765 M828	Y765-T767 PolarHBondContact O-N 3.25Å; T767-M828 WeakPolarHBondContact CA-O 3.21Å; T767-M828 HydrophobicContact CG2-CE 4.23Å
768	G	80.8	Confident	90.1	Very high	2 Å²	2	25 Å²	25	2%	0.021	14%	0.14	C	C	.	.			trans	124.7	-136.8	174.3	0	0	0	0	0	114	M731 M732 N766 G830	M731-G768 WeakPolarHBondContact CA-O 3.36Å; M731-G768 WeakPolarHBondContact CG-O 3.29Å; M732-G768 PolarHBondContact N-O 3.32Å; N766-G768 PolarHBondContact O-N 3.49Å; N766-G768 PolarHBondContact OD1-N 3.08Å; N766-G768 VanDerWaalsContact OD1-N 3.1Å; N766-G768 PolarHBondContact OD1-O 3.16Å; G768-G830 WeakPolarHBondContact CA-O 3.47Å; G768-G830 PolarHBondContact N-O 3.45Å
769	G	83.1	Confident	90.1	Very high	46 Å²	46	24.8 Å²	24.8	47%	0.474	14%	0.138	S	C	.	.	B	Isolated β-bridge	trans	132.7	-134.5	-172.3	0	0	0	0	0	111.3	M732 P832	M732-G769 WeakPolarHBondContact O-CA 3.46Å; G769-P832 WeakPolarHBondContact O-CG 3.48Å
770	Y	81.4	Confident	90	Very high	110 Å²	110	26.2 Å²	26.2	43%	0.431	14%	0.143	S	C	.	.			trans	-91.4	129.5	-177.5	-60.3	-90.5	0	0	0	112.2	P699 M732 D734 T772	P699-Y770 HydrophobicContact CG-CE1 4.28Å; M732-Y770 WeakPolarHBondContact CG-O 3.28Å; M732-Y770 PolarHBondContact O-N 3.12Å; D734-Y770 HydrophobicContact CB-CD1 4.13Å; D734-Y770 HydrophobicContact CB-CD2 3.99Å; D734-Y770 HydrophobicContact CB-CG 3.78Å; Y770-T772 VanDerWaalsContact C-N 3.26Å; Y770-T772 PolarHBondContact O-N 3.37Å
771	S	83.8	Confident	89.8	Confident	41 Å²	41	26.5 Å²	26.5	29%	0.287	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	-73.4	-16.2	177.8	58	0	0	0	0	113.9	A773 V774	S771-A773 VanDerWaalsContact C-N 3.34Å; S771-A773 PolarHBondContact O-N 3.34Å; S771-V774 PolarHBondContact O-N 2.9Å
772	T	86.4	Confident	89.6	Confident	61 Å²	61	27.3 Å²	27.3	37%	0.374	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-63.1	-32.3	-171.6	56.5	0	0	0	0	113.9	D734 I735 Y770	D734-T772 PolarHBondContact OD2-OG1 2.57Å; I735-T772 PolarHBondContact N-OG1 2.67Å; Y770-T772 VanDerWaalsContact C-N 3.26Å; Y770-T772 PolarHBondContact O-N 3.37Å
773	A	87.6	Confident	89.3	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-87.4	-13.1	-177.8	0	0	0	0	0	114.9	L733 I735 V738 S771 P775 L776 F777	L733-A773 WeakPolarHBondContact O-CB 3.5Å; I735-A773 HydrophobicContact CB-CB 4.35Å; V738-A773 HydrophobicContact CG2-CB 4.28Å; S771-A773 VanDerWaalsContact C-N 3.34Å; S771-A773 PolarHBondContact O-N 3.34Å; A773-P775 VanDerWaalsContact C-CD 3.47Å; A773-L776 WeakPolarHBondContact O-CA 3.38Å; A773-L776 WeakPolarHBondContact O-CB 3.45Å; A773-L776 PolarHBondContact O-N 2.81Å; A773-F777 HydrophobicContact CB-CD2 3.97Å; A773-F777 HydrophobicContact CB-CE2 3.63Å; A773-F777 VanDerWaalsContact O-CD2 3.31Å; A773-F777 WeakPolarHBondContact O-CD2 3.27Å; A773-F777 PolarHBondContact O-N 3.08Å
774	V	91.6	Very high	89	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-53.5	-44.4	-177.1	176.8	0	0	0	0	113.1	M732 S771 L776 F777 C778 Y791 P832 L835 F836	M732-V774 HydrophobicContact CE-CG2 3.94Å; M732-V774 HydrophobicContact CG-CG2 4.05Å; M732-V774 HydrophobicContact SD-CG2 4.03Å; S771-V774 PolarHBondContact O-N 2.9Å; V774-L776 VanDerWaalsContact C-N 3.26Å; V774-L776 PolarHBondContact O-N 2.88Å; V774-F777 PolarHBondContact O-N 3.11Å; V774-C778 PolarHBondContact O-N 3.41Å; V774-C778 PolarHBondContact O-SG 3.07Å; V774-C778 VanDerWaalsContact O-SG 3.38Å; V774-Y791 HydrophobicContact CG1-CE1 4.38Å; V774-P832 HydrophobicContact CG2-CB 3.83Å; V774-L835 HydrophobicContact CB-CD2 4.27Å; V774-L835 HydrophobicContact CG1-CD2 4.33Å; V774-L835 HydrophobicContact CG1-CG 4.07Å; V774-L835 HydrophobicContact CG2-CD2 4.15Å; V774-F836 HydrophobicContact CG1-CB 3.92Å; V774-F836 HydrophobicContact CG1-CD2 4.3Å
775	P	92.5	Very high	88.8	Confident	13 Å²	13	38.1 Å²	38.1	8%	0.084	21%	0.208	C	C	.	.	H	α-helix	trans	-63.8	-32.1	178.2	-22.3	36.2	0	0	0	113.1	A773 T779 L790 I804 F807	A773-P775 VanDerWaalsContact C-CD 3.47Å; P775-T779 WeakPolarHBondContact O-CB 3.34Å; P775-T779 PolarHBondContact O-N 2.59Å; P775-T779 VanDerWaalsContact O-N 3.1Å; P775-T779 PolarHBondContact O-OG1 3.35Å; P775-L790 HydrophobicContact CB-CD1 4Å; P775-I804 HydrophobicContact CB-CG2 3.93Å; P775-I804 HydrophobicContact CG-CG2 3.38Å; P775-F807 HydrophobicContact CB-CE2 4.11Å; P775-F807 HydrophobicContact CB-CZ 4.38Å
776	L	91	Very high	88.8	Confident	24 Å²	24	38.3 Å²	38.3	13%	0.126	22%	0.22	C	C	.	.	H	α-helix	trans	-70.8	-41.2	177.2	-179.5	58.2	0	0	0	111	I735 V738 A773 V774 T779 Y780 F807 I810	I735-L776 HydrophobicContact CG1-CD2 4.17Å; V738-L776 HydrophobicContact CB-CD2 4.46Å; V738-L776 HydrophobicContact CG1-CD2 3.7Å; A773-L776 WeakPolarHBondContact O-CA 3.38Å; A773-L776 WeakPolarHBondContact O-CB 3.45Å; A773-L776 PolarHBondContact O-N 2.81Å; V774-L776 VanDerWaalsContact C-N 3.26Å; V774-L776 PolarHBondContact O-N 2.88Å; L776-T779 PolarHBondContact O-N 3.16Å; L776-Y780 HydrophobicContact CD1-CE2 4.46Å; L776-Y780 VanDerWaalsContact O-CD2 3.26Å; L776-Y780 WeakPolarHBondContact O-CD2 3.39Å; L776-F807 HydrophobicContact CB-CE2 4.03Å; L776-F807 HydrophobicContact CD1-CD2 4.21Å; L776-F807 HydrophobicContact CD1-CE2 4.4Å; L776-I810 HydrophobicContact CD1-CG2 4.26Å
777	F	90.6	Very high	88.9	Confident	25 Å²	25	40.9 Å²	40.9	11%	0.11	24%	0.237	C	C	.	.	H	α-helix	trans	-65.6	-49.5	174.2	-70.4	-62	0	0	0	112.1	M732 V738 A773 V774 T779 Y780 F781 F836	M732-F777 HydrophobicContact SD-CD2 3.57Å; M732-F777 VanDerWaalsContact SD-CD2 3.57Å; M732-F777 HydrophobicContact SD-CE2 3.62Å; V738-F777 HydrophobicContact CG2-CZ 4.16Å; A773-F777 HydrophobicContact CB-CD2 3.97Å; A773-F777 HydrophobicContact CB-CE2 3.63Å; A773-F777 VanDerWaalsContact O-CD2 3.31Å; A773-F777 WeakPolarHBondContact O-CD2 3.27Å; A773-F777 PolarHBondContact O-N 3.08Å; V774-F777 PolarHBondContact O-N 3.11Å; F777-T779 PolarHBondContact O-N 3Å; F777-Y780 PolarHBondContact O-N 3.02Å; F777-Y780 VanDerWaalsContact O-N 3.16Å; F777-F781 VanDerWaalsContact O-CD2 3.3Å; F777-F781 WeakPolarHBondContact O-CD2 3.36Å; F777-F781 WeakPolarHBondContact O-CE2 3.17Å; F777-F836 HydrophobicContact CB-CD2 4.12Å; F777-F836 HydrophobicContact CB-CE2 3.87Å
778	C	93.4	Very high	89.3	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-54.4	-38.9	176.3	-68.1	0	0	0	0	112	V774 Y780 F781 F782 L790 F836 M840	V774-C778 PolarHBondContact O-N 3.41Å; V774-C778 PolarHBondContact O-SG 3.07Å; V774-C778 VanDerWaalsContact O-SG 3.38Å; C778-Y780 PolarHBondContact O-N 3.42Å; C778-Y780 VanDerWaalsContact O-N 3.13Å; C778-F781 PolarHBondContact O-N 2.95Å; C778-F782 HydrophobicContact CB-CE2 4.44Å; C778-F782 VanDerWaalsContact O-CD2 3.31Å; C778-F782 WeakPolarHBondContact O-CD2 3.25Å; C778-L790 HydrophobicContact CB-CD1 3.74Å; C778-L790 HydrophobicContact CB-CD2 3.84Å; C778-L790 HydrophobicContact CB-CG 4.48Å; C778-F836 WeakPolarHBondContact SG-CD2 3.48Å; C778-M840 HydrophobicContact CB-SD 4.17Å
779	T	93.4	Very high	89.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57.6	-28.3	-178.6	-62.5	0	0	0	0	113.8	P775 L776 F777 F781 T806 F807 I810 R814	P775-T779 WeakPolarHBondContact O-CB 3.34Å; P775-T779 PolarHBondContact O-N 2.59Å; P775-T779 VanDerWaalsContact O-N 3.1Å; P775-T779 PolarHBondContact O-OG1 3.35Å; L776-T779 PolarHBondContact O-N 3.16Å; F777-T779 PolarHBondContact O-N 3Å; T779-F781 PolarHBondContact O-N 2.66Å; T779-T806 WeakPolarHBondContact OG1-CA 3.48Å; T779-T806 WeakPolarHBondContact OG1-CB 3.38Å; T779-F807 HydrophobicContact CG2-CB 4.18Å; T779-F807 WeakPolarHBondContact CG2-O 3.25Å; T779-F807 PolarHBondContact OG1-N 2.82Å; T779-I810 HydrophobicContact CG2-CG2 3.44Å; T779-I810 VanDerWaalsContact CG2-CG2 3.44Å; T779-R814 PolarHBondContact O-NH1 2.84Å
780	Y	92.5	Very high	90.4	Very high	30 Å²	30	39.2 Å²	39.2	12%	0.118	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-18.8	177.9	-77	-92.6	0	0	0	113.8	L746 W750 L776 F777 C778 I810 R811 Y815	L746-Y780 HydrophobicContact CD2-CE1 4.17Å; W750-Y780 HydrophobicContact CD2-CD1 4.33Å; W750-Y780 AromaticContact CE2-CD1 3.61Å; W750-Y780 HydrophobicContact CH2-CD1 4.35Å; W750-Y780 HydrophobicContact CH2-CG 4.4Å; W750-Y780 AromaticContact CZ2-CD1 3.63Å; W750-Y780 HydrophobicContact CZ2-CD1 3.63Å; W750-Y780 HydrophobicContact CZ2-CG 4.08Å; W750-Y780 AromaticContact NE1-CD1 3.71Å; W750-Y780 AromaticContact NE1-CE1 3.89Å; L776-Y780 HydrophobicContact CD1-CE2 4.46Å; L776-Y780 VanDerWaalsContact O-CD2 3.26Å; L776-Y780 WeakPolarHBondContact O-CD2 3.39Å; F777-Y780 PolarHBondContact O-N 3.02Å; F777-Y780 VanDerWaalsContact O-N 3.16Å; C778-Y780 PolarHBondContact O-N 3.42Å; C778-Y780 VanDerWaalsContact O-N 3.13Å; Y780-I810 HydrophobicContact CD1-CD1 3.68Å; Y780-I810 HydrophobicContact CD2-CD1 4.43Å; Y780-I810 HydrophobicContact CE1-CD1 3.74Å; Y780-I810 HydrophobicContact CE2-CD1 4.48Å; Y780-I810 HydrophobicContact CG-CD1 4.05Å; Y780-R811 PolarHBondContact OH-O 2.86Å; Y780-Y815 WeakPolarHBondContact O-CB 3.44Å; Y780-Y815 PolarHBondContact O-N 3.02Å
781	F	93.7	Very high	90.9	Very high	7 Å²	7	34.1 Å²	34.1	3%	0.031	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-8.2	-170.6	-57.3	-68.1	0	0	0	114.6	W750 L759 I761 F777 C778 T779 Y815 L821 F836 M840 R845	W750-F781 AromaticContact CH2-CE1 3.72Å; W750-F781 HydrophobicContact CH2-CE1 3.72Å; W750-F781 AromaticContact CH2-CZ 3.88Å; W750-F781 HydrophobicContact CH2-CZ 3.88Å; W750-F781 HydrophobicContact CZ3-CE1 4.32Å; W750-F781 HydrophobicContact CZ3-CZ 4.13Å; L759-F781 HydrophobicContact CD2-CE1 3.66Å; L759-F781 HydrophobicContact CD2-CZ 4.1Å; I761-F781 HydrophobicContact CD1-CE1 4.28Å; I761-F781 HydrophobicContact CD1-CE2 4.01Å; I761-F781 HydrophobicContact CD1-CZ 3.66Å; F777-F781 VanDerWaalsContact O-CD2 3.3Å; F777-F781 WeakPolarHBondContact O-CD2 3.36Å; F777-F781 WeakPolarHBondContact O-CE2 3.17Å; C778-F781 PolarHBondContact O-N 2.95Å; T779-F781 PolarHBondContact O-N 2.66Å; F781-Y815 HydrophobicContact CD1-CD1 4.09Å; F781-Y815 HydrophobicContact CD1-CG 4.23Å; F781-Y815 HydrophobicContact CE1-CD1 4.33Å; F781-Y815 HydrophobicContact CE1-CG 4.26Å; F781-L821 HydrophobicContact CB-CD2 4.07Å; F781-L821 HydrophobicContact CD1-CD1 4.17Å; F781-L821 HydrophobicContact CD1-CD2 3.69Å; F781-L821 HydrophobicContact CD2-CD2 4.49Å; F781-L821 HydrophobicContact CE1-CD1 4.05Å; F781-L821 HydrophobicContact CE1-CD2 4.31Å; F781-L821 HydrophobicContact CG-CD2 3.81Å; F781-F836 HydrophobicContact CD2-CE2 4.44Å; F781-F836 HydrophobicContact CD2-CZ 4.27Å; F781-F836 HydrophobicContact CE2-CE2 4.24Å; F781-F836 AromaticContact CE2-CZ 3.92Å; F781-F836 HydrophobicContact CE2-CZ 3.92Å; F781-M840 HydrophobicContact CB-CE 3.51Å; F781-M840 HydrophobicContact CD2-CE 3.84Å; F781-M840 HydrophobicContact CG-CE 3.82Å; F781-R845 HydrophobicContact CB-CG 4.34Å; F781-R845 PolarHBondContact O-NE 2.88Å
782	F	91.9	Very high	91.3	Very high	17 Å²	17	32.8 Å²	32.8	8%	0.075	18%	0.18	C	C	.	.	S	Bend	trans	-109.3	161.8	173.7	-62.9	-77.7	0	0	0	110.7	C778 Q788 L790 T806 R814 M840 L843 R845	C778-F782 HydrophobicContact CB-CE2 4.44Å; C778-F782 VanDerWaalsContact O-CD2 3.31Å; C778-F782 WeakPolarHBondContact O-CD2 3.25Å; F782-Q788 HydrophobicContact CB-CG 4.03Å; F782-Q788 HydrophobicContact CD1-CG 3.79Å; F782-Q788 HydrophobicContact CE1-CG 4.39Å; F782-Q788 HydrophobicContact CG-CB 4.44Å; F782-Q788 HydrophobicContact CG-CG 3.89Å; F782-L790 HydrophobicContact CE2-CD2 3.96Å; F782-T806 HydrophobicContact CB-CG2 4.45Å; F782-T806 HydrophobicContact CD2-CG2 3.85Å; F782-T806 HydrophobicContact CG-CG2 4.44Å; F782-R814 WeakPolarHBondContact O-CD 3.39Å; F782-R814 PolarHBondContact O-NH1 3.46Å; F782-M840 HydrophobicContact CE2-CE 4.35Å; F782-M840 HydrophobicContact CE2-SD 3.71Å; F782-M840 HydrophobicContact CZ-SD 4.1Å; F782-L843 HydrophobicContact CE1-CB 4.22Å; F782-L843 HydrophobicContact CE1-CD1 4.23Å; F782-L843 HydrophobicContact CE2-CD1 4.22Å; F782-L843 HydrophobicContact CZ-CB 3.96Å; F782-L843 HydrophobicContact CZ-CD1 3.63Å; F782-L843 HydrophobicContact CZ-CG 4.47Å; F782-R845 HydrophobicContact CD1-CG 4.35Å; F782-R845 HydrophobicContact CE1-CB 3.63Å; F782-R845 HydrophobicContact CE1-CG 3.79Å; F782-R845 HydrophobicContact CZ-CB 3.65Å; F782-R845 HydrophobicContact CZ-CG 3.87Å
783	D	89.9	Confident	91.5	Very high	81 Å²	81	31.2 Å²	31.2	43%	0.433	17%	0.169	S	C	.	.			trans	-69.2	167.1	172.3	-65.1	-57.2	0	0	0	112.2	R814 S817	D783-R814 PolarHBondContact O-NH1 2.89Å; D783-S817 WeakPolarHBondContact OD2-CB 3.33Å; D783-S817 PolarHBondContact OD2-OG 2.71Å
784	A	88.9	Confident	91.7	Very high	38 Å²	38	32.9 Å²	32.9	31%	0.314	18%	0.175	S	C	.	.	S	Bend	trans	-75	-32.4	-172.5	0	0	0	0	0	114	R814	A784-R814 VanDerWaalsContact CA-CZ 3.47Å
785	E	89	Confident	91.6	Very high	123 Å²	123	33.6 Å²	33.6	58%	0.575	18%	0.181	S	C	*	.	S	Bend	trans	-144.5	138.6	-178.4	-65.2	-63.6	158.7	0	0	108.6	P787 S808	E785-P787 WeakPolarHBondContact OE2-CD 3.1Å; E785-S808 WeakPolarHBondContact OE1-CB 3.41Å
786	P	90.4	Very high	91.4	Very high	93 Å²	93	35 Å²	35	60%	0.604	19%	0.185	S	C	*	.	S	Bend	cis	-72.7	153.9	-6.1	31.6	-34.7	0	0	0	111.9	Q788	P786-Q788 PolarHBondContact O-N 3.03Å; P786-Q788 PolarHBondContact O-NE2 3.31Å
787	P	90.3	Very high	91.1	Very high	54 Å²	54	38.1 Å²	38.1	35%	0.351	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-68.1	129	178.7	-18.1	33.5	0	0	0	110.9	E785 M805	E785-P787 WeakPolarHBondContact OE2-CD 3.1Å; P787-M805 HydrophobicContact CB-CE 4.31Å; P787-M805 VanDerWaalsContact O-CE 3.28Å; P787-M805 WeakPolarHBondContact O-CE 3.36Å
788	Q	92.2	Very high	91	Very high	62 Å²	62	41.3 Å²	41.3	29%	0.29	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-80.9	137.7	-177.3	-57.1	-56.5	-51.7	0	0	111	F782 P786 L790 M805 T806	F782-Q788 HydrophobicContact CB-CG 4.03Å; F782-Q788 HydrophobicContact CD1-CG 3.79Å; F782-Q788 HydrophobicContact CE1-CG 4.39Å; F782-Q788 HydrophobicContact CG-CB 4.44Å; F782-Q788 HydrophobicContact CG-CG 3.89Å; P786-Q788 PolarHBondContact O-N 3.03Å; P786-Q788 PolarHBondContact O-NE2 3.31Å; Q788-L790 PolarHBondContact O-N 3.12Å; Q788-M805 CarbonylContact O-C 3.54Å; Q788-M805 VanDerWaalsContact O-CA 3.29Å; Q788-M805 WeakPolarHBondContact O-CA 3.32Å; Q788-T806 HydrophobicContact CB-CG2 3.96Å; Q788-T806 PolarHBondContact N-OG1 2.86Å; Q788-T806 PolarHBondContact O-N 2.75Å
789	H	94.4	Very high	90.7	Very high	44 Å²	44	46.9 Å²	46.9	20%	0.204	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	111.1	173.4	-178.6	-152.3	0	0	0	108.5	Y791 T792 I804 M805 P882	H789-Y791 PolarHBondContact CD2-O 3.36Å; H789-Y791 PolarHBondContact NE2-O 2.8Å; H789-T792 PolarHBondContact CE1-OG1 2.86Å; H789-T792 VanDerWaalsContact CE1-OG1 3.28Å; H789-T792 PolarHBondContact NE2-OG1 3.08Å; H789-I804 PolarHBondContact CD2-O 2.83Å; H789-M805 HydrophobicContact CB-CE 3.91Å; H789-M805 HydrophobicContact CB-SD 3.75Å; H789-P882 HydrophobicContact CB-CB 4.22Å; H789-P882 WeakPolarHBondContact O-CB 3.28Å; H789-P882 WeakPolarHBondContact O-CG 3.41Å
790	L	92.6	Very high	90.5	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-45.3	-174.1	-61.2	175.3	0	0	0	111.5	P775 C778 F782 Q788 I804 T806 L843 P882	P775-L790 HydrophobicContact CB-CD1 4Å; C778-L790 HydrophobicContact CB-CD1 3.74Å; C778-L790 HydrophobicContact CB-CD2 3.84Å; C778-L790 HydrophobicContact CB-CG 4.48Å; F782-L790 HydrophobicContact CE2-CD2 3.96Å; Q788-L790 PolarHBondContact O-N 3.12Å; L790-I804 PolarHBondContact N-O 3.5Å; L790-T806 HydrophobicContact CD1-CG2 4.18Å; L790-T806 HydrophobicContact CD2-CG2 3.82Å; L790-T806 HydrophobicContact CG-CG2 4.11Å; L790-L843 HydrophobicContact CD2-CD1 3.81Å; L790-P882 WeakPolarHBondContact O-CD 3.44Å; L790-P882 VanDerWaalsContact O-CG 3.3Å; L790-P882 WeakPolarHBondContact O-CG 3.43Å
791	Y	92.6	Very high	90.4	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.016	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.1	171.9	179	43.4	-91.1	0	0	0	110.2	V774 H789 I793 I804 L835 A839 I879 W888	V774-Y791 HydrophobicContact CG1-CE1 4.38Å; H789-Y791 PolarHBondContact CD2-O 3.36Å; H789-Y791 PolarHBondContact NE2-O 2.8Å; Y791-I793 HydrophobicContact CD2-CG1 4.06Å; Y791-I793 HydrophobicContact CE2-CD1 4.11Å; Y791-I793 HydrophobicContact CE2-CG1 4.15Å; Y791-I804 HydrophobicContact CD2-CB 3.86Å; Y791-I804 HydrophobicContact CD2-CG1 3.84Å; Y791-I804 HydrophobicContact CD2-CG2 4.36Å; Y791-I804 HydrophobicContact CE1-CG2 4.34Å; Y791-I804 HydrophobicContact CE2-CB 3.69Å; Y791-I804 HydrophobicContact CE2-CG1 3.59Å; Y791-I804 HydrophobicContact CE2-CG2 3.75Å; Y791-I804 HydrophobicContact CG-CB 4.47Å; Y791-I804 PolarHBondContact O-N 2.63Å; Y791-L835 HydrophobicContact CD1-CD1 3.71Å; Y791-L835 HydrophobicContact CD1-CG 4.47Å; Y791-L835 HydrophobicContact CD2-CD1 3.97Å; Y791-L835 HydrophobicContact CE1-CD1 3.55Å; Y791-L835 HydrophobicContact CE1-CD2 4.34Å; Y791-L835 HydrophobicContact CE1-CG 3.84Å; Y791-L835 HydrophobicContact CE2-CD1 3.77Å; Y791-L835 HydrophobicContact CE2-CD2 4.12Å; Y791-L835 HydrophobicContact CE2-CG 4.32Å; Y791-L835 HydrophobicContact CG-CD1 3.96Å; Y791-L835 WeakPolarHBondContact OH-CD2 3.24Å; Y791-A839 HydrophobicContact CD1-CB 4.03Å; Y791-A839 HydrophobicContact CE1-CB 4.26Å; Y791-I879 HydrophobicContact CD2-CG2 4.11Å; Y791-I879 HydrophobicContact CG-CG2 4.05Å; Y791-W888 HydrophobicContact CD1-CH2 4.16Å; Y791-W888 HydrophobicContact CG-CH2 4.38Å
792	T	92.4	Very high	90.4	Very high	13 Å²	13	56.9 Å²	56.9	8%	0.08	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	131.1	167.7	-48.5	0	0	0	0	109.5	H789 L801 T802 K803 I879 L880	H789-T792 PolarHBondContact CE1-OG1 2.86Å; H789-T792 VanDerWaalsContact CE1-OG1 3.28Å; H789-T792 PolarHBondContact NE2-OG1 3.08Å; T792-L801 HydrophobicContact CG2-CB 4.32Å; T792-L801 HydrophobicContact CG2-CD2 3.98Å; T792-T802 WeakPolarHBondContact CA-O 3.5Å; T792-T802 WeakPolarHBondContact CG2-O 3.18Å; T792-K803 HydrophobicContact CG2-CG 4.07Å; T792-I879 WeakPolarHBondContact O-CA 3.5Å; T792-L880 PolarHBondContact N-O 3.09Å; T792-L880 PolarHBondContact O-N 2.84Å
793	I	91.1	Very high	90.4	Very high	27 Å²	27	63.1 Å²	63.1	14%	0.138	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	135.6	172.1	-61.1	173.8	0	0	0	108.8	Y791 L801 T802 I804 L858 Q877	Y791-I793 HydrophobicContact CD2-CG1 4.06Å; Y791-I793 HydrophobicContact CE2-CD1 4.11Å; Y791-I793 HydrophobicContact CE2-CG1 4.15Å; I793-L801 CarbonylContact O-C 3.52Å; I793-L801 WeakPolarHBondContact O-CA 3.38Å; I793-T802 PolarHBondContact N-O 3.07Å; I793-T802 PolarHBondContact O-N 2.94Å; I793-I804 HydrophobicContact CD1-CG1 4.35Å; I793-I804 HydrophobicContact CG1-CG1 4.43Å; I793-L858 HydrophobicContact CD1-CD1 4.34Å; I793-Q877 HydrophobicContact CG2-CB 4.38Å; I793-Q877 HydrophobicContact CG2-CG 4.45Å
794	Y	90.3	Very high	90.6	Very high	35 Å²	35	60.9 Å²	60.9	14%	0.137	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	135.7	160.1	175.8	-109.4	0	0	0	109.2	N799 L801 Q877 I878	Y794-N799 VanDerWaalsContact CE2-OD1 3.28Å; Y794-N799 WeakPolarHBondContact CE2-OD1 3.3Å; Y794-N799 PolarHBondContact OH-OD1 3.27Å; Y794-L801 HydrophobicContact CD2-CD2 4.02Å; Y794-L801 HydrophobicContact CD2-CG 4.14Å; Y794-L801 HydrophobicContact CG-CD2 4.34Å; Y794-Q877 WeakPolarHBondContact O-CA 3.24Å; Y794-I878 HydrophobicContact CD1-CD1 4.15Å; Y794-I878 HydrophobicContact CD1-CG1 3.97Å; Y794-I878 HydrophobicContact CG-CG1 4.39Å; Y794-I878 PolarHBondContact N-O 2.98Å; Y794-I878 PolarHBondContact O-N 3.1Å
795	A	89.8	Confident	90.9	Very high	15 Å²	15	62.6 Å²	62.6	12%	0.124	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123.1	175.7	0	0	0	0	0	110.9	N799 T800 Q877	A795-N799 VanDerWaalsContact O-CA 3.32Å; A795-N799 WeakPolarHBondContact O-CA 3.4Å; A795-N799 PolarHBondContact O-N 2.84Å; A795-T800 PolarHBondContact N-O 3.09Å; A795-T800 VanDerWaalsContact N-O 3.14Å; A795-T800 PolarHBondContact O-N 3.43Å; A795-Q877 HydrophobicContact CB-CG 3.97Å
796	R	89.8	Confident	91.1	Very high	42 Å²	42	57 Å²	57	16%	0.158	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-62.9	-47.2	-177.2	-177.1	63.7	172.9	173.3	-4.7	111.9	E632 Q633 Y635 E638 T798 N799 N876	E632-R796 PolarHBondContact O-NH2 3.17Å; Q633-R796 WeakPolarHBondContact O-CG 3.39Å; Q633-R796 PolarHBondContact O-NE 3.14Å; Y635-R796 WeakPolarHBondContact O-CD 3.46Å; Y635-R796 WeakPolarHBondContact O-CG 3.34Å; E638-R796 VanDerWaalsContact CD-NH1 3.27Å; E638-R796 IonicContact OE1-CZ 3.9Å; E638-R796 IonicContact OE1-NH1 2.7Å; E638-R796 IonicContact OE1-NH2 3.89Å; E638-R796 PolarHBondContact OE1-NH2 2.91Å; E638-R796 IonicContact OE2-CZ 2.81Å; E638-R796 IonicContact OE2-NH1 2.71Å; E638-R796 PolarHBondContact OE2-NH1 2.72Å; E638-R796 IonicContact OE2-NH2 3.74Å; E638-R796 PolarHBondContact OE2-NH2 2.99Å; R796-T798 PolarHBondContact O-N 3.23Å; R796-T798 VanDerWaalsContact O-N 3.14Å; R796-N799 PolarHBondContact O-N 3.01Å; R796-N799 VanDerWaalsContact O-N 3.11Å; R796-N876 PolarHBondContact N-O 2.87Å
797	A	84.6	Confident	91.2	Very high	90 Å²	90	56.8 Å²	56.8	74%	0.744	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-60.1	-27.3	-173.5	0	0	0	0	0	114.7
798	T	86.6	Confident	91	Very high	93 Å²	93	56.3 Å²	56.3	57%	0.571	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-110.8	-8.9	176.8	50.1	0	0	0	0	113.2	R796 T800	R796-T798 PolarHBondContact O-N 3.23Å; R796-T798 VanDerWaalsContact O-N 3.14Å; T798-T800 PolarHBondContact O-N 3.49Å; T798-T800 PolarHBondContact OG1-OG1 2.84Å
799	N	87.3	Confident	90.7	Very high	116 Å²	116	61.3 Å²	61.3	62%	0.62	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	37.1	-170.1	-161	18.6	0	0	0	113.6	Y794 A795 R796	Y794-N799 VanDerWaalsContact CE2-OD1 3.28Å; Y794-N799 WeakPolarHBondContact CE2-OD1 3.3Å; Y794-N799 PolarHBondContact OH-OD1 3.27Å; A795-N799 VanDerWaalsContact O-CA 3.32Å; A795-N799 WeakPolarHBondContact O-CA 3.4Å; A795-N799 PolarHBondContact O-N 2.84Å; R796-N799 PolarHBondContact O-N 3.01Å; R796-N799 VanDerWaalsContact O-N 3.11Å
800	T	90.1	Very high	90.5	Very high	65 Å²	65	61.1 Å²	61.1	40%	0.399	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	138.3	-175.8	51.6	0	0	0	0	112.9	A795 T798	A795-T800 PolarHBondContact N-O 3.09Å; A795-T800 VanDerWaalsContact N-O 3.14Å; A795-T800 PolarHBondContact O-N 3.43Å; T798-T800 PolarHBondContact O-N 3.49Å; T798-T800 PolarHBondContact OG1-OG1 2.84Å
801	L	91.3	Very high	90.1	Very high	113 Å²	113	68.3 Å²	68.3	59%	0.592	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	129.5	163.7	-74.6	165.6	0	0	0	110.3	T792 I793 Y794 L880	T792-L801 HydrophobicContact CG2-CB 4.32Å; T792-L801 HydrophobicContact CG2-CD2 3.98Å; I793-L801 CarbonylContact O-C 3.52Å; I793-L801 WeakPolarHBondContact O-CA 3.38Å; Y794-L801 HydrophobicContact CD2-CD2 4.02Å; Y794-L801 HydrophobicContact CD2-CG 4.14Å; Y794-L801 HydrophobicContact CG-CD2 4.34Å; L801-L880 HydrophobicContact CD2-CD1 3.93Å
802	T	92.5	Very high	89.7	Confident	70 Å²	70	70.6 Å²	70.6	43%	0.429	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	112.6	177.4	-54	0	0	0	0	110.1	T792 I793 I804	T792-T802 WeakPolarHBondContact CA-O 3.5Å; T792-T802 WeakPolarHBondContact CG2-O 3.18Å; I793-T802 PolarHBondContact N-O 3.07Å; I793-T802 PolarHBondContact O-N 2.94Å; T802-I804 HydrophobicContact CG2-CD1 3.85Å
803	K	93.1	Very high	89.6	Confident	148 Å²	148	75.6 Å²	75.6	64%	0.643	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	131.7	173.9	-69.8	-168.2	174.7	-167	0	110.2	T792	T792-K803 HydrophobicContact CG2-CG 4.07Å
804	I	93.7	Very high	89.7	Confident	33 Å²	33	76.2 Å²	76.2	17%	0.169	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	122.9	-177.1	-55.8	-60.8	0	0	0	109	P775 H789 L790 Y791 I793 T802	P775-I804 HydrophobicContact CB-CG2 3.93Å; P775-I804 HydrophobicContact CG-CG2 3.38Å; H789-I804 PolarHBondContact CD2-O 2.83Å; L790-I804 PolarHBondContact N-O 3.5Å; Y791-I804 HydrophobicContact CD2-CB 3.86Å; Y791-I804 HydrophobicContact CD2-CG1 3.84Å; Y791-I804 HydrophobicContact CD2-CG2 4.36Å; Y791-I804 HydrophobicContact CE1-CG2 4.34Å; Y791-I804 HydrophobicContact CE2-CB 3.69Å; Y791-I804 HydrophobicContact CE2-CG1 3.59Å; Y791-I804 HydrophobicContact CE2-CG2 3.75Å; Y791-I804 HydrophobicContact CG-CB 4.47Å; Y791-I804 PolarHBondContact O-N 2.63Å; I793-I804 HydrophobicContact CD1-CG1 4.35Å; I793-I804 HydrophobicContact CG1-CG1 4.43Å; T802-I804 HydrophobicContact CG2-CD1 3.85Å
805	M	94.4	Very high	89.7	Confident	75 Å²	75	74.9 Å²	74.9	37%	0.369	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	156.1	-171.1	-52.7	-63.1	-62.2	0	0	110.6	P787 Q788 H789	P787-M805 HydrophobicContact CB-CE 4.31Å; P787-M805 VanDerWaalsContact O-CE 3.28Å; P787-M805 WeakPolarHBondContact O-CE 3.36Å; Q788-M805 CarbonylContact O-C 3.54Å; Q788-M805 VanDerWaalsContact O-CA 3.29Å; Q788-M805 WeakPolarHBondContact O-CA 3.32Å; H789-M805 HydrophobicContact CB-CE 3.91Å; H789-M805 HydrophobicContact CB-SD 3.75Å
806	T	93.9	Very high	89.2	Confident	5 Å²	5	75 Å²	75	3%	0.031	40%	0.401	C	S	.	.			trans	-66.3	147.4	165.2	57.1	0	0	0	0	111.4	T779 F782 Q788 L790	T779-T806 WeakPolarHBondContact OG1-CA 3.48Å; T779-T806 WeakPolarHBondContact OG1-CB 3.38Å; F782-T806 HydrophobicContact CB-CG2 4.45Å; F782-T806 HydrophobicContact CD2-CG2 3.85Å; F782-T806 HydrophobicContact CG-CG2 4.44Å; Q788-T806 HydrophobicContact CB-CG2 3.96Å; Q788-T806 PolarHBondContact N-OG1 2.86Å; Q788-T806 PolarHBondContact O-N 2.75Å; L790-T806 HydrophobicContact CD1-CG2 4.18Å; L790-T806 HydrophobicContact CD2-CG2 3.82Å; L790-T806 HydrophobicContact CG-CG2 4.11Å
807	F	91.2	Very high	88.8	Confident	89 Å²	89	75.5 Å²	75.5	39%	0.39	41%	0.411	S	S	.	.			trans	-79.2	143.4	173.3	-51.3	-75.4	0	0	0	111	P775 L776 T779 I810 R814	P775-F807 HydrophobicContact CB-CE2 4.11Å; P775-F807 HydrophobicContact CB-CZ 4.38Å; L776-F807 HydrophobicContact CB-CE2 4.03Å; L776-F807 HydrophobicContact CD1-CD2 4.21Å; L776-F807 HydrophobicContact CD1-CE2 4.4Å; T779-F807 HydrophobicContact CG2-CB 4.18Å; T779-F807 WeakPolarHBondContact CG2-O 3.25Å; T779-F807 PolarHBondContact OG1-N 2.82Å; F807-I810 HydrophobicContact CB-CG2 4.41Å; F807-R814 PolarHBondContact O-NH2 3.33Å
808	S	86.8	Confident	88.6	Confident	44 Å²	44	76.8 Å²	76.8	31%	0.308	41%	0.414	S	S	.	.	S	Bend	trans	-75.1	-35.9	172.9	55.6	0	0	0	0	112.2	E785 R814	E785-S808 WeakPolarHBondContact OE1-CB 3.41Å; S808-R814 VanDerWaalsContact C-NH2 3.35Å; S808-R814 PolarHBondContact O-NH2 3.05Å
809	H	86.1	Confident	88.6	Confident	166 Å²	166	74.5 Å²	74.5	77%	0.769	40%	0.397	S	S	*	.			trans	-108.9	128.2	-179	-64.5	67.1	0	0	0	111.5
810	I	89.4	Confident	88.7	Confident	41 Å²	41	70.8 Å²	70.8	21%	0.21	38%	0.377	C	S	.	.			trans	-134.6	167.4	174.2	62.5	174	0	0	0	111.1	L776 T779 Y780 F807 R814	L776-I810 HydrophobicContact CD1-CG2 4.26Å; T779-I810 HydrophobicContact CG2-CG2 3.44Å; T779-I810 VanDerWaalsContact CG2-CG2 3.44Å; Y780-I810 HydrophobicContact CD1-CD1 3.68Å; Y780-I810 HydrophobicContact CD2-CD1 4.43Å; Y780-I810 HydrophobicContact CE1-CD1 3.74Å; Y780-I810 HydrophobicContact CE2-CD1 4.48Å; Y780-I810 HydrophobicContact CG-CD1 4.05Å; F807-I810 HydrophobicContact CB-CG2 4.41Å; I810-R814 HydrophobicContact CD1-CG 3.66Å; I810-R814 HydrophobicContact CG1-CG 4.44Å
811	R	85.2	Confident	88.9	Confident	150 Å²	150	67.7 Å²	67.7	57%	0.566	36%	0.358	S	S	*	.	S	Bend	trans	-85.3	138.8	167.5	-68.3	178.7	173.6	164.6	-2.5	109.2	K739 L746 Y780	K739-R811 PolarHBondContact O-NH1 2.76Å; L746-R811 HydrophobicContact CD1-CB 3.71Å; Y780-R811 PolarHBondContact OH-O 2.86Å
812	G	85.1	Confident	89.1	Confident	53 Å²	53	62.3 Å²	62.3	55%	0.546	33%	0.33	S	S	.	.	S	Bend	trans	82.2	-176.5	-177.8	0	0	0	0	0	113.7
813	Q	90.1	Very high	89.3	Confident	118 Å²	118	59 Å²	59	55%	0.551	31%	0.309	S	S	*	.			trans	-94.1	139.6	-177.1	176.6	-176.6	-16.2	0	0	110.4	W750 V754	W750-Q813 PolarHBondContact NE1-O 2.93Å; V754-Q813 HydrophobicContact CG2-CB 4.06Å; V754-Q813 HydrophobicContact CG2-CG 3.86Å
814	R	92.4	Very high	89.5	Confident	40 Å²	40	52 Å²	52	15%	0.151	28%	0.279	C	S	.	.			trans	-69	151.1	172.2	-67.9	170.4	-178.8	-100.4	-2.1	110.7	T779 F782 D783 A784 F807 S808 I810 G816	T779-R814 PolarHBondContact O-NH1 2.84Å; F782-R814 WeakPolarHBondContact O-CD 3.39Å; F782-R814 PolarHBondContact O-NH1 3.46Å; D783-R814 PolarHBondContact O-NH1 2.89Å; A784-R814 VanDerWaalsContact CA-CZ 3.47Å; F807-R814 PolarHBondContact O-NH2 3.33Å; S808-R814 VanDerWaalsContact C-NH2 3.35Å; S808-R814 PolarHBondContact O-NH2 3.05Å; I810-R814 HydrophobicContact CD1-CG 3.66Å; I810-R814 HydrophobicContact CG1-CG 4.44Å; R814-G816 PolarHBondContact O-N 2.82Å
815	Y	91.4	Very high	89.7	Confident	6 Å²	6	50.4 Å²	50.4	2%	0.024	27%	0.271	C	S	.	.			trans	-67.4	-29.4	173.5	-162.3	-117.3	0	0	0	112	W750 M753 T756 A758 L759 Y780 F781 K819	W750-Y815 HydrophobicContact CH2-CD2 4.31Å; W750-Y815 HydrophobicContact CH2-CG 4.4Å; W750-Y815 HydrophobicContact CZ2-CD2 4.4Å; M753-Y815 WeakPolarHBondContact O-CE2 3.46Å; T756-Y815 PolarHBondContact O-OH 3.23Å; T756-Y815 PolarHBondContact OG1-OH 3.39Å; T756-Y815 VanDerWaalsContact OG1-OH 3.05Å; A758-Y815 WeakPolarHBondContact CA-OH 3.29Å; A758-Y815 PolarHBondContact N-OH 3.17Å; A758-Y815 PolarHBondContact O-OH 3.42Å; L759-Y815 HydrophobicContact CB-CE1 3.82Å; L759-Y815 HydrophobicContact CB-CE2 4.29Å; L759-Y815 PolarHBondContact N-OH 3.41Å; Y780-Y815 WeakPolarHBondContact O-CB 3.44Å; Y780-Y815 PolarHBondContact O-N 3.02Å; F781-Y815 HydrophobicContact CD1-CD1 4.09Å; F781-Y815 HydrophobicContact CD1-CG 4.23Å; F781-Y815 HydrophobicContact CE1-CD1 4.33Å; F781-Y815 HydrophobicContact CE1-CG 4.26Å; Y815-K819 HydrophobicContact CD1-CB 3.91Å; Y815-K819 HydrophobicContact CD1-CD 4.19Å; Y815-K819 HydrophobicContact CD2-CD 4.36Å; Y815-K819 HydrophobicContact CE1-CB 3.37Å; Y815-K819 HydrophobicContact CE1-CD 3.73Å; Y815-K819 HydrophobicContact CE1-CG 4.2Å; Y815-K819 HydrophobicContact CE2-CD 3.89Å; Y815-K819 HydrophobicContact CG-CD 4.47Å
816	G	79.1	Confident	89.7	Confident	17 Å²	17	46.9 Å²	46.9	18%	0.175	25%	0.253	C	S	.	.			trans	94	158.2	-174.4	0	0	0	0	0	112	R814 R845	R814-G816 PolarHBondContact O-N 2.82Å; G816-R845 PolarHBondContact O-NH2 3.42Å
817	S	81.3	Confident	89.5	Confident	53 Å²	53	52 Å²	52	37%	0.371	28%	0.277	S	S	.	.	S	Bend	trans	-79.1	-30.8	179.9	45.6	0	0	0	0	113.8	D783 R845	D783-S817 WeakPolarHBondContact OD2-CB 3.33Å; D783-S817 PolarHBondContact OD2-OG 2.71Å; S817-R845 PolarHBondContact O-NE 2.88Å; S817-R845 PolarHBondContact O-NH2 2.91Å
818	S	79.3	Confident	89.4	Confident	117 Å²	117	52 Å²	52	82%	0.818	28%	0.279	S	S	*	.	S	Bend	trans	-82.9	-15.4	-171.3	55.9	0	0	0	0	116.4
819	K	87.9	Confident	89.6	Confident	46 Å²	46	49.9 Å²	49.9	20%	0.2	26%	0.264	C	S	.	.	S	Bend	trans	-78.9	139.9	-180	-68.2	-169.7	177.8	-170.8	0	111.8	V754 T756 E757 Y815 R845	V754-K819 PolarHBondContact O-NZ 2.95Å; T756-K819 WeakPolarHBondContact O-CD 3.45Å; T756-K819 WeakPolarHBondContact O-CE 3.46Å; T756-K819 PolarHBondContact O-NZ 2.94Å; E757-K819 WeakPolarHBondContact O-CB 3.47Å; Y815-K819 HydrophobicContact CD1-CB 3.91Å; Y815-K819 HydrophobicContact CD1-CD 4.19Å; Y815-K819 HydrophobicContact CD2-CD 4.36Å; Y815-K819 HydrophobicContact CE1-CB 3.37Å; Y815-K819 HydrophobicContact CE1-CD 3.73Å; Y815-K819 HydrophobicContact CE1-CG 4.2Å; Y815-K819 HydrophobicContact CE2-CD 3.89Å; Y815-K819 HydrophobicContact CG-CD 4.47Å; K819-R845 VanDerWaalsContact O-CZ 3.3Å; K819-R845 PolarHBondContact O-NH1 3Å; K819-R845 PolarHBondContact O-NH2 3.38Å
820	D	88.9	Confident	89.6	Confident	38 Å²	38	42.1 Å²	42.1	20%	0.203	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	142	179.2	-161.8	4.3	0	0	0	111.3	A758 L759 R915	A758-D820 WeakPolarHBondContact CA-O 3.14Å; A758-D820 HydrophobicContact CB-CB 4.02Å; L759-D820 PolarHBondContact N-O 2.98Å; D820-R915 VanDerWaalsContact CG-NH1 3.3Å; D820-R915 IonicContact OD1-NH1 2.66Å; D820-R915 PolarHBondContact OD1-NH1 2.86Å; D820-R915 WeakPolarHBondContact OD2-CD 3.28Å; D820-R915 IonicContact OD2-CZ 2.76Å; D820-R915 IonicContact OD2-NE 3.4Å; D820-R915 IonicContact OD2-NH1 3.24Å; D820-R915 PolarHBondContact OD2-NH1 3.04Å
821	L	93.8	Very high	89.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	119.1	-172.8	-175.2	63.4	0	0	0	109.4	L759 I761 F781 M840 R845 A846 T847	L759-L821 HydrophobicContact CB-CD1 3.91Å; L759-L821 HydrophobicContact CD2-CD1 3.91Å; L759-L821 HydrophobicContact CG-CD1 4.08Å; L759-L821 WeakPolarHBondContact O-CA 3.28Å; I761-L821 HydrophobicContact CD1-CD1 3.87Å; I761-L821 HydrophobicContact CG1-CD1 4.03Å; F781-L821 HydrophobicContact CB-CD2 4.07Å; F781-L821 HydrophobicContact CD1-CD1 4.17Å; F781-L821 HydrophobicContact CD1-CD2 3.69Å; F781-L821 HydrophobicContact CD2-CD2 4.49Å; F781-L821 HydrophobicContact CE1-CD1 4.05Å; F781-L821 HydrophobicContact CE1-CD2 4.31Å; F781-L821 HydrophobicContact CG-CD2 3.81Å; L821-M840 HydrophobicContact CD2-CE 3.43Å; L821-M840 VanDerWaalsContact CD2-CE 3.43Å; L821-R845 HydrophobicContact CD2-CG 4.33Å; L821-A846 HydrophobicContact CB-CB 4.35Å; L821-A846 HydrophobicContact CD2-CB 4.03Å; L821-A846 HydrophobicContact CG-CB 3.94Å; L821-A846 CarbonylContact O-C 3.59Å; L821-A846 VanDerWaalsContact O-CA 3.24Å; L821-A846 WeakPolarHBondContact O-CA 3.42Å; L821-T847 PolarHBondContact O-N 3.1Å
822	V	95.6	Very high	89.5	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	137.8	179.7	-180	0	0	0	0	109.2	L759 I760 I761 L824 T847 I849 A908 I912	L759-V822 PolarHBondContact O-N 3.1Å; I760-V822 CarbonylContact C-O 3.59Å; I760-V822 WeakPolarHBondContact CA-O 3.37Å; I760-V822 HydrophobicContact CG1-CB 4.46Å; I761-V822 PolarHBondContact N-O 3.12Å; V822-L824 HydrophobicContact CG1-CD2 3.93Å; V822-T847 CarbonylContact C-O 3.57Å; V822-T847 VanDerWaalsContact CA-O 3.31Å; V822-T847 WeakPolarHBondContact CA-O 3.36Å; V822-I849 HydrophobicContact CG1-CB 4.42Å; V822-I849 HydrophobicContact CG1-CD1 3.62Å; V822-I849 HydrophobicContact CG1-CG1 3.9Å; V822-A908 HydrophobicContact CG1-CB 3.76Å; V822-I912 HydrophobicContact CG2-CD1 3.91Å; V822-I912 HydrophobicContact CG2-CG1 4.02Å
823	I	97.3	Very high	89.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.3	174.2	-62.1	171.8	0	0	0	108.4	I761 M763 T825 F836 A837 M840 A846 T847 V848 I849	I761-I823 HydrophobicContact CB-CG1 4.33Å; I761-I823 CarbonylContact O-C 3.56Å; I761-I823 WeakPolarHBondContact O-CA 3.09Å; M763-I823 HydrophobicContact CG-CG2 4.18Å; M763-I823 HydrophobicContact SD-CG2 3.74Å; I823-T825 HydrophobicContact CG2-CG2 4.31Å; I823-F836 HydrophobicContact CD1-CD1 4.07Å; I823-F836 HydrophobicContact CD1-CE1 3.66Å; I823-F836 HydrophobicContact CG1-CE1 4.32Å; I823-A837 HydrophobicContact CG2-CB 4.14Å; I823-M840 HydrophobicContact CD1-CB 3.7Å; I823-M840 HydrophobicContact CD1-CG 4.05Å; I823-A846 HydrophobicContact CD1-CB 3.62Å; I823-A846 HydrophobicContact CG1-CB 3.88Å; I823-T847 PolarHBondContact N-O 3.01Å; I823-V848 CarbonylContact O-C 3.55Å; I823-V848 WeakPolarHBondContact O-CA 3.24Å; I823-I849 PolarHBondContact O-N 3.24Å
824	L	97.7	Very high	89.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	127.4	176.8	-48.6	-175.5	0	0	0	111.1	I760 I761 D762 M763 R764 V822 I849 A904 L905 A908	I760-L824 HydrophobicContact CG2-CD1 3.72Å; I760-L824 HydrophobicContact CG2-CD2 4.12Å; I760-L824 HydrophobicContact CG2-CG 3.72Å; I761-L824 PolarHBondContact O-N 2.94Å; D762-L824 HydrophobicContact CB-CD1 4.19Å; M763-L824 CarbonylContact C-O 3.59Å; M763-L824 WeakPolarHBondContact CA-O 3.34Å; M763-L824 WeakPolarHBondContact CB-O 3.47Å; M763-L824 PolarHBondContact N-O 3.25Å; R764-L824 HydrophobicContact CG-CB 3.78Å; R764-L824 PolarHBondContact N-O 3.45Å; V822-L824 HydrophobicContact CG1-CD2 3.93Å; L824-I849 CarbonylContact C-O 3.54Å; L824-I849 VanDerWaalsContact CA-O 3.26Å; L824-I849 WeakPolarHBondContact CA-O 3.31Å; L824-I849 HydrophobicContact CD2-CB 4.16Å; L824-A904 HydrophobicContact CD2-CB 4.35Å; L824-L905 HydrophobicContact CD1-CB 4.03Å; L824-L905 HydrophobicContact CD1-CD1 4.05Å; L824-A908 HydrophobicContact CD2-CB 3.82Å
825	T	96.5	Very high	89.7	Confident	0 Å²	0	25 Å²	25	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	157.6	-176.5	54.2	0	0	0	0	113.6	I823 T829 A837 V848 I849 G850 E851 T853	I823-T825 HydrophobicContact CG2-CG2 4.31Å; T825-T829 HydrophobicContact CG2-CG2 4.44Å; T825-A837 HydrophobicContact CG2-CB 4.45Å; T825-V848 HydrophobicContact CG2-CG1 3.53Å; T825-I849 PolarHBondContact N-O 3.49Å; T825-G850 WeakPolarHBondContact O-CA 3.46Å; T825-E851 WeakPolarHBondContact CB-O 3.41Å; T825-E851 PolarHBondContact O-N 3.47Å; T825-E851 VanDerWaalsContact O-N 3.17Å; T825-E851 PolarHBondContact OG1-O 2.98Å; T825-T853 HydrophobicContact CG2-CG2 3.81Å
826	S	94.6	Very high	89.8	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.007	15%	0.145	C	C	.	.			trans	-141.9	168.5	175.3	66.6	0	0	0	0	110.8	R764 M828 T829 P852	R764-S826 VanDerWaalsContact C-OG 3.22Å; R764-S826 WeakPolarHBondContact CA-OG 3.27Å; R764-S826 WeakPolarHBondContact O-CB 3.4Å; R764-S826 PolarHBondContact O-OG 3.04Å; S826-M828 PolarHBondContact O-N 3.11Å; S826-M828 WeakPolarHBondContact OG-CB 3.43Å; S826-M828 PolarHBondContact OG-N 2.83Å; S826-T829 PolarHBondContact N-OG1 2.9Å; S826-T829 VanDerWaalsContact O-CB 3.32Å; S826-T829 WeakPolarHBondContact O-CB 3.3Å; S826-T829 PolarHBondContact O-N 2.86Å; S826-T829 PolarHBondContact O-OG1 3.36Å; S826-T829 PolarHBondContact OG-N 3.38Å; S826-T829 PolarHBondContact OG-OG1 3Å; S826-P852 CarbonylContact C-O 3.58Å
827	H	91.1	Very high	90.5	Very high	114 Å²	114	24 Å²	24	53%	0.528	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-13	164.6	65.2	-89.5	0	0	0	114	E851 P852	H827-E851 IonicContact CE1-OE2 3.12Å; H827-E851 IonicContact CG-OE2 3.12Å; H827-E851 IonicContact ND1-OE2 3.92Å; H827-E851 PolarHBondContact ND1-OE2 2.71Å; H827-P852 WeakPolarHBondContact CA-O 3.5Å; H827-P852 PolarHBondContact N-O 3.16Å
828	M	87.9	Confident	91	Very high	88 Å²	88	24.5 Å²	24.5	43%	0.433	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-11.1	172.4	-59.7	-173.8	68.4	0	0	113.6	T767 S826 G830	T767-M828 WeakPolarHBondContact CA-O 3.21Å; T767-M828 HydrophobicContact CG2-CE 4.23Å; S826-M828 PolarHBondContact O-N 3.11Å; S826-M828 WeakPolarHBondContact OG-CB 3.43Å; S826-M828 PolarHBondContact OG-N 2.83Å; M828-G830 PolarHBondContact O-N 2.86Å
829	T	90.5	Very high	91.6	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.091	C	C	.	.			trans	-69.6	122.9	179.6	-57	0	0	0	0	109.4	M763 N766 T825 S826 A833 E834 T853 I854	M763-T829 HydrophobicContact CB-CG2 4.26Å; M763-T829 PolarHBondContact O-OG1 2.92Å; N766-T829 CarbonylContact O-C 3.57Å; N766-T829 WeakPolarHBondContact O-CA 3.43Å; T825-T829 HydrophobicContact CG2-CG2 4.44Å; S826-T829 PolarHBondContact N-OG1 2.9Å; S826-T829 VanDerWaalsContact O-CB 3.32Å; S826-T829 WeakPolarHBondContact O-CB 3.3Å; S826-T829 PolarHBondContact O-N 2.86Å; S826-T829 PolarHBondContact O-OG1 3.36Å; S826-T829 PolarHBondContact OG-N 3.38Å; S826-T829 PolarHBondContact OG-OG1 3Å; T829-A833 HydrophobicContact CG2-CB 3.65Å; T829-E834 HydrophobicContact CG2-CG 4.39Å; T829-E834 WeakPolarHBondContact O-CG 3.47Å; T829-T853 HydrophobicContact CG2-CG2 3.91Å; T829-T853 WeakPolarHBondContact O-CB 3.19Å; T829-I854 WeakPolarHBondContact O-CG2 3.13Å; T829-I854 PolarHBondContact O-N 2.66Å; T829-I854 VanDerWaalsContact O-N 3.16Å
830	G	86.9	Confident	91.8	Very high	3 Å²	3	16.8 Å²	16.8	3%	0.031	8%	0.082	C	C	.	.			trans	-139.2	146.1	-165.8	0	0	0	0	0	117.6	N766 G768 M828 A833 E834	N766-G830 PolarHBondContact O-N 3.48Å; G768-G830 WeakPolarHBondContact CA-O 3.47Å; G768-G830 PolarHBondContact N-O 3.45Å; M828-G830 PolarHBondContact O-N 2.86Å; G830-A833 WeakPolarHBondContact O-CB 3.45Å; G830-A833 PolarHBondContact O-N 3.06Å; G830-E834 WeakPolarHBondContact CA-OE2 3.36Å
831	S	85.3	Confident	91.9	Very high	26 Å²	26	15.7 Å²	15.7	18%	0.182	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	-105.4	170	-170.6	0	0	0	0	114.6	A833 E834 L835 S857	S831-A833 PolarHBondContact O-N 3.38Å; S831-E834 PolarHBondContact N-OE2 3.16Å; S831-E834 WeakPolarHBondContact O-CB 3.34Å; S831-E834 PolarHBondContact O-N 3.03Å; S831-L835 PolarHBondContact O-N 2.69Å; S831-S857 WeakPolarHBondContact CB-O 3.43Å; S831-S857 PolarHBondContact OG-O 2.72Å
832	P	87.8	Confident	91.6	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.006	8%	0.083	C	C	.	.	H	α-helix	trans	-63.1	-24.4	177.1	-23.7	36.3	0	0	0	114.8	M732 G769 V774 E834 L835 F836	M732-P832 HydrophobicContact CB-CB 3.75Å; M732-P832 HydrophobicContact CB-CG 4.27Å; M732-P832 HydrophobicContact CE-CB 4.25Å; M732-P832 WeakPolarHBondContact CE-O 3.37Å; M732-P832 HydrophobicContact CG-CB 3.68Å; G769-P832 WeakPolarHBondContact O-CG 3.48Å; V774-P832 HydrophobicContact CG2-CB 3.83Å; P832-E834 VanDerWaalsContact C-N 3.33Å; P832-L835 PolarHBondContact O-N 3.39Å; P832-F836 PolarHBondContact O-N 3.25Å
833	A	90.7	Very high	91.3	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-65.2	-42.2	176.5	0	0	0	0	0	110.7	M763 N766 T829 G830 S831 F836 A837	M763-A833 HydrophobicContact CE-CB 3.78Å; N766-A833 HydrophobicContact CB-CB 4.09Å; N766-A833 WeakPolarHBondContact O-CB 3.47Å; T829-A833 HydrophobicContact CG2-CB 3.65Å; G830-A833 WeakPolarHBondContact O-CB 3.45Å; G830-A833 PolarHBondContact O-N 3.06Å; S831-A833 PolarHBondContact O-N 3.38Å; A833-F836 PolarHBondContact O-N 3.1Å; A833-A837 WeakPolarHBondContact O-CB 3.24Å; A833-A837 PolarHBondContact O-N 3.09Å
834	E	90.5	Very high	90.8	Very high	13 Å²	13	25.8 Å²	25.8	6%	0.061	13%	0.131	C	C	.	.	H	α-helix	trans	-67.9	-42.7	174.7	-55.2	179.4	96.5	0	0	111	T829 G830 S831 P832 F836 A837 R838 T853 I854 G855 G856 V893	T829-E834 HydrophobicContact CG2-CG 4.39Å; T829-E834 WeakPolarHBondContact O-CG 3.47Å; G830-E834 WeakPolarHBondContact CA-OE2 3.36Å; S831-E834 PolarHBondContact N-OE2 3.16Å; S831-E834 WeakPolarHBondContact O-CB 3.34Å; S831-E834 PolarHBondContact O-N 3.03Å; P832-E834 VanDerWaalsContact C-N 3.33Å; E834-F836 VanDerWaalsContact C-N 3.29Å; E834-F836 PolarHBondContact O-N 2.73Å; E834-A837 PolarHBondContact O-N 3.46Å; E834-R838 WeakPolarHBondContact O-CB 3.36Å; E834-R838 PolarHBondContact O-N 3.11Å; E834-T853 HydrophobicContact CG-CG2 4.4Å; E834-T853 WeakPolarHBondContact CG-OG1 3.42Å; E834-T853 VanDerWaalsContact OE1-CB 3.23Å; E834-T853 WeakPolarHBondContact OE1-CB 3.11Å; E834-T853 PolarHBondContact OE1-OG1 3.4Å; E834-I854 PolarHBondContact OE1-N 2.86Å; E834-G855 PolarHBondContact OE1-N 2.83Å; E834-G856 WeakPolarHBondContact OE2-CA 3.35Å; E834-G856 PolarHBondContact OE2-N 3.3Å; E834-V893 HydrophobicContact CB-CG2 4.1Å
835	L	90.2	Very high	90.5	Very high	3 Å²	3	27 Å²	27	2%	0.016	14%	0.135	C	C	.	.	H	α-helix	trans	-55.5	-42.9	174.4	-179.2	61.1	0	0	0	112.1	V774 Y791 S831 P832 A839 L858 I879 W888	V774-L835 HydrophobicContact CB-CD2 4.27Å; V774-L835 HydrophobicContact CG1-CD2 4.33Å; V774-L835 HydrophobicContact CG1-CG 4.07Å; V774-L835 HydrophobicContact CG2-CD2 4.15Å; Y791-L835 HydrophobicContact CD1-CD1 3.71Å; Y791-L835 HydrophobicContact CD1-CG 4.47Å; Y791-L835 HydrophobicContact CD2-CD1 3.97Å; Y791-L835 HydrophobicContact CE1-CD1 3.55Å; Y791-L835 HydrophobicContact CE1-CD2 4.34Å; Y791-L835 HydrophobicContact CE1-CG 3.84Å; Y791-L835 HydrophobicContact CE2-CD1 3.77Å; Y791-L835 HydrophobicContact CE2-CD2 4.12Å; Y791-L835 HydrophobicContact CE2-CG 4.32Å; Y791-L835 HydrophobicContact CG-CD1 3.96Å; Y791-L835 WeakPolarHBondContact OH-CD2 3.24Å; S831-L835 PolarHBondContact O-N 2.69Å; P832-L835 PolarHBondContact O-N 3.39Å; L835-A839 VanDerWaalsContact O-CB 3.24Å; L835-A839 WeakPolarHBondContact O-CB 3.4Å; L835-A839 PolarHBondContact O-N 3.33Å; L835-L858 HydrophobicContact CB-CD2 4.23Å; L835-L858 HydrophobicContact CD1-CD1 4.4Å; L835-L858 HydrophobicContact CD2-CD1 3.87Å; L835-L858 HydrophobicContact CD2-CD2 3.8Å; L835-I879 HydrophobicContact CD1-CD1 4Å; L835-I879 HydrophobicContact CD1-CG2 4.36Å; L835-W888 HydrophobicContact CD1-CH2 4.02Å; L835-W888 HydrophobicContact CD1-CZ3 3.55Å
836	F	93.3	Very high	90.4	Very high	1 Å²	1	27.3 Å²	27.3	0%	0.004	14%	0.138	C	C	.	.	H	α-helix	trans	-66.7	-54.4	174.2	178	-92.9	0	0	0	111.3	M732 I761 M763 V774 F777 C778 F781 I823 P832 A833 E834 R838 A839 M840	M732-F836 HydrophobicContact CE-CB 4.09Å; I761-F836 HydrophobicContact CD1-CE1 3.93Å; I761-F836 HydrophobicContact CD1-CZ 3.81Å; I761-F836 HydrophobicContact CG2-CE1 4.48Å; M763-F836 HydrophobicContact CE-CB 4.32Å; M763-F836 HydrophobicContact CE-CD1 3.9Å; M763-F836 HydrophobicContact CE-CG 4.4Å; M763-F836 HydrophobicContact SD-CD1 3.55Å; M763-F836 VanDerWaalsContact SD-CD1 3.55Å; M763-F836 HydrophobicContact SD-CE1 4Å; V774-F836 HydrophobicContact CG1-CB 3.92Å; V774-F836 HydrophobicContact CG1-CD2 4.3Å; F777-F836 HydrophobicContact CB-CD2 4.12Å; F777-F836 HydrophobicContact CB-CE2 3.87Å; C778-F836 WeakPolarHBondContact SG-CD2 3.48Å; F781-F836 HydrophobicContact CD2-CE2 4.44Å; F781-F836 HydrophobicContact CD2-CZ 4.27Å; F781-F836 HydrophobicContact CE2-CE2 4.24Å; F781-F836 AromaticContact CE2-CZ 3.92Å; F781-F836 HydrophobicContact CE2-CZ 3.92Å; I823-F836 HydrophobicContact CD1-CD1 4.07Å; I823-F836 HydrophobicContact CD1-CE1 3.66Å; I823-F836 HydrophobicContact CG1-CE1 4.32Å; P832-F836 PolarHBondContact O-N 3.25Å; A833-F836 PolarHBondContact O-N 3.1Å; E834-F836 VanDerWaalsContact C-N 3.29Å; E834-F836 PolarHBondContact O-N 2.73Å; F836-R838 VanDerWaalsContact C-N 3.3Å; F836-R838 PolarHBondContact O-N 3.39Å; F836-A839 PolarHBondContact O-N 2.86Å; F836-M840 HydrophobicContact CD1-CG 4.32Å; F836-M840 HydrophobicContact CD2-CG 4.37Å; F836-M840 HydrophobicContact CE1-CG 4.04Å; F836-M840 HydrophobicContact CE2-CG 4.08Å; F836-M840 HydrophobicContact CE2-SD 4.38Å; F836-M840 HydrophobicContact CG-CG 4.48Å; F836-M840 HydrophobicContact CZ-CG 3.91Å; F836-M840 HydrophobicContact CZ-SD 4.46Å; F836-M840 WeakPolarHBondContact O-CB 3.19Å; F836-M840 WeakPolarHBondContact O-CG 3.35Å; F836-M840 PolarHBondContact O-N 3.43Å
837	A	93.8	Very high	90.3	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-57.5	-42.9	-178.8	0	0	0	0	0	112.2	I823 T825 A833 E834 M840 S841	I823-A837 HydrophobicContact CG2-CB 4.14Å; T825-A837 HydrophobicContact CG2-CB 4.45Å; A833-A837 WeakPolarHBondContact O-CB 3.24Å; A833-A837 PolarHBondContact O-N 3.09Å; E834-A837 PolarHBondContact O-N 3.46Å; A837-M840 PolarHBondContact O-N 3.32Å; A837-S841 VanDerWaalsContact O-CB 3.25Å; A837-S841 WeakPolarHBondContact O-CB 3.43Å; A837-S841 PolarHBondContact O-N 3.48Å
838	R	91.5	Very high	90.5	Very high	64 Å²	64	22.6 Å²	22.6	24%	0.242	12%	0.117	C	C	.	.	H	α-helix	trans	-66.6	-45.4	177.9	-164.2	74.2	-148.1	-162.3	10.3	112.4	E834 F836 M840 S841 D842 W888 V893	E834-R838 WeakPolarHBondContact O-CB 3.36Å; E834-R838 PolarHBondContact O-N 3.11Å; F836-R838 VanDerWaalsContact C-N 3.3Å; F836-R838 PolarHBondContact O-N 3.39Å; R838-M840 VanDerWaalsContact C-N 3.3Å; R838-M840 PolarHBondContact O-N 2.74Å; R838-S841 WeakPolarHBondContact O-CB 3.49Å; R838-S841 PolarHBondContact O-N 3.25Å; R838-D842 IonicContact CZ-OD1 3.55Å; R838-D842 VanDerWaalsContact CZ-OD1 3.3Å; R838-D842 IonicContact NE-OD1 3.48Å; R838-D842 PolarHBondContact NE-OD1 3.36Å; R838-D842 IonicContact NH2-OD1 3.74Å; R838-D842 PolarHBondContact NH2-OD1 2.91Å; R838-D842 WeakPolarHBondContact O-CB 3.47Å; R838-D842 PolarHBondContact O-N 3.41Å; R838-W888 HydrophobicContact CB-CE3 4.22Å; R838-W888 HydrophobicContact CB-CH2 3.74Å; R838-W888 HydrophobicContact CB-CZ2 4.1Å; R838-W888 HydrophobicContact CB-CZ3 3.77Å; R838-W888 HydrophobicContact CG-CD2 3.65Å; R838-W888 VanDerWaalsContact CG-CE2 3.48Å; R838-W888 HydrophobicContact CG-CE3 3.75Å; R838-W888 HydrophobicContact CG-CG 4.34Å; R838-W888 HydrophobicContact CG-CH2 3.66Å; R838-W888 HydrophobicContact CG-CZ2 3.53Å; R838-W888 HydrophobicContact CG-CZ3 3.73Å; R838-V893 HydrophobicContact CB-CG2 3.81Å; R838-V893 HydrophobicContact CG-CG2 4.39Å
839	A	91.9	Very high	90.9	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-63.2	-37.3	177.2	0	0	0	0	0	112.1	Y791 L835 F836 S841 L843 W888	Y791-A839 HydrophobicContact CD1-CB 4.03Å; Y791-A839 HydrophobicContact CE1-CB 4.26Å; L835-A839 VanDerWaalsContact O-CB 3.24Å; L835-A839 WeakPolarHBondContact O-CB 3.4Å; L835-A839 PolarHBondContact O-N 3.33Å; F836-A839 PolarHBondContact O-N 2.86Å; A839-S841 VanDerWaalsContact C-N 3.34Å; A839-L843 WeakPolarHBondContact O-CB 3.3Å; A839-L843 WeakPolarHBondContact O-CG 3.31Å; A839-L843 PolarHBondContact O-N 2.97Å; A839-W888 HydrophobicContact CB-CH2 4.37Å
840	M	92.5	Very high	91.1	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-73.3	-27.1	176.2	-61.8	-59.8	-71.1	0	0	112.6	C778 F781 F782 L821 I823 F836 A837 R838 R845 A846	C778-M840 HydrophobicContact CB-SD 4.17Å; F781-M840 HydrophobicContact CB-CE 3.51Å; F781-M840 HydrophobicContact CD2-CE 3.84Å; F781-M840 HydrophobicContact CG-CE 3.82Å; F782-M840 HydrophobicContact CE2-CE 4.35Å; F782-M840 HydrophobicContact CE2-SD 3.71Å; F782-M840 HydrophobicContact CZ-SD 4.1Å; L821-M840 HydrophobicContact CD2-CE 3.43Å; L821-M840 VanDerWaalsContact CD2-CE 3.43Å; I823-M840 HydrophobicContact CD1-CB 3.7Å; I823-M840 HydrophobicContact CD1-CG 4.05Å; F836-M840 HydrophobicContact CD1-CG 4.32Å; F836-M840 HydrophobicContact CD2-CG 4.37Å; F836-M840 HydrophobicContact CE1-CG 4.04Å; F836-M840 HydrophobicContact CE2-CG 4.08Å; F836-M840 HydrophobicContact CE2-SD 4.38Å; F836-M840 HydrophobicContact CG-CG 4.48Å; F836-M840 HydrophobicContact CZ-CG 3.91Å; F836-M840 HydrophobicContact CZ-SD 4.46Å; F836-M840 WeakPolarHBondContact O-CB 3.19Å; F836-M840 WeakPolarHBondContact O-CG 3.35Å; F836-M840 PolarHBondContact O-N 3.43Å; A837-M840 PolarHBondContact O-N 3.32Å; R838-M840 VanDerWaalsContact C-N 3.3Å; R838-M840 PolarHBondContact O-N 2.74Å; M840-R845 HydrophobicContact CE-CB 4.01Å; M840-R845 HydrophobicContact CE-CG 3.47Å; M840-R845 VanDerWaalsContact CE-CG 3.47Å; M840-R845 PolarHBondContact O-N 2.77Å; M840-A846 HydrophobicContact CB-CB 3.92Å; M840-A846 PolarHBondContact O-N 3.07Å; M840-A846 VanDerWaalsContact O-N 3.09Å
841	S	90.8	Very high	91.5	Very high	15 Å²	15	20.4 Å²	20.4	11%	0.105	11%	0.105	C	C	.	.	H	α-helix	trans	-78.3	-54.2	174.6	-176.5	0	0	0	0	113	A837 R838 A839 L843 N844 H896	A837-S841 VanDerWaalsContact O-CB 3.25Å; A837-S841 WeakPolarHBondContact O-CB 3.43Å; A837-S841 PolarHBondContact O-N 3.48Å; R838-S841 WeakPolarHBondContact O-CB 3.49Å; R838-S841 PolarHBondContact O-N 3.25Å; A839-S841 VanDerWaalsContact C-N 3.34Å; S841-L843 PolarHBondContact O-N 2.9Å; S841-L843 VanDerWaalsContact O-N 3.09Å; S841-N844 PolarHBondContact O-N 3.01Å; S841-H896 PolarHBondContact OG-CE1 2.8Å
842	D	88.3	Confident	91.9	Very high	24 Å²	24	21.5 Å²	21.5	13%	0.128	11%	0.112	C	C	.	.	H	α-helix	trans	-60.5	-20.4	-179.1	-92.6	35.6	0	0	0	112.4	R838 S881 W888	R838-D842 IonicContact CZ-OD1 3.55Å; R838-D842 VanDerWaalsContact CZ-OD1 3.3Å; R838-D842 IonicContact NE-OD1 3.48Å; R838-D842 PolarHBondContact NE-OD1 3.36Å; R838-D842 IonicContact NH2-OD1 3.74Å; R838-D842 PolarHBondContact NH2-OD1 2.91Å; R838-D842 WeakPolarHBondContact O-CB 3.47Å; R838-D842 PolarHBondContact O-N 3.41Å; D842-S881 WeakPolarHBondContact OD2-CB 3.44Å; D842-S881 PolarHBondContact OD2-OG 2.93Å; D842-W888 PolarHBondContact OD2-NE1 3.36Å
843	L	88.7	Confident	92.1	Very high	37 Å²	37	22 Å²	22	19%	0.194	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	12.5	175.7	-63.8	177.7	0	0	0	114	F782 L790 A839 S841 R845 P882 T883	F782-L843 HydrophobicContact CE1-CB 4.22Å; F782-L843 HydrophobicContact CE1-CD1 4.23Å; F782-L843 HydrophobicContact CE2-CD1 4.22Å; F782-L843 HydrophobicContact CZ-CB 3.96Å; F782-L843 HydrophobicContact CZ-CD1 3.63Å; F782-L843 HydrophobicContact CZ-CG 4.47Å; L790-L843 HydrophobicContact CD2-CD1 3.81Å; A839-L843 WeakPolarHBondContact O-CB 3.3Å; A839-L843 WeakPolarHBondContact O-CG 3.31Å; A839-L843 PolarHBondContact O-N 2.97Å; S841-L843 PolarHBondContact O-N 2.9Å; S841-L843 VanDerWaalsContact O-N 3.09Å; L843-R845 PolarHBondContact O-N 2.89Å; L843-R845 VanDerWaalsContact O-N 3.07Å; L843-P882 HydrophobicContact CD2-CG 4.04Å; L843-T883 HydrophobicContact CD2-CG2 4.37Å
844	N	87.5	Confident	91.9	Very high	151 Å²	151	27.2 Å²	27.2	81%	0.807	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	25.2	179.8	-61.6	-30.5	0	0	0	114.9	S841	S841-N844 PolarHBondContact O-N 3.01Å
845	R	90.7	Very high	91.5	Very high	26 Å²	26	27 Å²	27	10%	0.098	14%	0.143	C	C	.	.			trans	-92.2	-23.8	-175.3	-177.7	56.4	-163.8	106.2	-14.1	113.7	F781 F782 G816 S817 K819 L821 M840 L843	F781-R845 HydrophobicContact CB-CG 4.34Å; F781-R845 PolarHBondContact O-NE 2.88Å; F782-R845 HydrophobicContact CD1-CG 4.35Å; F782-R845 HydrophobicContact CE1-CB 3.63Å; F782-R845 HydrophobicContact CE1-CG 3.79Å; F782-R845 HydrophobicContact CZ-CB 3.65Å; F782-R845 HydrophobicContact CZ-CG 3.87Å; G816-R845 PolarHBondContact O-NH2 3.42Å; S817-R845 PolarHBondContact O-NE 2.88Å; S817-R845 PolarHBondContact O-NH2 2.91Å; K819-R845 VanDerWaalsContact O-CZ 3.3Å; K819-R845 PolarHBondContact O-NH1 3Å; K819-R845 PolarHBondContact O-NH2 3.38Å; L821-R845 HydrophobicContact CD2-CG 4.33Å; M840-R845 HydrophobicContact CE-CB 4.01Å; M840-R845 HydrophobicContact CE-CG 3.47Å; M840-R845 VanDerWaalsContact CE-CG 3.47Å; M840-R845 PolarHBondContact O-N 2.77Å; L843-R845 PolarHBondContact O-N 2.89Å; L843-R845 VanDerWaalsContact O-N 3.07Å
846	A	93.3	Very high	90.8	Very high	6 Å²	6	28.2 Å²	28.2	5%	0.05	16%	0.155	C	C	.	.			trans	-136.9	141.1	178.7	0	0	0	0	0	113.1	L821 I823 M840	L821-A846 HydrophobicContact CB-CB 4.35Å; L821-A846 HydrophobicContact CD2-CB 4.03Å; L821-A846 HydrophobicContact CG-CB 3.94Å; L821-A846 CarbonylContact O-C 3.59Å; L821-A846 VanDerWaalsContact O-CA 3.24Å; L821-A846 WeakPolarHBondContact O-CA 3.42Å; I823-A846 HydrophobicContact CD1-CB 3.62Å; I823-A846 HydrophobicContact CG1-CB 3.88Å; M840-A846 HydrophobicContact CB-CB 3.92Å; M840-A846 PolarHBondContact O-N 3.07Å; M840-A846 VanDerWaalsContact O-N 3.09Å
847	T	93.3	Very high	89.9	Confident	17 Å²	17	29.3 Å²	29.3	10%	0.104	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	123.8	167.7	-53.1	0	0	0	0	109.2	L821 V822 I823 I849 H896 R915	L821-T847 PolarHBondContact O-N 3.1Å; V822-T847 CarbonylContact C-O 3.57Å; V822-T847 VanDerWaalsContact CA-O 3.31Å; V822-T847 WeakPolarHBondContact CA-O 3.36Å; I823-T847 PolarHBondContact N-O 3.01Å; T847-I849 HydrophobicContact CG2-CD1 4.17Å; T847-I849 HydrophobicContact CG2-CG1 3.99Å; T847-H896 HydrophobicContact CG2-CB 4.2Å; T847-R915 PolarHBondContact OG1-NH1 2.87Å; T847-R915 PolarHBondContact OG1-NH2 3.01Å
848	V	95.8	Very high	89	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	130.9	178.3	-173.3	0	0	0	0	109.9	I823 T825 V893 P895 H896 V897	I823-V848 CarbonylContact O-C 3.55Å; I823-V848 WeakPolarHBondContact O-CA 3.24Å; T825-V848 HydrophobicContact CG2-CG1 3.53Å; V848-V893 HydrophobicContact CG1-CG1 4.45Å; V848-P895 HydrophobicContact CG1-CB 4.26Å; V848-H896 PolarHBondContact N-ND1 2.86Å; V848-H896 VanDerWaalsContact N-ND1 3.17Å; V848-H896 WeakPolarHBondContact O-CB 3.49Å; V848-H896 PolarHBondContact O-N 2.9Å; V848-V897 PolarHBondContact O-N 2.9Å
849	I	96.4	Very high	88.5	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	134.3	-171.9	-55.2	-171.6	0	0	0	110.8	V822 I823 L824 T825 T847 V897 T899 A904 V907 A908 I911	V822-I849 HydrophobicContact CG1-CB 4.42Å; V822-I849 HydrophobicContact CG1-CD1 3.62Å; V822-I849 HydrophobicContact CG1-CG1 3.9Å; I823-I849 PolarHBondContact O-N 3.24Å; L824-I849 CarbonylContact C-O 3.54Å; L824-I849 VanDerWaalsContact CA-O 3.26Å; L824-I849 WeakPolarHBondContact CA-O 3.31Å; L824-I849 HydrophobicContact CD2-CB 4.16Å; T825-I849 PolarHBondContact N-O 3.49Å; T847-I849 HydrophobicContact CG2-CD1 4.17Å; T847-I849 HydrophobicContact CG2-CG1 3.99Å; I849-V897 WeakPolarHBondContact CA-O 3.48Å; I849-V897 HydrophobicContact CG1-CB 4.13Å; I849-V897 HydrophobicContact CG1-CG2 4.42Å; I849-V897 HydrophobicContact CG2-CB 4.24Å; I849-T899 HydrophobicContact CG2-CG2 3.61Å; I849-A904 HydrophobicContact CG2-CB 4.26Å; I849-V907 HydrophobicContact CG2-CB 4.33Å; I849-V907 HydrophobicContact CG2-CG1 3.99Å; I849-A908 HydrophobicContact CD1-CB 4.14Å; I849-I911 HydrophobicContact CD1-CD1 3.62Å
850	G	95.1	Very high	88.2	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	135.8	-135.3	175.7	0	0	0	0	0	111.9	T825 P895 V897 S898 T899	T825-G850 WeakPolarHBondContact O-CA 3.46Å; G850-P895 WeakPolarHBondContact O-CG 3.33Å; G850-V897 PolarHBondContact N-O 2.76Å; G850-S898 CarbonylContact O-C 3.6Å; G850-S898 VanDerWaalsContact O-CA 3.31Å; G850-S898 WeakPolarHBondContact O-CA 3.35Å; G850-T899 CarbonylContact C-O 3.03Å; G850-T899 WeakPolarHBondContact CA-O 3.44Å; G850-T899 PolarHBondContact O-N 3.49Å; G850-T899 VanDerWaalsContact O-O 3.05Å
851	E	94.9	Very high	87.9	Confident	45 Å²	45	33 Å²	33	21%	0.21	20%	0.198	C	C	.	.	S	Bend	trans	-100.5	160.3	174.8	-65.4	155.8	-161.5	0	0	110.5	T825 H827 V901	T825-E851 WeakPolarHBondContact CB-O 3.41Å; T825-E851 PolarHBondContact O-N 3.47Å; T825-E851 VanDerWaalsContact O-N 3.17Å; T825-E851 PolarHBondContact OG1-O 2.98Å; H827-E851 IonicContact CE1-OE2 3.12Å; H827-E851 IonicContact CG-OE2 3.12Å; H827-E851 IonicContact ND1-OE2 3.92Å; H827-E851 PolarHBondContact ND1-OE2 2.71Å; E851-V901 HydrophobicContact CG-CG2 4.13Å; E851-V901 WeakPolarHBondContact OE1-CB 3.42Å; E851-V901 WeakPolarHBondContact OE1-CG2 3.49Å; E851-V901 PolarHBondContact OE1-N 3.22Å; E851-V901 WeakPolarHBondContact OE2-CG2 3.4Å
852	P	93.8	Very high	87.8	Confident	49 Å²	49	35.7 Å²	35.7	32%	0.318	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-56.4	151.1	167.1	-22.7	34.2	0	0	0	112	S826 H827	S826-P852 CarbonylContact C-O 3.58Å; H827-P852 WeakPolarHBondContact CA-O 3.5Å; H827-P852 PolarHBondContact N-O 3.16Å
853	T	92.1	Very high	88	Confident	10 Å²	10	37 Å²	37	6%	0.061	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-92.1	168.7	-176.8	70.7	0	0	0	0	112.8	T825 T829 E834 G855 G892 V893	T825-T853 HydrophobicContact CG2-CG2 3.81Å; T829-T853 HydrophobicContact CG2-CG2 3.91Å; T829-T853 WeakPolarHBondContact O-CB 3.19Å; E834-T853 HydrophobicContact CG-CG2 4.4Å; E834-T853 WeakPolarHBondContact CG-OG1 3.42Å; E834-T853 VanDerWaalsContact OE1-CB 3.23Å; E834-T853 WeakPolarHBondContact OE1-CB 3.11Å; E834-T853 PolarHBondContact OE1-OG1 3.4Å; T853-G855 VanDerWaalsContact C-N 3.33Å; T853-G855 PolarHBondContact O-N 2.82Å; T853-G892 WeakPolarHBondContact OG1-CA 3.47Å; T853-V893 HydrophobicContact CG2-CB 4.01Å; T853-V893 PolarHBondContact N-O 2.69Å; T853-V893 PolarHBondContact OG1-N 3.12Å
854	I	86.3	Confident	88.2	Confident	111 Å²	111	39.5 Å²	39.5	57%	0.569	23%	0.228	S	C	*	.			trans	-68.5	-21.4	-163.6	-156.9	170.9	0	0	0	115.7	T829 E834	T829-I854 WeakPolarHBondContact O-CG2 3.13Å; T829-I854 PolarHBondContact O-N 2.66Å; T829-I854 VanDerWaalsContact O-N 3.16Å; E834-I854 PolarHBondContact OE1-N 2.86Å
855	G	81.8	Confident	88.5	Confident	9 Å²	9	32.3 Å²	32.3	9%	0.093	19%	0.19	C	C	.	.			trans	83.1	46.7	-176.2	0	0	0	0	0	113.9	R682 E834 T853 F890	R682-G855 WeakPolarHBondContact CD-O 3.38Å; R682-G855 WeakPolarHBondContact CG-O 3.39Å; E834-G855 PolarHBondContact OE1-N 2.83Å; T853-G855 VanDerWaalsContact C-N 3.33Å; T853-G855 PolarHBondContact O-N 2.82Å; G855-F890 WeakPolarHBondContact CA-O 3.41Å
856	G	76.2	Confident	88.5	Confident	27 Å²	27	35.8 Å²	35.8	28%	0.278	20%	0.203	S	C	.	.			trans	-70.2	170.3	-174.5	0	0	0	0	0	116.2	R682 E834	R682-G856 VanDerWaalsContact CD-C 3.46Å; R682-G856 WeakPolarHBondContact CD-O 3.35Å; R682-G856 PolarHBondContact NH1-O 3.01Å; R682-G856 VanDerWaalsContact NH1-O 3.07Å; E834-G856 WeakPolarHBondContact OE2-CA 3.35Å; E834-G856 PolarHBondContact OE2-N 3.3Å
857	S	73.6	Confident	88.1	Confident	25 Å²	25	43.7 Å²	43.7	18%	0.175	24%	0.244	C	C	.	.			trans	-105.7	147.7	161.3	-174.8	0	0	0	0	110.1	S831 S859	S831-S857 WeakPolarHBondContact CB-O 3.43Å; S831-S857 PolarHBondContact OG-O 2.72Å; S857-S859 VanDerWaalsContact C-N 3.31Å; S857-S859 PolarHBondContact OG-N 2.83Å; S857-S859 VanDerWaalsContact OG-N 3.09Å; S857-S859 PolarHBondContact OG-O 3.38Å
858	L	73.8	Confident	88	Confident	34 Å²	34	43.7 Å²	43.7	18%	0.178	25%	0.245	C	C	.	.	S	Bend	trans	-75.6	-21.8	167.6	-58.9	-176.3	0	0	0	112.9	I793 L835 I879	I793-L858 HydrophobicContact CD1-CD1 4.34Å; L835-L858 HydrophobicContact CB-CD2 4.23Å; L835-L858 HydrophobicContact CD1-CD1 4.4Å; L835-L858 HydrophobicContact CD2-CD1 3.87Å; L835-L858 HydrophobicContact CD2-CD2 3.8Å; L858-I879 HydrophobicContact CD1-CD1 3.72Å; L858-I879 HydrophobicContact CD1-CG1 3.73Å; L858-I879 HydrophobicContact CG-CD1 3.98Å; L858-I879 HydrophobicContact CG-CG1 4.4Å
859	S	81.4	Confident	87.8	Confident	34 Å²	34	45.7 Å²	45.7	24%	0.238	26%	0.257	C	S	.	.			trans	-165.1	124.7	-174.1	-179.6	0	0	0	0	110.4	S857 N876 Q877	S857-S859 VanDerWaalsContact C-N 3.31Å; S857-S859 PolarHBondContact OG-N 2.83Å; S857-S859 VanDerWaalsContact OG-N 3.09Å; S857-S859 PolarHBondContact OG-O 3.38Å; S859-N876 VanDerWaalsContact CB-OD1 3.31Å; S859-N876 WeakPolarHBondContact CB-OD1 3.32Å; S859-N876 PolarHBondContact O-N 2.85Å; S859-N876 PolarHBondContact O-OD1 2.77Å; S859-N876 PolarHBondContact OG-OD1 3.42Å; S859-Q877 PolarHBondContact OG-NE2 2.95Å
860	S	85.3	Confident	87.6	Confident	61 Å²	61	45.7 Å²	45.7	43%	0.427	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	151.3	165.8	53.6	0	0	0	0	109.3	I874	S860-I874 CarbonylContact C-O 3.57Å; S860-I874 VanDerWaalsContact CA-O 3.24Å; S860-I874 WeakPolarHBondContact CA-O 3.37Å; S860-I874 WeakPolarHBondContact CB-O 3.48Å
861	G	86.1	Confident	87.6	Confident	12 Å²	12	46.6 Å²	46.6	12%	0.124	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	145.6	165.3	0	0	0	0	0	109.7	Y863 S873 I874 N876	G861-Y863 VanDerWaalsContact CA-CE2 3.44Å; G861-Y863 WeakPolarHBondContact O-CD2 3.49Å; G861-Y863 VanDerWaalsContact O-CE2 3.32Å; G861-Y863 WeakPolarHBondContact O-CE2 3.19Å; G861-S873 WeakPolarHBondContact O-CA 3.47Å; G861-I874 PolarHBondContact N-O 3.29Å; G861-I874 PolarHBondContact O-N 3.38Å; G861-N876 PolarHBondContact N-ND2 3.17Å
862	T	89.7	Confident	87.5	Confident	71 Å²	71	44.6 Å²	44.6	44%	0.436	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	126.4	168.9	-60.2	0	0	0	0	108	F686 P692 Y871 A872	F686-T862 HydrophobicContact CE1-CG2 4.14Å; F686-T862 HydrophobicContact CZ-CG2 3.76Å; P692-T862 HydrophobicContact CG-CG2 4.24Å; T862-Y871 HydrophobicContact CG2-CD1 4.13Å; T862-Y871 HydrophobicContact CG2-CG 4.45Å; T862-A872 WeakPolarHBondContact CA-O 3.37Å
863	Y	91.4	Very high	87.4	Confident	52 Å²	52	42.8 Å²	42.8	20%	0.204	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	130.9	-172.1	-56.2	-82.8	0	0	0	110.8	L630 H634 G861 Y871 A872 I874	L630-Y863 HydrophobicContact CD2-CG 4.4Å; H634-Y863 HydrophobicContact CB-CD2 4.41Å; H634-Y863 HydrophobicContact CB-CE1 4.43Å; H634-Y863 HydrophobicContact CB-CE2 3.7Å; H634-Y863 AromaticContact CD2-CD1 3.51Å; H634-Y863 AromaticContact CD2-CD2 3.93Å; H634-Y863 AromaticContact CD2-CE1 3.41Å; H634-Y863 VanDerWaalsContact CD2-CE1 3.41Å; H634-Y863 WeakPolarHBondContact CD2-CE1 3.04Å; H634-Y863 AromaticContact CD2-CE2 3.83Å; H634-Y863 AromaticContact CD2-CG 3.78Å; H634-Y863 AromaticContact CD2-CZ 3.57Å; H634-Y863 AromaticContact CE1-CE1 3.78Å; H634-Y863 AromaticContact CG-CE1 3.66Å; H634-Y863 AromaticContact CG-CE2 3.8Å; H634-Y863 AromaticContact CG-CZ 3.42Å; H634-Y863 VanDerWaalsContact CG-CZ 3.42Å; H634-Y863 AromaticContact ND1-CE1 3.89Å; H634-Y863 AromaticContact ND1-CZ 3.88Å; H634-Y863 AromaticContact NE2-CD1 3.59Å; H634-Y863 AromaticContact NE2-CE1 3.49Å; H634-Y863 WeakPolarHBondContact NE2-CE1 3.25Å; G861-Y863 VanDerWaalsContact CA-CE2 3.44Å; G861-Y863 WeakPolarHBondContact O-CD2 3.49Å; G861-Y863 VanDerWaalsContact O-CE2 3.32Å; G861-Y863 WeakPolarHBondContact O-CE2 3.19Å; Y863-Y871 CarbonylContact O-C 3.57Å; Y863-Y871 WeakPolarHBondContact O-CA 3.36Å; Y863-A872 PolarHBondContact N-O 3.5Å; Y863-A872 PolarHBondContact O-N 2.74Å; Y863-I874 HydrophobicContact CD2-CB 4.17Å; Y863-I874 HydrophobicContact CD2-CD1 4Å; Y863-I874 HydrophobicContact CD2-CG1 4.21Å; Y863-I874 HydrophobicContact CE2-CB 4.06Å
864	Q	92.9	Very high	87.4	Confident	90 Å²	90	42.3 Å²	42.3	42%	0.421	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	133.5	178.4	-162.8	-178.8	6.9	0	0	111.2	R866 S868 Y871	Q864-R866 WeakPolarHBondContact CG-O 3.15Å; Q864-R866 PolarHBondContact O-N 3.03Å; Q864-S868 WeakPolarHBondContact CG-O 3.31Å; Q864-S868 PolarHBondContact NE2-O 2.97Å; Q864-Y871 HydrophobicContact CB-CD1 3.9Å; Q864-Y871 HydrophobicContact CB-CE1 3.61Å; Q864-Y871 HydrophobicContact CG-CD1 4.16Å; Q864-Y871 HydrophobicContact CG-CE1 3.66Å
865	I	94.2	Very high	87.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.211	C	C	.	.			trans	-87.5	89.7	-178.5	-61.7	155.8	0	0	0	108.7	L623 V627 L630 V685 S868 L870 A872	L623-I865 HydrophobicContact CB-CG2 4.48Å; L623-I865 HydrophobicContact CD2-CG2 4.35Å; V627-I865 HydrophobicContact CG2-CD1 3.69Å; V627-I865 HydrophobicContact CG2-CG1 3.99Å; V627-I865 HydrophobicContact CG2-CG2 3.91Å; L630-I865 HydrophobicContact CD1-CG1 3.86Å; V685-I865 HydrophobicContact CB-CD1 4.45Å; V685-I865 HydrophobicContact CG1-CD1 3.58Å; V685-I865 HydrophobicContact CG2-CD1 3.99Å; I865-S868 WeakPolarHBondContact O-CB 3.41Å; I865-S868 PolarHBondContact O-OG 2.93Å; I865-L870 HydrophobicContact CB-CB 4.18Å; I865-L870 HydrophobicContact CD1-CB 3.76Å; I865-L870 PolarHBondContact N-O 2.88Å; I865-A872 HydrophobicContact CD1-CB 4.11Å; I865-A872 HydrophobicContact CG1-CB 4.23Å
866	R	90.8	Very high	88	Confident	98 Å²	98	37.7 Å²	37.7	37%	0.37	21%	0.212	S	C	.	.	S	Bend	trans	57.7	-160.7	-174.1	-45.6	-61.9	-162.4	-167.3	3.6	111.5	E629 Q864 S868	E629-R866 IonicContact OE1-CZ 3.93Å; E629-R866 IonicContact OE1-NH1 3.69Å; E629-R866 IonicContact OE1-NH2 3.91Å; E629-R866 PolarHBondContact OE1-NH2 3.04Å; E629-R866 IonicContact OE2-CZ 2.72Å; E629-R866 VanDerWaalsContact OE2-CZ 3.31Å; E629-R866 IonicContact OE2-NH1 2.62Å; E629-R866 PolarHBondContact OE2-NH1 3.46Å; E629-R866 IonicContact OE2-NH2 3.95Å; E629-R866 PolarHBondContact OE2-NH2 3.08Å; E629-R866 VanDerWaalsContact OE2-NH2 3.08Å; Q864-R866 WeakPolarHBondContact CG-O 3.15Å; Q864-R866 PolarHBondContact O-N 3.03Å; R866-S868 PolarHBondContact O-N 2.93Å
867	D	85.9	Confident	88.6	Confident	173 Å²	173	38.8 Å²	38.8	93%	0.925	21%	0.209	S	C	*	.	S	Bend	trans	-74.4	62.8	173.3	-48.5	-57.4	0	0	0	111.1
868	S	90.1	Very high	89.3	Confident	17 Å²	17	38.3 Å²	38.3	12%	0.119	21%	0.205	C	C	.	.	S	Bend	trans	-140.6	168.8	-178.6	84.5	0	0	0	0	113.8	Q864 I865 R866 L870	Q864-S868 WeakPolarHBondContact CG-O 3.31Å; Q864-S868 PolarHBondContact NE2-O 2.97Å; I865-S868 WeakPolarHBondContact O-CB 3.41Å; I865-S868 PolarHBondContact O-OG 2.93Å; R866-S868 PolarHBondContact O-N 2.93Å; S868-L870 PolarHBondContact O-N 2.98Å; S868-L870 PolarHBondContact OG-N 2.91Å
869	V	91.1	Very high	90	Very high	42 Å²	42	38 Å²	38	26%	0.255	20%	0.203	S	C	.	.	S	Bend	trans	-79.5	9.9	175.7	-71.2	0	0	0	0	113.8	F663 H687 C688	F663-V869 HydrophobicContact CB-CG2 4.45Å; F663-V869 HydrophobicContact CD1-CG2 4.13Å; F663-V869 HydrophobicContact CD2-CG2 3.81Å; F663-V869 HydrophobicContact CE1-CG2 4.3Å; F663-V869 HydrophobicContact CE2-CG2 4Å; F663-V869 HydrophobicContact CG-CG2 3.89Å; F663-V869 HydrophobicContact CZ-CG2 4.24Å; H687-V869 VanDerWaalsContact CD2-CG2 3.49Å; H687-V869 WeakPolarHBondContact CD2-CG2 3.41Å; H687-V869 WeakPolarHBondContact NE2-CG2 3.47Å; C688-V869 PolarHBondContact N-O 3.04Å
870	L	93.7	Very high	90.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	137.4	177.7	-65.2	-175.8	0	0	0	111.9	F663 L666 A667 V685 F686 H687 I865 S868	F663-L870 HydrophobicContact CB-CD2 4.09Å; F663-L870 HydrophobicContact CD1-CD1 3.99Å; F663-L870 HydrophobicContact CD1-CD2 4.33Å; F663-L870 HydrophobicContact CD1-CG 3.89Å; L666-L870 HydrophobicContact CD2-CD1 3.72Å; L666-L870 HydrophobicContact CG-CD1 4.04Å; A667-L870 HydrophobicContact CB-CD2 4.01Å; V685-L870 HydrophobicContact CG1-CB 4.35Å; V685-L870 HydrophobicContact CG1-CD2 4.47Å; F686-L870 WeakPolarHBondContact O-CA 3.37Å; H687-L870 HydrophobicContact CB-CD2 4.16Å; I865-L870 HydrophobicContact CB-CB 4.18Å; I865-L870 HydrophobicContact CD1-CB 3.76Å; I865-L870 PolarHBondContact N-O 2.88Å; S868-L870 PolarHBondContact O-N 2.98Å; S868-L870 PolarHBondContact OG-N 2.91Å
871	Y	93.8	Very high	90.4	Very high	18 Å²	18	35.5 Å²	35.5	7%	0.071	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	139.9	177.7	-65.7	-95.3	0	0	0	110.7	V685 F686 C688 P692 T862 Y863 Q864	V685-Y871 CarbonylContact C-O 3.57Å; V685-Y871 VanDerWaalsContact CA-O 3.3Å; V685-Y871 WeakPolarHBondContact CA-O 3.27Å; F686-Y871 WeakPolarHBondContact CD1-O 3.37Å; F686-Y871 HydrophobicContact CE2-CD2 4.42Å; F686-Y871 HydrophobicContact CE2-CG 4.34Å; F686-Y871 HydrophobicContact CZ-CG 4.33Å; F686-Y871 PolarHBondContact N-O 2.9Å; F686-Y871 PolarHBondContact O-N 2.73Å; C688-Y871 HydrophobicContact CB-CD2 4Å; C688-Y871 HydrophobicContact CB-CE2 4.12Å; P692-Y871 HydrophobicContact CG-CD1 4.2Å; P692-Y871 HydrophobicContact CG-CE1 4.26Å; P692-Y871 HydrophobicContact CG-CG 4.38Å; T862-Y871 HydrophobicContact CG2-CD1 4.13Å; T862-Y871 HydrophobicContact CG2-CG 4.45Å; Y863-Y871 CarbonylContact O-C 3.57Å; Y863-Y871 WeakPolarHBondContact O-CA 3.36Å; Q864-Y871 HydrophobicContact CB-CD1 3.9Å; Q864-Y871 HydrophobicContact CB-CE1 3.61Å; Q864-Y871 HydrophobicContact CG-CD1 4.16Å; Q864-Y871 HydrophobicContact CG-CE1 3.66Å
872	A	93.1	Very high	90.3	Very high	3 Å²	3	36.2 Å²	36.2	3%	0.025	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.7	173.6	0	0	0	0	0	110.6	H684 V685 T862 Y863 I865 I874	H684-A872 WeakPolarHBondContact O-CA 3.42Å; V685-A872 HydrophobicContact CG2-CB 4.18Å; T862-A872 WeakPolarHBondContact CA-O 3.37Å; Y863-A872 PolarHBondContact N-O 3.5Å; Y863-A872 PolarHBondContact O-N 2.74Å; I865-A872 HydrophobicContact CD1-CB 4.11Å; I865-A872 HydrophobicContact CG1-CB 4.23Å; A872-I874 HydrophobicContact CB-CD1 4.04Å; A872-I874 HydrophobicContact CB-CG1 4.03Å
873	S	92.3	Very high	90	Very high	11 Å²	11	37 Å²	37	8%	0.077	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	117.3	167.4	-170.7	0	0	0	0	109	H684 G861	H684-S873 WeakPolarHBondContact CE1-CB 3.48Å; H684-S873 PolarHBondContact N-O 3.45Å; H684-S873 WeakPolarHBondContact NE2-CB 3.29Å; H684-S873 PolarHBondContact O-N 3Å; G861-S873 WeakPolarHBondContact O-CA 3.47Å
874	I	92.5	Very high	89.6	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	118.5	-170.8	-57.8	176.6	0	0	0	110.2	L630 L631 H634 Y635 S860 G861 Y863 A872 N876	L630-I874 HydrophobicContact CB-CD1 3.8Å; L631-I874 HydrophobicContact CD2-CD1 4.19Å; L631-I874 HydrophobicContact CD2-CG1 4.3Å; L631-I874 HydrophobicContact CD2-CG2 4.25Å; H634-I874 HydrophobicContact CB-CG2 4.23Å; Y635-I874 HydrophobicContact CD2-CG2 4.06Å; Y635-I874 HydrophobicContact CG-CG2 4.35Å; S860-I874 CarbonylContact C-O 3.57Å; S860-I874 VanDerWaalsContact CA-O 3.24Å; S860-I874 WeakPolarHBondContact CA-O 3.37Å; S860-I874 WeakPolarHBondContact CB-O 3.48Å; G861-I874 PolarHBondContact N-O 3.29Å; G861-I874 PolarHBondContact O-N 3.38Å; Y863-I874 HydrophobicContact CD2-CB 4.17Å; Y863-I874 HydrophobicContact CD2-CD1 4Å; Y863-I874 HydrophobicContact CD2-CG1 4.21Å; Y863-I874 HydrophobicContact CE2-CB 4.06Å; A872-I874 HydrophobicContact CB-CD1 4.04Å; A872-I874 HydrophobicContact CB-CG1 4.03Å; I874-N876 PolarHBondContact O-N 3.1Å
875	P	90.3	Very high	89.2	Confident	1 Å²	1	37 Å²	37	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	118.6	172.6	-23.1	34.8	0	0	0	112	Y635 A636 R682 I683	Y635-P875 VanDerWaalsContact CD2-O 3.29Å; Y635-P875 WeakPolarHBondContact CD2-O 3.39Å; Y635-P875 HydrophobicContact CE2-CB 4.3Å; Y635-P875 HydrophobicContact CE2-CG 4.44Å; A636-P875 PolarHBondContact N-O 3.14Å; R682-P875 HydrophobicContact CB-CG 3.75Å; I683-P875 HydrophobicContact CG1-CG 4.38Å
876	N	89.4	Confident	88.8	Confident	21 Å²	21	44.3 Å²	44.3	11%	0.112	24%	0.244	C	C	.	.			trans	-107.1	6.4	-174.5	62.4	25.8	0	0	0	113.6	H634 R796 S859 G861 I874	H634-N876 WeakPolarHBondContact O-CA 3.47Å; H634-N876 WeakPolarHBondContact O-CB 3.43Å; R796-N876 PolarHBondContact N-O 2.87Å; S859-N876 VanDerWaalsContact CB-OD1 3.31Å; S859-N876 WeakPolarHBondContact CB-OD1 3.32Å; S859-N876 PolarHBondContact O-N 2.85Å; S859-N876 PolarHBondContact O-OD1 2.77Å; S859-N876 PolarHBondContact OG-OD1 3.42Å; G861-N876 PolarHBondContact N-ND2 3.17Å; I874-N876 PolarHBondContact O-N 3.1Å
877	Q	89	Confident	88.6	Confident	50 Å²	50	42.6 Å²	42.6	23%	0.234	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	148.7	173.2	-64.3	-179	23.4	0	0	111.6	I793 Y794 A795 S859	I793-Q877 HydrophobicContact CG2-CB 4.38Å; I793-Q877 HydrophobicContact CG2-CG 4.45Å; Y794-Q877 WeakPolarHBondContact O-CA 3.24Å; A795-Q877 HydrophobicContact CB-CG 3.97Å; S859-Q877 PolarHBondContact OG-NE2 2.95Å
878	I	88.6	Confident	88.5	Confident	16 Å²	16	35.6 Å²	35.6	8%	0.082	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	158.3	168.2	53.3	178.1	0	0	0	110.8	A636 I637 Y794 V887	A636-I878 HydrophobicContact CB-CB 4.35Å; A636-I878 HydrophobicContact CB-CG1 4.21Å; A636-I878 HydrophobicContact CB-CG2 3.65Å; I637-I878 HydrophobicContact CD1-CG2 4.27Å; I637-I878 HydrophobicContact CG1-CD1 4.14Å; I637-I878 HydrophobicContact CG1-CG2 4.16Å; Y794-I878 HydrophobicContact CD1-CD1 4.15Å; Y794-I878 HydrophobicContact CD1-CG1 3.97Å; Y794-I878 HydrophobicContact CG-CG1 4.39Å; Y794-I878 PolarHBondContact N-O 2.98Å; Y794-I878 PolarHBondContact O-N 3.1Å; I878-V887 HydrophobicContact CB-CG1 4.04Å; I878-V887 HydrophobicContact CD1-CG1 4.39Å; I878-V887 HydrophobicContact CD1-CG2 4.02Å; I878-V887 HydrophobicContact CG2-CG1 4.13Å
879	I	88.3	Confident	87.8	Confident	28 Å²	28	38 Å²	38	14%	0.144	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	131.4	-178.8	-47.6	152.1	0	0	0	108.5	Y791 T792 L835 L858 V887 W888	Y791-I879 HydrophobicContact CD2-CG2 4.11Å; Y791-I879 HydrophobicContact CG-CG2 4.05Å; T792-I879 WeakPolarHBondContact O-CA 3.5Å; L835-I879 HydrophobicContact CD1-CD1 4Å; L835-I879 HydrophobicContact CD1-CG2 4.36Å; L858-I879 HydrophobicContact CD1-CD1 3.72Å; L858-I879 HydrophobicContact CD1-CG1 3.73Å; L858-I879 HydrophobicContact CG-CD1 3.98Å; L858-I879 HydrophobicContact CG-CG1 4.4Å; I879-V887 WeakPolarHBondContact O-CA 3.35Å; I879-W888 HydrophobicContact CB-CD2 4.27Å; I879-W888 HydrophobicContact CB-CE3 3.76Å; I879-W888 HydrophobicContact CB-CZ3 4.28Å; I879-W888 HydrophobicContact CD1-CE3 3.71Å; I879-W888 HydrophobicContact CD1-CZ3 3.97Å; I879-W888 HydrophobicContact CG1-CE3 4.37Å; I879-W888 HydrophobicContact CG2-CD2 3.96Å; I879-W888 HydrophobicContact CG2-CE3 3.5Å; I879-W888 VanDerWaalsContact CG2-CE3 3.5Å; I879-W888 HydrophobicContact CG2-CH2 4.1Å; I879-W888 HydrophobicContact CG2-CZ3 3.61Å; I879-W888 PolarHBondContact O-N 3.14Å
880	L	88.5	Confident	87.2	Confident	37 Å²	37	37.9 Å²	37.9	19%	0.194	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	129	174.6	-50.6	177	0	0	0	109.9	T792 L801 K886 V887	T792-L880 PolarHBondContact N-O 3.09Å; T792-L880 PolarHBondContact O-N 2.84Å; L801-L880 HydrophobicContact CD2-CD1 3.93Å; L880-K886 CarbonylContact C-O 3.53Å; L880-K886 WeakPolarHBondContact CA-O 3.21Å; L880-V887 HydrophobicContact CD2-CB 4.41Å; L880-V887 HydrophobicContact CD2-CG2 3.81Å
881	S	86.1	Confident	86.3	Confident	4 Å²	4	43.1 Å²	43.1	3%	0.028	25%	0.245	C	C	.	.			trans	-56.1	133.1	174.2	174.9	0	0	0	0	110.9	D842 T883 T884 G885 K886	D842-S881 WeakPolarHBondContact OD2-CB 3.44Å; D842-S881 PolarHBondContact OD2-OG 2.93Å; S881-T883 VanDerWaalsContact C-N 3.27Å; S881-T883 PolarHBondContact O-N 3.47Å; S881-T883 PolarHBondContact OG-OG1 2.98Å; S881-T884 WeakPolarHBondContact CB-OG1 3.39Å; S881-T884 PolarHBondContact OG-N 2.91Å; S881-T884 PolarHBondContact OG-OG1 3.1Å; S881-G885 WeakPolarHBondContact O-CA 3.24Å; S881-G885 PolarHBondContact O-N 2.8Å; S881-K886 PolarHBondContact N-O 2.78Å
882	P	84.8	Confident	85.8	Confident	28 Å²	28	42.7 Å²	42.7	18%	0.182	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-26.7	-179.1	31.3	-37.6	0	0	0	112.8	H789 L790 L843	H789-P882 HydrophobicContact CB-CB 4.22Å; H789-P882 WeakPolarHBondContact O-CB 3.28Å; H789-P882 WeakPolarHBondContact O-CG 3.41Å; L790-P882 WeakPolarHBondContact O-CD 3.44Å; L790-P882 VanDerWaalsContact O-CG 3.3Å; L790-P882 WeakPolarHBondContact O-CG 3.43Å; L843-P882 HydrophobicContact CD2-CG 4.04Å
883	T	82.4	Confident	85.6	Confident	88 Å²	88	42.7 Å²	42.7	54%	0.54	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-37.3	-175.4	53	0	0	0	0	112.9	L843 S881	L843-T883 HydrophobicContact CD2-CG2 4.37Å; S881-T883 VanDerWaalsContact C-N 3.27Å; S881-T883 PolarHBondContact O-N 3.47Å; S881-T883 PolarHBondContact OG-OG1 2.98Å
884	T	84.9	Confident	85.5	Confident	91 Å²	91	47.7 Å²	47.7	56%	0.558	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-15.8	-176.7	66.7	0	0	0	0	114.5	S881 K886	S881-T884 WeakPolarHBondContact CB-OG1 3.39Å; S881-T884 PolarHBondContact OG-N 2.91Å; S881-T884 PolarHBondContact OG-OG1 3.1Å; T884-K886 PolarHBondContact O-N 3.28Å; T884-K886 VanDerWaalsContact O-N 3.1Å; T884-K886 PolarHBondContact OG1-N 2.9Å
885	G	82.8	Confident	85.6	Confident	51 Å²	51	48.4 Å²	48.4	53%	0.526	27%	0.273	S	S	.	.			trans	68.3	-2.2	-174.7	0	0	0	0	0	115.2	S881	S881-G885 WeakPolarHBondContact O-CA 3.24Å; S881-G885 PolarHBondContact O-N 2.8Å
886	K	86.8	Confident	85.7	Confident	153 Å²	153	53 Å²	53	67%	0.665	29%	0.294	S	S	*	.	S	Bend	trans	-82	157	178.8	-65.5	-174.9	177.1	-175.4	0	111.6	L880 S881 T884	L880-K886 CarbonylContact C-O 3.53Å; L880-K886 WeakPolarHBondContact CA-O 3.21Å; S881-K886 PolarHBondContact N-O 2.78Å; T884-K886 PolarHBondContact O-N 3.28Å; T884-K886 VanDerWaalsContact O-N 3.1Å; T884-K886 PolarHBondContact OG1-N 2.9Å
887	V	85.6	Confident	85.8	Confident	61 Å²	61	53.2 Å²	53.2	37%	0.37	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-59.8	135.5	167.5	-167.7	0	0	0	0	109.4	I878 I879 L880 F890	I878-V887 HydrophobicContact CB-CG1 4.04Å; I878-V887 HydrophobicContact CD1-CG1 4.39Å; I878-V887 HydrophobicContact CD1-CG2 4.02Å; I878-V887 HydrophobicContact CG2-CG1 4.13Å; I879-V887 WeakPolarHBondContact O-CA 3.35Å; L880-V887 HydrophobicContact CD2-CB 4.41Å; L880-V887 HydrophobicContact CD2-CG2 3.81Å; V887-F890 HydrophobicContact CG1-CE1 4.02Å; V887-F890 HydrophobicContact CG1-CZ 4.22Å
888	W	83.8	Confident	86.1	Confident	26 Å²	26	55.3 Å²	55.3	10%	0.098	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-69.2	151.1	171.1	-77.4	-20.1	0	0	0	111.9	Y791 L835 R838 A839 D842 I879	Y791-W888 HydrophobicContact CD1-CH2 4.16Å; Y791-W888 HydrophobicContact CG-CH2 4.38Å; L835-W888 HydrophobicContact CD1-CH2 4.02Å; L835-W888 HydrophobicContact CD1-CZ3 3.55Å; R838-W888 HydrophobicContact CB-CE3 4.22Å; R838-W888 HydrophobicContact CB-CH2 3.74Å; R838-W888 HydrophobicContact CB-CZ2 4.1Å; R838-W888 HydrophobicContact CB-CZ3 3.77Å; R838-W888 HydrophobicContact CG-CD2 3.65Å; R838-W888 VanDerWaalsContact CG-CE2 3.48Å; R838-W888 HydrophobicContact CG-CE3 3.75Å; R838-W888 HydrophobicContact CG-CG 4.34Å; R838-W888 HydrophobicContact CG-CH2 3.66Å; R838-W888 HydrophobicContact CG-CZ2 3.53Å; R838-W888 HydrophobicContact CG-CZ3 3.73Å; A839-W888 HydrophobicContact CB-CH2 4.37Å; D842-W888 PolarHBondContact OD2-NE1 3.36Å; I879-W888 HydrophobicContact CB-CD2 4.27Å; I879-W888 HydrophobicContact CB-CE3 3.76Å; I879-W888 HydrophobicContact CB-CZ3 4.28Å; I879-W888 HydrophobicContact CD1-CE3 3.71Å; I879-W888 HydrophobicContact CD1-CZ3 3.97Å; I879-W888 HydrophobicContact CG1-CE3 4.37Å; I879-W888 HydrophobicContact CG2-CD2 3.96Å; I879-W888 HydrophobicContact CG2-CE3 3.5Å; I879-W888 VanDerWaalsContact CG2-CE3 3.5Å; I879-W888 HydrophobicContact CG2-CH2 4.1Å; I879-W888 HydrophobicContact CG2-CZ3 3.61Å; I879-W888 PolarHBondContact O-N 3.14Å
889	S	76.3	Confident	86.3	Confident	69 Å²	69	55.6 Å²	55.6	48%	0.483	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-61.5	147.3	177.9	-172	0	0	0	0	112.2	L891	S889-L891 VanDerWaalsContact C-N 3.28Å; S889-L891 PolarHBondContact OG-N 3.4Å; S889-L891 VanDerWaalsContact OG-N 3.16Å
890	F	77.4	Confident	86.4	Confident	39 Å²	39	60.1 Å²	60.1	17%	0.171	34%	0.339	C	S	.	.	S	Bend	trans	-85.2	-3.8	171.4	-42	-42.2	0	0	0	112.4	I637 D680 R682 G855 V887 G892	I637-F890 HydrophobicContact CD1-CE2 4.42Å; I637-F890 HydrophobicContact CD1-CZ 3.75Å; D680-F890 HydrophobicContact CB-CD2 3.74Å; D680-F890 HydrophobicContact CB-CE2 4.04Å; D680-F890 HydrophobicContact CB-CG 4.48Å; R682-F890 VanDerWaalsContact NH2-CD1 3.26Å; G855-F890 WeakPolarHBondContact CA-O 3.41Å; V887-F890 HydrophobicContact CG1-CE1 4.02Å; V887-F890 HydrophobicContact CG1-CZ 4.22Å; F890-G892 PolarHBondContact O-N 2.93Å
891	L	75.9	Confident	86.4	Confident	109 Å²	109	59.7 Å²	59.7	57%	0.571	34%	0.338	S	S	*	.	S	Bend	trans	-84.9	17.3	175	-53.5	175.9	0	0	0	113.3	S889	S889-L891 VanDerWaalsContact C-N 3.28Å; S889-L891 PolarHBondContact OG-N 3.4Å; S889-L891 VanDerWaalsContact OG-N 3.16Å
892	G	83.6	Confident	86.5	Confident	10 Å²	10	64.7 Å²	64.7	10%	0.103	37%	0.368	C	S	.	.			trans	76.2	-150.7	177.6	0	0	0	0	0	115.3	T853 F890	T853-G892 WeakPolarHBondContact OG1-CA 3.47Å; F890-G892 PolarHBondContact O-N 2.93Å
893	V	87.8	Confident	86.9	Confident	3 Å²	3	68 Å²	68	2%	0.018	38%	0.382	C	S	.	.			trans	-110.3	108.4	-177.9	-172.1	0	0	0	0	109.1	E834 R838 V848 T853	E834-V893 HydrophobicContact CB-CG2 4.1Å; R838-V893 HydrophobicContact CB-CG2 3.81Å; R838-V893 HydrophobicContact CG-CG2 4.39Å; V848-V893 HydrophobicContact CG1-CG1 4.45Å; T853-V893 HydrophobicContact CG2-CB 4.01Å; T853-V893 PolarHBondContact N-O 2.69Å; T853-V893 PolarHBondContact OG1-N 3.12Å
894	E	91.6	Very high	87.4	Confident	115 Å²	115	63.9 Å²	63.9	54%	0.537	36%	0.356	S	S	.	.			trans	-64.9	129.7	167.6	-71	-61.8	157.4	0	0	110.5
895	P	92.9	Very high	87.8	Confident	16 Å²	16	61.5 Å²	61.5	10%	0.104	34%	0.34	C	S	.	.			trans	-73.6	147.7	176.1	31.1	-34.5	0	0	0	110.9	V848 G850 V897	V848-P895 HydrophobicContact CG1-CB 4.26Å; G850-P895 WeakPolarHBondContact O-CG 3.33Å; P895-V897 PolarHBondContact O-N 2.89Å
896	H	92.9	Very high	88.3	Confident	97 Å²	97	62 Å²	62	45%	0.449	34%	0.335	S	S	.	.	S	Bend	trans	-68	-27.5	172	-61.4	71.4	0	0	0	111.6	S841 T847 V848	S841-H896 PolarHBondContact OG-CE1 2.8Å; T847-H896 HydrophobicContact CG2-CB 4.2Å; V848-H896 PolarHBondContact N-ND1 2.86Å; V848-H896 VanDerWaalsContact N-ND1 3.17Å; V848-H896 WeakPolarHBondContact O-CB 3.49Å; V848-H896 PolarHBondContact O-N 2.9Å
897	V	92.4	Very high	88.6	Confident	27 Å²	27	56.4 Å²	56.4	16%	0.164	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	103.1	174	-175.5	0	0	0	0	108.4	V848 I849 G850 P895 V907 I911 V959	V848-V897 PolarHBondContact O-N 2.9Å; I849-V897 WeakPolarHBondContact CA-O 3.48Å; I849-V897 HydrophobicContact CG1-CB 4.13Å; I849-V897 HydrophobicContact CG1-CG2 4.42Å; I849-V897 HydrophobicContact CG2-CB 4.24Å; G850-V897 PolarHBondContact N-O 2.76Å; P895-V897 PolarHBondContact O-N 2.89Å; V897-V907 HydrophobicContact CG1-CG1 3.88Å; V897-I911 HydrophobicContact CG2-CD1 4.03Å; V897-V959 HydrophobicContact CG2-CB 3.95Å; V897-V959 HydrophobicContact CG2-CG1 3.58Å
898	S	94.5	Very high	89	Confident	94 Å²	94	53.5 Å²	53.5	66%	0.657	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	127.4	175.8	-171.7	0	0	0	0	110.7	G850	G850-S898 CarbonylContact O-C 3.6Å; G850-S898 VanDerWaalsContact O-CA 3.31Å; G850-S898 WeakPolarHBondContact O-CA 3.35Å
899	T	93.1	Very high	89.4	Confident	22 Å²	22	55.1 Å²	55.1	14%	0.135	31%	0.305	C	S	.	.			trans	-163.7	155.3	-177.2	178.2	0	0	0	0	109.8	I849 G850 E903 A904 V907	I849-T899 HydrophobicContact CG2-CG2 3.61Å; G850-T899 CarbonylContact C-O 3.03Å; G850-T899 WeakPolarHBondContact CA-O 3.44Å; G850-T899 PolarHBondContact O-N 3.49Å; G850-T899 VanDerWaalsContact O-O 3.05Å; T899-E903 WeakPolarHBondContact OG1-CB 3.31Å; T899-A904 HydrophobicContact CG2-CB 4.01Å; T899-V907 HydrophobicContact CG2-CB 4.39Å; T899-V907 HydrophobicContact CG2-CG1 4.48Å; T899-V907 HydrophobicContact CG2-CG2 4.23Å
900	Q	90.9	Very high	90.2	Very high	123 Å²	123	56.4 Å²	56.4	58%	0.575	31%	0.31	S	S	*	.			trans	-60.5	144.7	-179.8	-63.3	-172.5	4.1	0	0	111.3	T902 E903 A904	Q900-T902 PolarHBondContact O-N 2.9Å; Q900-E903 HydrophobicContact CB-CG 4.48Å; Q900-E903 PolarHBondContact O-N 3.03Å; Q900-A904 PolarHBondContact O-N 3.06Å; Q900-A904 VanDerWaalsContact O-N 3.09Å
901	V	87.5	Confident	90.9	Very high	28 Å²	28	54.7 Å²	54.7	17%	0.17	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-31.4	178.6	148.6	0	0	0	0	113.6	R764 E851	R764-V901 HydrophobicContact CG-CG2 4.48Å; R764-V901 PolarHBondContact NH1-O 2.88Å; E851-V901 HydrophobicContact CG-CG2 4.13Å; E851-V901 WeakPolarHBondContact OE1-CB 3.42Å; E851-V901 WeakPolarHBondContact OE1-CG2 3.49Å; E851-V901 PolarHBondContact OE1-N 3.22Å; E851-V901 WeakPolarHBondContact OE2-CG2 3.4Å
902	T	89.2	Confident	91.6	Very high	108 Å²	108	50 Å²	50	66%	0.663	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-37.4	174.4	41.2	0	0	0	0	113.6	Q900	Q900-T902 PolarHBondContact O-N 2.9Å
903	E	92.9	Very high	91.9	Very high	99 Å²	99	53.1 Å²	53.1	46%	0.463	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-22.8	-172.2	-63.5	-174.4	154.2	0	0	113.5	T899 Q900 L905 S906 V907	T899-E903 WeakPolarHBondContact OG1-CB 3.31Å; Q900-E903 HydrophobicContact CB-CG 4.48Å; Q900-E903 PolarHBondContact O-N 3.03Å; E903-L905 PolarHBondContact O-N 3.34Å; E903-S906 PolarHBondContact O-N 3.04Å; E903-S906 PolarHBondContact O-OG 3.01Å; E903-V907 HydrophobicContact CB-CG2 4.46Å; E903-V907 PolarHBondContact O-N 3.08Å
904	A	92.3	Very high	92	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-48.8	-37.7	-174.6	0	0	0	0	0	114.7	L824 I849 T899 Q900 A908	L824-A904 HydrophobicContact CD2-CB 4.35Å; I849-A904 HydrophobicContact CG2-CB 4.26Å; T899-A904 HydrophobicContact CG2-CB 4.01Å; Q900-A904 PolarHBondContact O-N 3.06Å; Q900-A904 VanDerWaalsContact O-N 3.09Å; A904-A908 VanDerWaalsContact O-CB 3.31Å; A904-A908 WeakPolarHBondContact O-CB 3.38Å; A904-A908 PolarHBondContact O-N 3.34Å
905	L	94.3	Very high	92	Very high	41 Å²	41	50 Å²	50	22%	0.215	28%	0.277	C	S	.	.	H	α-helix	trans	-70	-40.8	178	179.6	60.6	0	0	0	112.8	Y726 I760 L824 E903 Q909	Y726-L905 HydrophobicContact CD2-CD1 3.97Å; Y726-L905 HydrophobicContact CE2-CD1 4.08Å; Y726-L905 HydrophobicContact CE2-CD2 4.4Å; I760-L905 HydrophobicContact CD1-CD1 3.85Å; I760-L905 HydrophobicContact CG2-CD1 4.2Å; L824-L905 HydrophobicContact CD1-CB 4.03Å; L824-L905 HydrophobicContact CD1-CD1 4.05Å; E903-L905 PolarHBondContact O-N 3.34Å; L905-Q909 VanDerWaalsContact O-CG 3.31Å; L905-Q909 WeakPolarHBondContact O-CG 3.4Å; L905-Q909 PolarHBondContact O-N 2.93Å
906	S	93.3	Very high	91.8	Very high	62 Å²	62	53 Å²	53	43%	0.434	30%	0.303	S	S	.	.	H	α-helix	trans	-69.2	-36.8	174.6	26.6	0	0	0	0	112.3	E903 Q909 T910	E903-S906 PolarHBondContact O-N 3.04Å; E903-S906 PolarHBondContact O-OG 3.01Å; S906-Q909 PolarHBondContact O-N 3.5Å; S906-T910 WeakPolarHBondContact O-CB 3.34Å; S906-T910 PolarHBondContact O-N 3.17Å; S906-T910 PolarHBondContact O-OG1 2.65Å
907	V	92.8	Very high	91.6	Very high	36 Å²	36	53.3 Å²	53.3	22%	0.218	31%	0.305	C	S	.	.	H	α-helix	trans	-63.7	-46.5	174.2	173.7	0	0	0	0	110.2	I849 V897 T899 E903 Q909 T910 I911	I849-V907 HydrophobicContact CG2-CB 4.33Å; I849-V907 HydrophobicContact CG2-CG1 3.99Å; V897-V907 HydrophobicContact CG1-CG1 3.88Å; T899-V907 HydrophobicContact CG2-CB 4.39Å; T899-V907 HydrophobicContact CG2-CG1 4.48Å; T899-V907 HydrophobicContact CG2-CG2 4.23Å; E903-V907 HydrophobicContact CB-CG2 4.46Å; E903-V907 PolarHBondContact O-N 3.08Å; V907-Q909 PolarHBondContact O-N 3.07Å; V907-T910 PolarHBondContact O-N 3.08Å; V907-I911 HydrophobicContact CG1-CD1 3.83Å; V907-I911 WeakPolarHBondContact O-CG1 3.18Å; V907-I911 PolarHBondContact O-N 3.3Å
908	A	94.1	Very high	91.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.4	-46.5	174.5	0	0	0	0	0	113.2	I760 V822 L824 I849 A904 T910 I911 I912	I760-A908 HydrophobicContact CD1-CB 3.97Å; I760-A908 HydrophobicContact CG1-CB 4.46Å; V822-A908 HydrophobicContact CG1-CB 3.76Å; L824-A908 HydrophobicContact CD2-CB 3.82Å; I849-A908 HydrophobicContact CD1-CB 4.14Å; A904-A908 VanDerWaalsContact O-CB 3.31Å; A904-A908 WeakPolarHBondContact O-CB 3.38Å; A904-A908 PolarHBondContact O-N 3.34Å; A908-T910 VanDerWaalsContact C-N 3.33Å; A908-T910 PolarHBondContact O-N 2.56Å; A908-I911 PolarHBondContact O-N 3.15Å; A908-I912 WeakPolarHBondContact O-CG1 3.45Å; A908-I912 PolarHBondContact O-N 3.19Å
909	Q	92.6	Very high	91.5	Very high	60 Å²	60	50.9 Å²	50.9	28%	0.28	29%	0.287	S	S	.	.	H	α-helix	trans	-60.6	-41.9	175.1	-72.6	171.6	10.4	0	0	111.9	I760 L905 S906 V907 N913	I760-Q909 HydrophobicContact CD1-CG 4.17Å; L905-Q909 VanDerWaalsContact O-CG 3.31Å; L905-Q909 WeakPolarHBondContact O-CG 3.4Å; L905-Q909 PolarHBondContact O-N 2.93Å; S906-Q909 PolarHBondContact O-N 3.5Å; V907-Q909 PolarHBondContact O-N 3.07Å; Q909-N913 VanDerWaalsContact O-CB 3.26Å; Q909-N913 WeakPolarHBondContact O-CB 3.3Å; Q909-N913 PolarHBondContact O-N 2.84Å; Q909-N913 PolarHBondContact O-ND2 2.95Å
910	T	91.7	Very high	91.4	Very high	95 Å²	95	53 Å²	53	58%	0.583	30%	0.303	S	S	*	.	H	α-helix	trans	-62.9	-42.1	177.6	-57.7	0	0	0	0	111.6	S906 V907 A908 L914	S906-T910 WeakPolarHBondContact O-CB 3.34Å; S906-T910 PolarHBondContact O-N 3.17Å; S906-T910 PolarHBondContact O-OG1 2.65Å; V907-T910 PolarHBondContact O-N 3.08Å; A908-T910 VanDerWaalsContact C-N 3.33Å; A908-T910 PolarHBondContact O-N 2.56Å; T910-L914 WeakPolarHBondContact O-CB 3.42Å; T910-L914 PolarHBondContact O-N 3.04Å
911	I	92.2	Very high	91.6	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-65.4	-48.6	178	-74.6	167.3	0	0	0	111.5	I849 V897 V907 A908 N913 L914 R915 V959	I849-I911 HydrophobicContact CD1-CD1 3.62Å; V897-I911 HydrophobicContact CG2-CD1 4.03Å; V907-I911 HydrophobicContact CG1-CD1 3.83Å; V907-I911 WeakPolarHBondContact O-CG1 3.18Å; V907-I911 PolarHBondContact O-N 3.3Å; A908-I911 PolarHBondContact O-N 3.15Å; I911-N913 VanDerWaalsContact C-N 3.35Å; I911-N913 PolarHBondContact O-N 2.79Å; I911-L914 PolarHBondContact O-N 3.35Å; I911-R915 HydrophobicContact CG2-CG 4.47Å; I911-R915 VanDerWaalsContact CG2-NE 3.32Å; I911-R915 WeakPolarHBondContact O-CG 3.43Å; I911-R915 PolarHBondContact O-N 2.81Å; I911-V959 HydrophobicContact CD1-CB 4.09Å; I911-V959 HydrophobicContact CD1-CG1 4.28Å; I911-V959 HydrophobicContact CG1-CB 4.42Å; I911-V959 VanDerWaalsContact CG1-O 3.25Å; I911-V959 WeakPolarHBondContact CG1-O 3.35Å
912	I	91.8	Very high	91.9	Very high	10 Å²	10	46.2 Å²	46.2	5%	0.051	27%	0.269	C	S	.	.	H	α-helix	trans	-61.2	-44.8	178	-67.7	164.4	0	0	0	110.5	I724 A758 I760 V822 A908 L914 R915 A916	I724-I912 HydrophobicContact CD1-CB 4.15Å; I724-I912 HydrophobicContact CD1-CG2 3.58Å; I724-I912 HydrophobicContact CG1-CG2 3.92Å; I724-I912 HydrophobicContact CG2-CD1 3.96Å; A758-I912 HydrophobicContact CB-CD1 4.08Å; A758-I912 HydrophobicContact CB-CG1 4.26Å; A758-I912 HydrophobicContact CB-CG2 3.53Å; I760-I912 HydrophobicContact CD1-CD1 3.96Å; I760-I912 HydrophobicContact CG1-CD1 3.66Å; V822-I912 HydrophobicContact CG2-CD1 3.91Å; V822-I912 HydrophobicContact CG2-CG1 4.02Å; A908-I912 WeakPolarHBondContact O-CG1 3.45Å; A908-I912 PolarHBondContact O-N 3.19Å; I912-L914 VanDerWaalsContact C-N 3.3Å; I912-L914 PolarHBondContact O-N 2.97Å; I912-R915 PolarHBondContact O-N 2.89Å; I912-A916 WeakPolarHBondContact O-CB 3.37Å; I912-A916 PolarHBondContact O-N 2.92Å
913	N	89.9	Confident	92.2	Very high	76 Å²	76	44.3 Å²	44.3	41%	0.406	25%	0.253	S	S	.	.	H	α-helix	trans	-65	-31.6	178	-73.3	-32.5	0	0	0	112.9	Q909 I911 Q917	Q909-N913 VanDerWaalsContact O-CB 3.26Å; Q909-N913 WeakPolarHBondContact O-CB 3.3Å; Q909-N913 PolarHBondContact O-N 2.84Å; Q909-N913 PolarHBondContact O-ND2 2.95Å; I911-N913 VanDerWaalsContact C-N 3.35Å; I911-N913 PolarHBondContact O-N 2.79Å; N913-Q917 PolarHBondContact O-NE2 3.1Å
914	L	89.9	Confident	92.3	Very high	26 Å²	26	42.1 Å²	42.1	14%	0.136	24%	0.243	C	C	.	.	H	α-helix	trans	-70.6	-49.1	171.6	175.1	62.5	0	0	0	111.2	T910 I911 I912 A916 Q917 V918 V958 L964	T910-L914 WeakPolarHBondContact O-CB 3.42Å; T910-L914 PolarHBondContact O-N 3.04Å; I911-L914 PolarHBondContact O-N 3.35Å; I912-L914 VanDerWaalsContact C-N 3.3Å; I912-L914 PolarHBondContact O-N 2.97Å; L914-A916 PolarHBondContact O-N 3.41Å; L914-Q917 WeakPolarHBondContact O-CB 3.47Å; L914-Q917 PolarHBondContact O-N 3.18Å; L914-V918 PolarHBondContact O-N 3.17Å; L914-V958 HydrophobicContact CD2-CG1 3.8Å; L914-V958 HydrophobicContact CG-CG1 4.34Å; L914-L964 HydrophobicContact CD1-CD2 4.35Å
915	R	89.9	Confident	92.5	Very high	26 Å²	26	42.1 Å²	42.1	10%	0.098	24%	0.243	C	C	.	.	H	α-helix	trans	-58.7	-35.6	179.3	-72.6	170.1	179.7	-179.5	-2	112.3	D820 T847 I911 I912 Q917 V918 P919 S956 V958	D820-R915 VanDerWaalsContact CG-NH1 3.3Å; D820-R915 IonicContact OD1-NH1 2.66Å; D820-R915 PolarHBondContact OD1-NH1 2.86Å; D820-R915 WeakPolarHBondContact OD2-CD 3.28Å; D820-R915 IonicContact OD2-CZ 2.76Å; D820-R915 IonicContact OD2-NE 3.4Å; D820-R915 IonicContact OD2-NH1 3.24Å; D820-R915 PolarHBondContact OD2-NH1 3.04Å; T847-R915 PolarHBondContact OG1-NH1 2.87Å; T847-R915 PolarHBondContact OG1-NH2 3.01Å; I911-R915 HydrophobicContact CG2-CG 4.47Å; I911-R915 VanDerWaalsContact CG2-NE 3.32Å; I911-R915 WeakPolarHBondContact O-CG 3.43Å; I911-R915 PolarHBondContact O-N 2.81Å; I912-R915 PolarHBondContact O-N 2.89Å; R915-Q917 PolarHBondContact O-N 3Å; R915-V918 PolarHBondContact O-N 3.3Å; R915-P919 WeakPolarHBondContact O-CD 3.29Å; R915-S956 PolarHBondContact NE-O 3.44Å; R915-S956 PolarHBondContact NH2-O 2.84Å; R915-V958 PolarHBondContact NE-O 3.11Å; R915-V958 PolarHBondContact NH2-O 3.41Å
916	A	88.8	Confident	92.5	Very high	78 Å²	78	40.1 Å²	40.1	65%	0.645	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.1	173.1	0	0	0	0	0	114.1	I912 L914	I912-A916 WeakPolarHBondContact O-CB 3.37Å; I912-A916 PolarHBondContact O-N 2.92Å; L914-A916 PolarHBondContact O-N 3.41Å
917	Q	89.8	Confident	92.6	Very high	105 Å²	105	40.9 Å²	40.9	49%	0.491	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-23.1	177.6	-67.1	166.8	71.8	0	0	113.2	N913 L914 R915 S920 I921	N913-Q917 PolarHBondContact O-NE2 3.1Å; L914-Q917 WeakPolarHBondContact O-CB 3.47Å; L914-Q917 PolarHBondContact O-N 3.18Å; R915-Q917 PolarHBondContact O-N 3Å; Q917-S920 PolarHBondContact O-N 3.17Å; Q917-I921 HydrophobicContact CB-CD1 4.08Å; Q917-I921 WeakPolarHBondContact O-CG1 3.48Å; Q917-I921 PolarHBondContact O-N 3Å; Q917-I921 VanDerWaalsContact O-N 3.15Å
918	V	91.8	Very high	92.7	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.03	23%	0.228	C	C	.	.	H	α-helix	trans	-51.2	-44.7	-177.1	170.7	0	0	0	0	113.2	L914 R915 S920 I921 I922 L950 F955 L964	L914-V918 PolarHBondContact O-N 3.17Å; R915-V918 PolarHBondContact O-N 3.3Å; V918-S920 VanDerWaalsContact C-N 3.3Å; V918-S920 PolarHBondContact O-N 2.99Å; V918-I921 PolarHBondContact O-N 2.93Å; V918-I922 HydrophobicContact CG1-CG1 3.89Å; V918-I922 WeakPolarHBondContact O-CB 3.34Å; V918-I922 VanDerWaalsContact O-CG1 3.32Å; V918-I922 WeakPolarHBondContact O-CG1 3.22Å; V918-I922 PolarHBondContact O-N 2.76Å; V918-L950 HydrophobicContact CG1-CD1 4.16Å; V918-F955 HydrophobicContact CG1-CB 3.69Å; V918-F955 HydrophobicContact CG1-CG 4.08Å; V918-L964 HydrophobicContact CG1-CD1 4.25Å; V918-L964 HydrophobicContact CG2-CD1 4.05Å; V918-L964 HydrophobicContact CG2-CD2 3.95Å
919	P	91.9	Very high	92.7	Very high	65 Å²	65	40.7 Å²	40.7	42%	0.422	23%	0.228	S	C	.	.	H	α-helix	trans	-58.1	-37.7	178.7	-26.9	35.7	0	0	0	114.2	R915 E923 L950	R915-P919 WeakPolarHBondContact O-CD 3.29Å; P919-E923 WeakPolarHBondContact O-CB 3.22Å; P919-E923 PolarHBondContact O-N 3.49Å; P919-L950 HydrophobicContact CB-CD2 4.2Å; P919-L950 HydrophobicContact CG-CD1 4.41Å
920	S	92.6	Very high	92.8	Very high	67 Å²	67	39.1 Å²	39.1	47%	0.469	23%	0.226	S	C	.	.	H	α-helix	trans	-70.2	-47.1	177	-150.2	0	0	0	0	110.7	Q917 V918 I922 E923 E924	Q917-S920 PolarHBondContact O-N 3.17Å; V918-S920 VanDerWaalsContact C-N 3.3Å; V918-S920 PolarHBondContact O-N 2.99Å; S920-I922 VanDerWaalsContact C-N 3.28Å; S920-I922 PolarHBondContact O-N 2.86Å; S920-E923 PolarHBondContact O-N 3.45Å; S920-E924 WeakPolarHBondContact CB-OE1 3.47Å; S920-E924 VanDerWaalsContact O-CB 3.28Å; S920-E924 WeakPolarHBondContact O-CB 3.44Å; S920-E924 WeakPolarHBondContact O-CG 3.29Å; S920-E924 PolarHBondContact O-N 2.94Å; S920-E924 PolarHBondContact OG-OE1 2.91Å
921	I	94	Very high	92.8	Very high	7 Å²	7	39 Å²	39	4%	0.036	22%	0.222	C	C	.	.	H	α-helix	trans	-56.5	-42.8	178.1	-66.4	166.8	0	0	0	111.2	Q917 V918 S925 L964 V1158 I1163	Q917-I921 HydrophobicContact CB-CD1 4.08Å; Q917-I921 WeakPolarHBondContact O-CG1 3.48Å; Q917-I921 PolarHBondContact O-N 3Å; Q917-I921 VanDerWaalsContact O-N 3.15Å; V918-I921 PolarHBondContact O-N 2.93Å; I921-S925 VanDerWaalsContact O-CB 3.27Å; I921-S925 WeakPolarHBondContact O-CB 3.27Å; I921-S925 PolarHBondContact O-N 3.05Å; I921-S925 PolarHBondContact O-OG 3.43Å; I921-L964 HydrophobicContact CD1-CD2 3.85Å; I921-L964 HydrophobicContact CG2-CD2 4.27Å; I921-V1158 HydrophobicContact CG2-CG1 4.14Å; I921-V1158 WeakPolarHBondContact O-CG1 3.36Å; I921-I1163 HydrophobicContact CD1-CD1 4.01Å; I921-I1163 HydrophobicContact CG1-CD1 4.43Å; I921-I1163 HydrophobicContact CG2-CD1 3.6Å
922	I	94.8	Very high	92.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-72.5	-42.6	-179.8	-66.2	-61.8	0	0	0	111.9	V918 S920 S925 A926 L946 L950 F955 L968	V918-I922 HydrophobicContact CG1-CG1 3.89Å; V918-I922 WeakPolarHBondContact O-CB 3.34Å; V918-I922 VanDerWaalsContact O-CG1 3.32Å; V918-I922 WeakPolarHBondContact O-CG1 3.22Å; V918-I922 PolarHBondContact O-N 2.76Å; S920-I922 VanDerWaalsContact C-N 3.28Å; S920-I922 PolarHBondContact O-N 2.86Å; I922-S925 WeakPolarHBondContact O-CB 3.31Å; I922-S925 PolarHBondContact O-N 2.91Å; I922-A926 WeakPolarHBondContact O-CB 3.48Å; I922-A926 PolarHBondContact O-N 2.93Å; I922-L946 HydrophobicContact CG2-CD2 4.01Å; I922-L946 HydrophobicContact CG2-CG 3.84Å; I922-L950 HydrophobicContact CB-CD2 4.2Å; I922-L950 HydrophobicContact CG1-CD1 4.45Å; I922-L950 HydrophobicContact CG2-CB 4.09Å; I922-L950 HydrophobicContact CG2-CD2 4.03Å; I922-L950 HydrophobicContact CG2-CG 4.5Å; I922-F955 HydrophobicContact CD1-CD1 4.31Å; I922-F955 HydrophobicContact CD1-CE1 3.76Å; I922-F955 HydrophobicContact CD1-CE2 3.99Å; I922-F955 HydrophobicContact CD1-CZ 3.59Å; I922-F955 HydrophobicContact CG1-CD2 4.44Å; I922-F955 HydrophobicContact CG1-CE2 4.26Å; I922-F955 HydrophobicContact CG1-CZ 4.35Å; I922-L968 HydrophobicContact CD1-CD1 3.87Å
923	E	94.8	Very high	92.9	Very high	68 Å²	68	40.1 Å²	40.1	32%	0.318	23%	0.227	S	C	.	.	H	α-helix	trans	-65.7	-43.9	176.5	-178	57.3	-144.8	0	0	111.8	P919 S920 S925 A926 I927 R947	P919-E923 WeakPolarHBondContact O-CB 3.22Å; P919-E923 PolarHBondContact O-N 3.49Å; S920-E923 PolarHBondContact O-N 3.45Å; E923-S925 VanDerWaalsContact C-N 3.32Å; E923-S925 PolarHBondContact O-N 3.46Å; E923-A926 WeakPolarHBondContact O-CB 3.47Å; E923-A926 PolarHBondContact O-N 3.26Å; E923-I927 HydrophobicContact CG-CD1 3.95Å; E923-I927 WeakPolarHBondContact O-CB 3.46Å; E923-I927 VanDerWaalsContact O-CG1 3.27Å; E923-I927 WeakPolarHBondContact O-CG1 3.4Å; E923-I927 PolarHBondContact O-N 2.67Å; E923-R947 IonicContact OE1-CZ 2.73Å; E923-R947 IonicContact OE1-NE 3.73Å; E923-R947 PolarHBondContact OE1-NE 3.06Å; E923-R947 IonicContact OE1-NH2 3.39Å; E923-R947 PolarHBondContact OE1-NH2 3.21Å; E923-R947 IonicContact OE2-CZ 3.63Å; E923-R947 IonicContact OE2-NE 3.82Å; E923-R947 PolarHBondContact OE2-NE 3.02Å; E923-R947 IonicContact OE2-NH2 3.32Å
924	E	95.4	Very high	92.8	Very high	53 Å²	53	36.7 Å²	36.7	25%	0.248	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-41.3	174.8	-71.3	162	-141.2	0	0	111.5	S920 I927 L928 V1158 G1159	S920-E924 WeakPolarHBondContact CB-OE1 3.47Å; S920-E924 VanDerWaalsContact O-CB 3.28Å; S920-E924 WeakPolarHBondContact O-CB 3.44Å; S920-E924 WeakPolarHBondContact O-CG 3.29Å; S920-E924 PolarHBondContact O-N 2.94Å; S920-E924 PolarHBondContact OG-OE1 2.91Å; E924-I927 PolarHBondContact O-N 2.88Å; E924-L928 WeakPolarHBondContact O-CB 3.31Å; E924-L928 VanDerWaalsContact O-CG 3.3Å; E924-L928 WeakPolarHBondContact O-CG 3.33Å; E924-L928 PolarHBondContact O-N 3.18Å; E924-V1158 HydrophobicContact CB-CG1 3.69Å; E924-G1159 WeakPolarHBondContact OE2-CA 3.36Å; E924-G1159 PolarHBondContact OE2-N 2.97Å
925	S	95.6	Very high	92.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.7	-48.5	173.1	-63	0	0	0	0	111.4	I921 I922 E923 I927 L928 I929	I921-S925 VanDerWaalsContact O-CB 3.27Å; I921-S925 WeakPolarHBondContact O-CB 3.27Å; I921-S925 PolarHBondContact O-N 3.05Å; I921-S925 PolarHBondContact O-OG 3.43Å; I922-S925 WeakPolarHBondContact O-CB 3.31Å; I922-S925 PolarHBondContact O-N 2.91Å; E923-S925 VanDerWaalsContact C-N 3.32Å; E923-S925 PolarHBondContact O-N 3.46Å; S925-I927 VanDerWaalsContact C-N 3.32Å; S925-I927 PolarHBondContact O-N 2.96Å; S925-L928 PolarHBondContact O-N 3.28Å; S925-I929 VanDerWaalsContact O-CD1 3.31Å; S925-I929 WeakPolarHBondContact O-CD1 3.46Å; S925-I929 WeakPolarHBondContact O-CG1 3.48Å; S925-I929 PolarHBondContact O-N 3.34Å
926	A	95.4	Very high	92.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.9	-40.5	177.6	0	0	0	0	0	112.2	I922 E923 A930 A943 L946	I922-A926 WeakPolarHBondContact O-CB 3.48Å; I922-A926 PolarHBondContact O-N 2.93Å; E923-A926 WeakPolarHBondContact O-CB 3.47Å; E923-A926 PolarHBondContact O-N 3.26Å; A926-A930 WeakPolarHBondContact O-CB 3.46Å; A926-A930 PolarHBondContact O-N 2.67Å; A926-A943 HydrophobicContact CB-CB 3.88Å; A926-A943 VanDerWaalsContact O-CB 3.26Å; A926-A943 WeakPolarHBondContact O-CB 3.39Å; A926-L946 HydrophobicContact CB-CD2 4.46Å
927	I	95.1	Very high	92.6	Very high	77 Å²	77	42.8 Å²	42.8	40%	0.395	24%	0.235	S	C	.	.	H	α-helix	trans	-65.5	-44.6	175.1	-70.4	166.8	0	0	0	111.4	E923 E924 S925 I929 N931	E923-I927 HydrophobicContact CG-CD1 3.95Å; E923-I927 WeakPolarHBondContact O-CB 3.46Å; E923-I927 VanDerWaalsContact O-CG1 3.27Å; E923-I927 WeakPolarHBondContact O-CG1 3.4Å; E923-I927 PolarHBondContact O-N 2.67Å; E924-I927 PolarHBondContact O-N 2.88Å; S925-I927 VanDerWaalsContact C-N 3.32Å; S925-I927 PolarHBondContact O-N 2.96Å; I927-I929 VanDerWaalsContact C-N 3.34Å; I927-I929 PolarHBondContact O-N 3.06Å; I927-N931 WeakPolarHBondContact O-CB 3.48Å; I927-N931 PolarHBondContact O-N 3.39Å; I927-N931 PolarHBondContact O-ND2 2.83Å
928	L	94.9	Very high	92.6	Very high	32 Å²	32	40 Å²	40	17%	0.168	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-43.4	178.2	-76	169.1	0	0	0	111.4	E924 S925 N932 F1156 V1158 L1165 I1167	E924-L928 WeakPolarHBondContact O-CB 3.31Å; E924-L928 VanDerWaalsContact O-CG 3.3Å; E924-L928 WeakPolarHBondContact O-CG 3.33Å; E924-L928 PolarHBondContact O-N 3.18Å; S925-L928 PolarHBondContact O-N 3.28Å; L928-N932 WeakPolarHBondContact O-CB 3.22Å; L928-N932 PolarHBondContact O-N 3.26Å; L928-N932 PolarHBondContact O-ND2 3.42Å; L928-F1156 HydrophobicContact CD1-CB 4.19Å; L928-F1156 HydrophobicContact CD2-CB 4.12Å; L928-F1156 HydrophobicContact CD2-CD1 4.06Å; L928-F1156 HydrophobicContact CD2-CG 4.37Å; L928-V1158 HydrophobicContact CD1-CG2 4.14Å; L928-L1165 HydrophobicContact CB-CD1 4.46Å; L928-L1165 HydrophobicContact CD1-CD1 4.32Å; L928-I1167 HydrophobicContact CB-CD1 3.89Å
929	I	94.8	Very high	92.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-68	-51.7	-179.1	-65.1	161.2	0	0	0	111.1	S925 I927 N931 N932 Y933 V942 L972 L981 L1165 I1167	S925-I929 VanDerWaalsContact O-CD1 3.31Å; S925-I929 WeakPolarHBondContact O-CD1 3.46Å; S925-I929 WeakPolarHBondContact O-CG1 3.48Å; S925-I929 PolarHBondContact O-N 3.34Å; I927-I929 VanDerWaalsContact C-N 3.34Å; I927-I929 PolarHBondContact O-N 3.06Å; I929-N931 PolarHBondContact O-N 2.81Å; I929-N932 PolarHBondContact O-N 3.35Å; I929-Y933 WeakPolarHBondContact O-CB 3.28Å; I929-Y933 PolarHBondContact O-N 3.42Å; I929-V942 HydrophobicContact CD1-CG1 4.4Å; I929-V942 HydrophobicContact CG2-CB 4.29Å; I929-V942 HydrophobicContact CG2-CG1 4.07Å; I929-L972 HydrophobicContact CD1-CD1 4.17Å; I929-L972 HydrophobicContact CD1-CD2 3.31Å; I929-L972 HydrophobicContact CD1-CG 4.38Å; I929-L981 HydrophobicContact CG1-CD1 4.33Å; I929-L981 HydrophobicContact CG2-CD2 4.31Å; I929-L1165 HydrophobicContact CD1-CD1 4.35Å; I929-L1165 HydrophobicContact CG1-CD1 4.32Å; I929-I1167 HydrophobicContact CG1-CD1 4.2Å
930	A	94.1	Very high	92.6	Very high	28 Å²	28	39 Å²	39	23%	0.231	22%	0.223	C	C	.	.	H	α-helix	trans	-60.6	-29.3	-178.4	0	0	0	0	0	113.5	A926 A943	A926-A930 WeakPolarHBondContact O-CB 3.46Å; A926-A930 PolarHBondContact O-N 2.67Å; A930-A943 HydrophobicContact CB-CB 3.85Å
931	N	92.1	Very high	92.8	Very high	93 Å²	93	38.6 Å²	38.6	50%	0.497	22%	0.215	S	C	.	.	H	α-helix	trans	-84.1	-47	177.2	-73.1	-55.8	0	0	0	112.9	I927 I929 R1089	I927-N931 WeakPolarHBondContact O-CB 3.48Å; I927-N931 PolarHBondContact O-N 3.39Å; I927-N931 PolarHBondContact O-ND2 2.83Å; I929-N931 PolarHBondContact O-N 2.81Å; N931-R1089 WeakPolarHBondContact O-CG 3.39Å; N931-R1089 PolarHBondContact O-NE 3Å
932	N	92.6	Very high	92.8	Very high	28 Å²	28	38.2 Å²	38.2	15%	0.15	21%	0.214	C	C	.	.	H	α-helix	trans	-103.1	-21	-165.1	-60.5	-82.3	0	0	0	115.3	L928 I929 A934 R1089 F1156 I1167 T1169	L928-N932 WeakPolarHBondContact O-CB 3.22Å; L928-N932 PolarHBondContact O-N 3.26Å; L928-N932 PolarHBondContact O-ND2 3.42Å; I929-N932 PolarHBondContact O-N 3.35Å; N932-A934 PolarHBondContact O-N 2.93Å; N932-R1089 WeakPolarHBondContact O-CG 3.15Å; N932-F1156 HydrophobicContact CB-CE1 4.23Å; N932-F1156 HydrophobicContact CB-CE2 4.13Å; N932-F1156 HydrophobicContact CB-CZ 3.72Å; N932-F1156 WeakPolarHBondContact OD1-CE1 3.46Å; N932-I1167 HydrophobicContact CB-CG2 4.23Å; N932-T1169 HydrophobicContact CB-CG2 4.26Å; N932-T1169 WeakPolarHBondContact O-CA 3.39Å; N932-T1169 WeakPolarHBondContact O-CB 3.37Å; N932-T1169 WeakPolarHBondContact O-CG2 3.33Å
933	Y	92.3	Very high	92.8	Very high	9 Å²	9	38.3 Å²	38.3	4%	0.035	21%	0.214	C	C	.	.	S	Bend	trans	-66.5	133.5	-176.8	-176.9	-112.5	0	0	0	111.4	I929 F935 V938 D978 L981 I1167 P1168	I929-Y933 WeakPolarHBondContact O-CB 3.28Å; I929-Y933 PolarHBondContact O-N 3.42Å; Y933-F935 VanDerWaalsContact C-N 3.3Å; Y933-F935 HydrophobicContact CD1-CB 4.39Å; Y933-F935 HydrophobicContact CE1-CB 4.05Å; Y933-F935 HydrophobicContact CE1-CD2 4.16Å; Y933-F935 PolarHBondContact O-N 3.16Å; Y933-F935 VanDerWaalsContact O-N 3.15Å; Y933-V938 HydrophobicContact CD1-CB 4.41Å; Y933-V938 HydrophobicContact CE1-CB 3.92Å; Y933-V938 HydrophobicContact CE1-CG1 3.79Å; Y933-D978 WeakPolarHBondContact OH-CB 3.29Å; Y933-D978 PolarHBondContact OH-OD2 3.26Å; Y933-L981 HydrophobicContact CD2-CD1 4.04Å; Y933-L981 HydrophobicContact CD2-CD2 4.33Å; Y933-L981 HydrophobicContact CE2-CB 4.35Å; Y933-L981 HydrophobicContact CE2-CD1 4.44Å; Y933-L981 HydrophobicContact CE2-CD2 4.31Å; Y933-I1167 HydrophobicContact CD2-CG2 4.25Å; Y933-P1168 WeakPolarHBondContact CA-O 3.37Å; Y933-P1168 HydrophobicContact CD2-CB 4.43Å; Y933-P1168 WeakPolarHBondContact CD2-O 3.45Å; Y933-P1168 HydrophobicContact CE2-CB 4.18Å; Y933-P1168 HydrophobicContact CE2-CG 4.19Å
934	A	87.7	Confident	92.9	Very high	4 Å²	4	41.1 Å²	41.1	3%	0.033	23%	0.227	C	C	.	.	S	Bend	trans	-50.2	-46	-167.7	0	0	0	0	0	113.4	N932 Q936 P1168 H1171	N932-A934 PolarHBondContact O-N 2.93Å; A934-Q936 PolarHBondContact O-N 3.04Å; A934-P1168 PolarHBondContact N-O 2.98Å; A934-H1171 HydrophobicContact CB-CB 4.12Å; A934-H1171 PolarHBondContact O-CD2 2.91Å
935	F	87.9	Confident	92.9	Very high	46 Å²	46	42 Å²	42	20%	0.202	23%	0.23	C	C	.	.	S	Bend	trans	-92.5	93.9	178.7	-57.7	-69.6	0	0	0	111.1	Y933 S937 V938 G939 H1171 A1179 E1181	Y933-F935 VanDerWaalsContact C-N 3.3Å; Y933-F935 HydrophobicContact CD1-CB 4.39Å; Y933-F935 HydrophobicContact CE1-CB 4.05Å; Y933-F935 HydrophobicContact CE1-CD2 4.16Å; Y933-F935 PolarHBondContact O-N 3.16Å; Y933-F935 VanDerWaalsContact O-N 3.15Å; F935-S937 VanDerWaalsContact C-N 3.29Å; F935-S937 PolarHBondContact O-N 2.83Å; F935-S937 VanDerWaalsContact O-N 3.11Å; F935-V938 HydrophobicContact CB-CB 4.14Å; F935-V938 HydrophobicContact CB-CG2 4.06Å; F935-V938 PolarHBondContact O-N 2.84Å; F935-G939 PolarHBondContact O-N 2.62Å; F935-H1171 HydrophobicContact CE1-CB 3.8Å; F935-H1171 AromaticContact CE1-CG 3.74Å; F935-H1171 HydrophobicContact CE2-CB 4.38Å; F935-H1171 HydrophobicContact CZ-CB 3.65Å; F935-A1179 HydrophobicContact CE1-CB 4.1Å; F935-A1179 HydrophobicContact CZ-CB 3.85Å; F935-E1181 HydrophobicContact CE2-CB 4.06Å; F935-E1181 HydrophobicContact CZ-CB 4.08Å
936	Q	88.6	Confident	92.8	Very high	114 Å²	114	42 Å²	42	53%	0.533	23%	0.23	S	C	.	.	H	α-helix	trans	-50	-40.6	-172.5	179.1	175.6	-8	0	0	114.8	A934 A940 R1089	A934-Q936 PolarHBondContact O-N 3.04Å; Q936-A940 PolarHBondContact O-N 3.1Å; Q936-A940 VanDerWaalsContact O-N 3.09Å; Q936-R1089 VanDerWaalsContact CD-NH2 3.29Å
937	S	88.6	Confident	92.8	Very high	97 Å²	97	46 Å²	46	68%	0.678	25%	0.245	S	C	*	.	H	α-helix	trans	-68.5	-39.8	179.4	47.4	0	0	0	0	112.8	F935 A940 D941	F935-S937 VanDerWaalsContact C-N 3.29Å; F935-S937 PolarHBondContact O-N 2.83Å; F935-S937 VanDerWaalsContact O-N 3.11Å; S937-A940 PolarHBondContact O-N 2.88Å; S937-D941 WeakPolarHBondContact O-CB 3.47Å; S937-D941 PolarHBondContact O-N 3.48Å; S937-D941 VanDerWaalsContact O-N 3.1Å
938	V	89.4	Confident	92.7	Very high	47 Å²	47	47.5 Å²	47.5	29%	0.285	25%	0.251	S	S	.	.	H	α-helix	trans	-70.3	-40.8	176	-179	0	0	0	0	110.1	Y933 F935 A940 D941 V942	Y933-V938 HydrophobicContact CD1-CB 4.41Å; Y933-V938 HydrophobicContact CE1-CB 3.92Å; Y933-V938 HydrophobicContact CE1-CG1 3.79Å; F935-V938 HydrophobicContact CB-CB 4.14Å; F935-V938 HydrophobicContact CB-CG2 4.06Å; F935-V938 PolarHBondContact O-N 2.84Å; V938-A940 VanDerWaalsContact C-N 3.27Å; V938-A940 PolarHBondContact O-N 3.07Å; V938-D941 PolarHBondContact O-N 3.5Å; V938-V942 HydrophobicContact CG1-CG2 4.12Å; V938-V942 WeakPolarHBondContact O-CB 3.37Å; V938-V942 WeakPolarHBondContact O-CG2 3.31Å; V938-V942 PolarHBondContact O-N 3.46Å
939	G	91.9	Very high	92.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.9	-35.3	176	0	0	0	0	0	113.1	F935 A943	F935-G939 PolarHBondContact O-N 2.62Å; G939-A943 WeakPolarHBondContact O-CB 3.47Å; G939-A943 PolarHBondContact O-N 3.29Å
940	A	93	Very high	92.3	Very high	49 Å²	49	50 Å²	50	41%	0.405	26%	0.264	S	S	.	.	H	α-helix	trans	-70.3	-46.6	173.5	0	0	0	0	0	112.5	Q936 S937 V938 A943 E944	Q936-A940 PolarHBondContact O-N 3.1Å; Q936-A940 VanDerWaalsContact O-N 3.09Å; S937-A940 PolarHBondContact O-N 2.88Å; V938-A940 VanDerWaalsContact C-N 3.27Å; V938-A940 PolarHBondContact O-N 3.07Å; A940-A943 PolarHBondContact O-N 2.81Å; A940-E944 PolarHBondContact O-N 3.45Å
941	D	94.9	Very high	91.9	Very high	58 Å²	58	52.8 Å²	52.8	31%	0.31	29%	0.287	S	S	.	.	H	α-helix	trans	-62.4	-42.3	178.8	172.6	92.2	0	0	0	112.6	S937 V938 E944 K945	S937-D941 WeakPolarHBondContact O-CB 3.47Å; S937-D941 PolarHBondContact O-N 3.48Å; S937-D941 VanDerWaalsContact O-N 3.1Å; V938-D941 PolarHBondContact O-N 3.5Å; D941-E944 PolarHBondContact O-N 3.16Å; D941-K945 WeakPolarHBondContact O-CG 3.37Å; D941-K945 PolarHBondContact O-N 2.75Å; D941-K945 WeakPolarHBondContact OD1-CE 3.21Å; D941-K945 IonicContact OD1-NZ 3.59Å; D941-K945 PolarHBondContact OD1-NZ 3.23Å; D941-K945 WeakPolarHBondContact OD2-CE 3.32Å; D941-K945 IonicContact OD2-NZ 3.55Å; D941-K945 PolarHBondContact OD2-NZ 3.24Å
942	V	94.7	Very high	91.5	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.4	-44.2	172.1	172.5	0	0	0	0	110.8	I929 V938 E944 L946 L972 L975 L981	I929-V942 HydrophobicContact CD1-CG1 4.4Å; I929-V942 HydrophobicContact CG2-CB 4.29Å; I929-V942 HydrophobicContact CG2-CG1 4.07Å; V938-V942 HydrophobicContact CG1-CG2 4.12Å; V938-V942 WeakPolarHBondContact O-CB 3.37Å; V938-V942 WeakPolarHBondContact O-CG2 3.31Å; V938-V942 PolarHBondContact O-N 3.46Å; V942-E944 VanDerWaalsContact C-N 3.34Å; V942-E944 PolarHBondContact O-N 3.28Å; V942-L946 VanDerWaalsContact O-CB 3.26Å; V942-L946 WeakPolarHBondContact O-CB 3.45Å; V942-L946 PolarHBondContact O-N 2.87Å; V942-L972 HydrophobicContact CG1-CD2 3.93Å; V942-L975 HydrophobicContact CB-CB 4.45Å; V942-L975 HydrophobicContact CG1-CB 4.13Å; V942-L975 HydrophobicContact CG1-CD1 4.46Å; V942-L975 HydrophobicContact CG2-CB 4.05Å; V942-L981 HydrophobicContact CG1-CD2 4.44Å
943	A	95.6	Very high	91	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.008	30%	0.302	C	S	.	.	H	α-helix	trans	-69	-29.2	179.6	0	0	0	0	0	113.3	A926 A930 G939 A940 R947	A926-A943 HydrophobicContact CB-CB 3.88Å; A926-A943 VanDerWaalsContact O-CB 3.26Å; A926-A943 WeakPolarHBondContact O-CB 3.39Å; A930-A943 HydrophobicContact CB-CB 3.85Å; G939-A943 WeakPolarHBondContact O-CB 3.47Å; G939-A943 PolarHBondContact O-N 3.29Å; A940-A943 PolarHBondContact O-N 2.81Å; A943-R947 VanDerWaalsContact C-NH1 3.33Å; A943-R947 WeakPolarHBondContact O-CG 3.38Å; A943-R947 PolarHBondContact O-NH1 3.48Å
944	E	96.3	Very high	90.7	Very high	127 Å²	127	58.5 Å²	58.5	59%	0.593	32%	0.322	S	S	*	.	H	α-helix	trans	-71.2	-53.8	172.6	-172.3	161.7	-153.4	0	0	110.3	A940 D941 V942 L946 R947 E948	A940-E944 PolarHBondContact O-N 3.45Å; D941-E944 PolarHBondContact O-N 3.16Å; V942-E944 VanDerWaalsContact C-N 3.34Å; V942-E944 PolarHBondContact O-N 3.28Å; E944-L946 VanDerWaalsContact C-N 3.32Å; E944-L946 PolarHBondContact O-N 3.19Å; E944-R947 WeakPolarHBondContact O-CA 3.5Å; E944-R947 WeakPolarHBondContact O-CB 3.39Å; E944-R947 PolarHBondContact O-N 3.33Å; E944-E948 PolarHBondContact O-N 3.12Å; E944-E948 VanDerWaalsContact O-N 3.09Å
945	K	95.4	Very high	90.6	Very high	71 Å²	71	58.6 Å²	58.6	31%	0.309	32%	0.322	S	S	.	.	H	α-helix	trans	-62.7	-33.6	-179.9	-69.1	169.3	-172.7	162.5	0	113.7	D941 R947 E948 L949 L975	D941-K945 WeakPolarHBondContact O-CG 3.37Å; D941-K945 PolarHBondContact O-N 2.75Å; D941-K945 WeakPolarHBondContact OD1-CE 3.21Å; D941-K945 IonicContact OD1-NZ 3.59Å; D941-K945 PolarHBondContact OD1-NZ 3.23Å; D941-K945 WeakPolarHBondContact OD2-CE 3.32Å; D941-K945 IonicContact OD2-NZ 3.55Å; D941-K945 PolarHBondContact OD2-NZ 3.24Å; K945-R947 PolarHBondContact O-N 2.64Å; K945-E948 WeakPolarHBondContact O-CB 3.24Å; K945-E948 PolarHBondContact O-N 2.69Å; K945-E948 VanDerWaalsContact O-N 3.13Å; K945-L949 WeakPolarHBondContact O-CG 3.23Å; K945-L949 PolarHBondContact O-N 3.46Å; K945-L975 HydrophobicContact CB-CD1 4.03Å; K945-L975 HydrophobicContact CB-CD2 3.62Å; K945-L975 HydrophobicContact CB-CG 4.44Å; K945-L975 HydrophobicContact CD-CD2 3.79Å; K945-L975 HydrophobicContact CG-CD2 4.3Å
946	L	94.4	Very high	90.2	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-64.8	-31	175.2	-164.3	73.2	0	0	0	111.9	I922 A926 V942 E944 L949 L950 F955 L968 D971 L972 L975	I922-L946 HydrophobicContact CG2-CD2 4.01Å; I922-L946 HydrophobicContact CG2-CG 3.84Å; A926-L946 HydrophobicContact CB-CD2 4.46Å; V942-L946 VanDerWaalsContact O-CB 3.26Å; V942-L946 WeakPolarHBondContact O-CB 3.45Å; V942-L946 PolarHBondContact O-N 2.87Å; E944-L946 VanDerWaalsContact C-N 3.32Å; E944-L946 PolarHBondContact O-N 3.19Å; L946-L949 HydrophobicContact CD1-CD1 4.46Å; L946-L950 PolarHBondContact O-N 3.32Å; L946-F955 HydrophobicContact CD1-CZ 4.28Å; L946-L968 HydrophobicContact CD1-CD1 3.93Å; L946-L968 HydrophobicContact CD2-CD1 4.02Å; L946-D971 HydrophobicContact CD1-CB 4.31Å; L946-L972 HydrophobicContact CD1-CD2 4.4Å; L946-L972 HydrophobicContact CD2-CD2 4.26Å; L946-L975 HydrophobicContact CB-CD1 4.3Å; L946-L975 HydrophobicContact CD1-CD1 4.24Å
947	R	94.6	Very high	89.8	Confident	85 Å²	85	58.4 Å²	58.4	32%	0.321	34%	0.339	S	S	.	.	H	α-helix	trans	-74.4	-34.4	170.8	-64.9	172.6	-178.5	105.4	-6.4	112.1	E923 A943 E944 K945 L950 A951	E923-R947 IonicContact OE1-CZ 2.73Å; E923-R947 IonicContact OE1-NE 3.73Å; E923-R947 PolarHBondContact OE1-NE 3.06Å; E923-R947 IonicContact OE1-NH2 3.39Å; E923-R947 PolarHBondContact OE1-NH2 3.21Å; E923-R947 IonicContact OE2-CZ 3.63Å; E923-R947 IonicContact OE2-NE 3.82Å; E923-R947 PolarHBondContact OE2-NE 3.02Å; E923-R947 IonicContact OE2-NH2 3.32Å; A943-R947 VanDerWaalsContact C-NH1 3.33Å; A943-R947 WeakPolarHBondContact O-CG 3.38Å; A943-R947 PolarHBondContact O-NH1 3.48Å; E944-R947 WeakPolarHBondContact O-CA 3.5Å; E944-R947 WeakPolarHBondContact O-CB 3.39Å; E944-R947 PolarHBondContact O-N 3.33Å; K945-R947 PolarHBondContact O-N 2.64Å; R947-L950 WeakPolarHBondContact O-CB 3.31Å; R947-L950 PolarHBondContact O-N 2.98Å; R947-A951 WeakPolarHBondContact O-CB 3.39Å; R947-A951 PolarHBondContact O-N 3Å
948	E	93.3	Very high	89.8	Confident	108 Å²	108	54 Å²	54	51%	0.505	31%	0.307	S	S	.	.	H	α-helix	trans	-62	-44.8	172.2	-61.6	-175.3	133.7	0	0	111.5	E944 K945 L950 A951 N952	E944-E948 PolarHBondContact O-N 3.12Å; E944-E948 VanDerWaalsContact O-N 3.09Å; K945-E948 WeakPolarHBondContact O-CB 3.24Å; K945-E948 PolarHBondContact O-N 2.69Å; K945-E948 VanDerWaalsContact O-N 3.13Å; E948-L950 VanDerWaalsContact C-N 3.3Å; E948-L950 PolarHBondContact O-N 2.94Å; E948-A951 PolarHBondContact O-N 3.31Å; E948-N952 WeakPolarHBondContact O-CB 3.24Å; E948-N952 PolarHBondContact O-N 3.24Å; E948-N952 PolarHBondContact O-ND2 3.43Å
949	L	91.3	Very high	89.7	Confident	38 Å²	38	54.2 Å²	54.2	20%	0.199	31%	0.309	C	S	.	.	H	α-helix	trans	-59.4	-40.1	174.5	-66.2	174.5	0	0	0	112	K945 L946 G953 E954 F955 D971 L975	K945-L949 WeakPolarHBondContact O-CG 3.23Å; K945-L949 PolarHBondContact O-N 3.46Å; L946-L949 HydrophobicContact CD1-CD1 4.46Å; L949-G953 PolarHBondContact O-N 3.4Å; L949-E954 HydrophobicContact CB-CB 4.34Å; L949-E954 HydrophobicContact CB-CG 4.31Å; L949-E954 HydrophobicContact CD2-CG 3.93Å; L949-E954 WeakPolarHBondContact O-CB 3.34Å; L949-E954 PolarHBondContact O-N 2.98Å; L949-E954 VanDerWaalsContact O-N 3.07Å; L949-F955 HydrophobicContact CB-CE2 3.95Å; L949-D971 HydrophobicContact CD1-CB 4.09Å; L949-L975 HydrophobicContact CD1-CD1 4.03Å
950	L	89.4	Confident	89.5	Confident	47 Å²	47	56.8 Å²	56.8	25%	0.246	33%	0.326	C	S	.	.	H	α-helix	trans	-64.3	-46.7	173.5	-178.6	67.6	0	0	0	112.1	V918 P919 I922 L946 R947 E948 N952 G953 F955	V918-L950 HydrophobicContact CG1-CD1 4.16Å; P919-L950 HydrophobicContact CB-CD2 4.2Å; P919-L950 HydrophobicContact CG-CD1 4.41Å; I922-L950 HydrophobicContact CB-CD2 4.2Å; I922-L950 HydrophobicContact CG1-CD1 4.45Å; I922-L950 HydrophobicContact CG2-CB 4.09Å; I922-L950 HydrophobicContact CG2-CD2 4.03Å; I922-L950 HydrophobicContact CG2-CG 4.5Å; L946-L950 PolarHBondContact O-N 3.32Å; R947-L950 WeakPolarHBondContact O-CB 3.31Å; R947-L950 PolarHBondContact O-N 2.98Å; E948-L950 VanDerWaalsContact C-N 3.3Å; E948-L950 PolarHBondContact O-N 2.94Å; L950-N952 VanDerWaalsContact C-N 3.33Å; L950-N952 PolarHBondContact O-N 3.15Å; L950-G953 PolarHBondContact O-N 3.19Å; L950-G953 VanDerWaalsContact O-N 3.08Å; L950-F955 HydrophobicContact CB-CD2 4.48Å; L950-F955 HydrophobicContact CD1-CD2 4.31Å
951	A	86.4	Confident	89.2	Confident	87 Å²	87	57.9 Å²	57.9	72%	0.719	32%	0.322	S	S	*	.	H	α-helix	trans	-66.2	-33	-179.5	0	0	0	0	0	113.1	R947 E948 G953	R947-A951 WeakPolarHBondContact O-CB 3.39Å; R947-A951 PolarHBondContact O-N 3Å; E948-A951 PolarHBondContact O-N 3.31Å; A951-G953 PolarHBondContact O-N 2.87Å
952	N	84.1	Confident	88.9	Confident	124 Å²	124	62.1 Å²	62.1	66%	0.663	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-7.1	173.8	-67.3	-26	0	0	0	113.1	E948 L950 E954	E948-N952 WeakPolarHBondContact O-CB 3.24Å; E948-N952 PolarHBondContact O-N 3.24Å; E948-N952 PolarHBondContact O-ND2 3.43Å; L950-N952 VanDerWaalsContact C-N 3.33Å; L950-N952 PolarHBondContact O-N 3.15Å; N952-E954 HydrophobicContact CB-CG 4.5Å
953	G	81.3	Confident	88.7	Confident	29 Å²	29	63.8 Å²	63.8	30%	0.299	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	15.6	175.7	0	0	0	0	0	115.2	L949 L950 A951 F955 S956	L949-G953 PolarHBondContact O-N 3.4Å; L950-G953 PolarHBondContact O-N 3.19Å; L950-G953 VanDerWaalsContact O-N 3.08Å; A951-G953 PolarHBondContact O-N 2.87Å; G953-F955 PolarHBondContact O-N 3.11Å; G953-F955 VanDerWaalsContact O-N 3.1Å; G953-S956 WeakPolarHBondContact O-CB 3.49Å; G953-S956 PolarHBondContact O-N 3.14Å; G953-S956 PolarHBondContact O-OG 3.18Å
954	E	85.1	Confident	88.6	Confident	96 Å²	96	63.7 Å²	63.7	45%	0.449	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-57.9	-28.3	-176.2	-71.1	-69.4	145	0	0	113.6	L949 N952 S957 K967	L949-E954 HydrophobicContact CB-CB 4.34Å; L949-E954 HydrophobicContact CB-CG 4.31Å; L949-E954 HydrophobicContact CD2-CG 3.93Å; L949-E954 WeakPolarHBondContact O-CB 3.34Å; L949-E954 PolarHBondContact O-N 2.98Å; L949-E954 VanDerWaalsContact O-N 3.07Å; N952-E954 HydrophobicContact CB-CG 4.5Å; E954-S957 PolarHBondContact O-OG 3.4Å; E954-K967 WeakPolarHBondContact O-CE 3.48Å
955	F	85.5	Confident	88.4	Confident	7 Å²	7	60 Å²	60	3%	0.031	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-87.3	-0.1	177.5	-58.7	-86.7	0	0	0	114.3	V918 I922 L946 L949 L950 G953 S957 V958 L964 K967 D971	V918-F955 HydrophobicContact CG1-CB 3.69Å; V918-F955 HydrophobicContact CG1-CG 4.08Å; I922-F955 HydrophobicContact CD1-CD1 4.31Å; I922-F955 HydrophobicContact CD1-CE1 3.76Å; I922-F955 HydrophobicContact CD1-CE2 3.99Å; I922-F955 HydrophobicContact CD1-CZ 3.59Å; I922-F955 HydrophobicContact CG1-CD2 4.44Å; I922-F955 HydrophobicContact CG1-CE2 4.26Å; I922-F955 HydrophobicContact CG1-CZ 4.35Å; L946-F955 HydrophobicContact CD1-CZ 4.28Å; L949-F955 HydrophobicContact CB-CE2 3.95Å; L950-F955 HydrophobicContact CB-CD2 4.48Å; L950-F955 HydrophobicContact CD1-CD2 4.31Å; G953-F955 PolarHBondContact O-N 3.11Å; G953-F955 VanDerWaalsContact O-N 3.1Å; F955-S957 PolarHBondContact O-N 3.3Å; F955-V958 HydrophobicContact CB-CG2 4.22Å; F955-V958 HydrophobicContact CD1-CG2 4.36Å; F955-V958 WeakPolarHBondContact O-CB 3.46Å; F955-V958 VanDerWaalsContact O-CG2 3.29Å; F955-V958 WeakPolarHBondContact O-CG2 3.25Å; F955-V958 PolarHBondContact O-N 2.96Å; F955-V958 VanDerWaalsContact O-N 3.14Å; F955-L964 HydrophobicContact CD1-CD1 3.92Å; F955-L964 HydrophobicContact CE1-CD1 4.37Å; F955-K967 HydrophobicContact CD1-CD 3.99Å; F955-K967 HydrophobicContact CD1-CG 4.24Å; F955-K967 HydrophobicContact CE1-CD 4.03Å; F955-K967 HydrophobicContact CE1-CG 3.85Å; F955-D971 VanDerWaalsContact CZ-OD2 3.28Å; F955-D971 WeakPolarHBondContact CZ-OD2 3.11Å
956	S	79.8	Confident	88.3	Confident	77 Å²	77	60.8 Å²	60.8	54%	0.538	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-62	-22.5	172.9	62.1	0	0	0	0	112.9	R915 G953 V958	R915-S956 PolarHBondContact NE-O 3.44Å; R915-S956 PolarHBondContact NH2-O 2.84Å; G953-S956 WeakPolarHBondContact O-CB 3.49Å; G953-S956 PolarHBondContact O-N 3.14Å; G953-S956 PolarHBondContact O-OG 3.18Å; S956-V958 VanDerWaalsContact C-N 3.29Å; S956-V958 PolarHBondContact O-N 2.73Å
957	S	81.4	Confident	88.2	Confident	79 Å²	79	62.8 Å²	62.8	55%	0.552	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-72.8	-12.9	175.5	59.1	0	0	0	0	114.7	E954 F955 V959	E954-S957 PolarHBondContact O-OG 3.4Å; F955-S957 PolarHBondContact O-N 3.3Å; S957-V959 PolarHBondContact O-N 2.92Å
958	V	87.4	Confident	88.2	Confident	4 Å²	4	58.8 Å²	58.8	2%	0.024	34%	0.338	C	S	.	.			trans	-64	133.7	-176.1	169	0	0	0	0	111.3	L914 R915 F955 S956 L964	L914-V958 HydrophobicContact CD2-CG1 3.8Å; L914-V958 HydrophobicContact CG-CG1 4.34Å; R915-V958 PolarHBondContact NE-O 3.11Å; R915-V958 PolarHBondContact NH2-O 3.41Å; F955-V958 HydrophobicContact CB-CG2 4.22Å; F955-V958 HydrophobicContact CD1-CG2 4.36Å; F955-V958 WeakPolarHBondContact O-CB 3.46Å; F955-V958 VanDerWaalsContact O-CG2 3.29Å; F955-V958 WeakPolarHBondContact O-CG2 3.25Å; F955-V958 PolarHBondContact O-N 2.96Å; F955-V958 VanDerWaalsContact O-N 3.14Å; S956-V958 VanDerWaalsContact C-N 3.29Å; S956-V958 PolarHBondContact O-N 2.73Å; V958-L964 HydrophobicContact CG1-CB 3.89Å; V958-L964 HydrophobicContact CG2-CB 4.36Å; V958-L964 HydrophobicContact CG2-CD1 4.14Å
959	V	87.4	Confident	88.3	Confident	51 Å²	51	54.3 Å²	54.3	31%	0.309	32%	0.319	S	S	.	.			trans	-124.8	-16.2	-179.1	-65	0	0	0	0	114.1	V897 I911 S957 S963	V897-V959 HydrophobicContact CG2-CB 3.95Å; V897-V959 HydrophobicContact CG2-CG1 3.58Å; I911-V959 HydrophobicContact CD1-CB 4.09Å; I911-V959 HydrophobicContact CD1-CG1 4.28Å; I911-V959 HydrophobicContact CG1-CB 4.42Å; I911-V959 VanDerWaalsContact CG1-O 3.25Å; I911-V959 WeakPolarHBondContact CG1-O 3.35Å; S957-V959 PolarHBondContact O-N 2.92Å; V959-S963 PolarHBondContact N-OG 3.34Å
960	C	88.2	Confident	88.4	Confident	55 Å²	55	54.9 Å²	54.9	37%	0.372	33%	0.329	S	S	.	.	S	Bend	trans	-153.5	164	174.4	68.7	0	0	0	0	111.3	E962 S963 L964	C960-E962 VanDerWaalsContact C-N 3.29Å; C960-E962 PolarHBondContact O-N 2.9Å; C960-S963 PolarHBondContact N-OG 2.76Å; C960-S963 PolarHBondContact O-N 2.87Å; C960-S963 VanDerWaalsContact O-N 3.12Å; C960-S963 PolarHBondContact O-OG 3.23Å; C960-S963 PolarHBondContact SG-N 2.74Å; C960-L964 PolarHBondContact O-N 2.71Å; C960-L964 VanDerWaalsContact O-N 3.12Å
961	K	87.4	Confident	88.6	Confident	72 Å²	72	53.8 Å²	53.8	31%	0.313	32%	0.323	S	S	.	.	H	α-helix	trans	-58.2	-40.7	179.2	174.4	170.4	169	167.1	0	112.4	S963 L964 E965 S1161 N1162	K961-S963 VanDerWaalsContact C-N 3.33Å; K961-S963 PolarHBondContact O-N 2.73Å; K961-L964 WeakPolarHBondContact O-CB 3.22Å; K961-L964 PolarHBondContact O-N 3.39Å; K961-L964 VanDerWaalsContact O-N 3.14Å; K961-E965 VanDerWaalsContact CE-CD 3.44Å; K961-E965 WeakPolarHBondContact CE-OE1 3.46Å; K961-E965 HydrophobicContact CG-CG 4.28Å; K961-E965 IonicContact NZ-OE1 3.7Å; K961-E965 WeakPolarHBondContact O-CG 2.99Å; K961-E965 PolarHBondContact O-N 3.29Å; K961-S1161 PolarHBondContact NZ-O 2.96Å; K961-N1162 PolarHBondContact NZ-O 3.24Å
962	E	88.9	Confident	89	Confident	146 Å²	146	49.7 Å²	49.7	68%	0.682	29%	0.289	S	S	*	.	H	α-helix	trans	-61.5	-39.4	176.9	-175.4	175.8	-168.2	0	0	111.9	C960 L964 E965 T966	C960-E962 VanDerWaalsContact C-N 3.29Å; C960-E962 PolarHBondContact O-N 2.9Å; E962-L964 VanDerWaalsContact C-N 3.35Å; E962-L964 PolarHBondContact O-N 2.91Å; E962-E965 PolarHBondContact O-N 3.06Å; E962-T966 VanDerWaalsContact O-CB 3.23Å; E962-T966 WeakPolarHBondContact O-CB 3.45Å; E962-T966 PolarHBondContact O-N 3.13Å; E962-T966 PolarHBondContact O-OG1 3.43Å
963	S	90.5	Very high	89.3	Confident	35 Å²	35	46.9 Å²	46.9	25%	0.245	27%	0.271	C	S	.	.	H	α-helix	trans	-65.5	-35.6	174.2	71.6	0	0	0	0	112.9	V959 C960 K961 K967	V959-S963 PolarHBondContact N-OG 3.34Å; C960-S963 PolarHBondContact N-OG 2.76Å; C960-S963 PolarHBondContact O-N 2.87Å; C960-S963 VanDerWaalsContact O-N 3.12Å; C960-S963 PolarHBondContact O-OG 3.23Å; C960-S963 PolarHBondContact SG-N 2.74Å; K961-S963 VanDerWaalsContact C-N 3.33Å; K961-S963 PolarHBondContact O-N 2.73Å; S963-K967 WeakPolarHBondContact O-CB 3.46Å; S963-K967 PolarHBondContact O-N 2.82Å
964	L	92.5	Very high	89.8	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-67.8	-48.2	173.4	178.3	62.4	0	0	0	111.2	L914 V918 I921 F955 V958 C960 K961 E962 T966 K967 L968 I1163	L914-L964 HydrophobicContact CD1-CD2 4.35Å; V918-L964 HydrophobicContact CG1-CD1 4.25Å; V918-L964 HydrophobicContact CG2-CD1 4.05Å; V918-L964 HydrophobicContact CG2-CD2 3.95Å; I921-L964 HydrophobicContact CD1-CD2 3.85Å; I921-L964 HydrophobicContact CG2-CD2 4.27Å; F955-L964 HydrophobicContact CD1-CD1 3.92Å; F955-L964 HydrophobicContact CE1-CD1 4.37Å; V958-L964 HydrophobicContact CG1-CB 3.89Å; V958-L964 HydrophobicContact CG2-CB 4.36Å; V958-L964 HydrophobicContact CG2-CD1 4.14Å; C960-L964 PolarHBondContact O-N 2.71Å; C960-L964 VanDerWaalsContact O-N 3.12Å; K961-L964 WeakPolarHBondContact O-CB 3.22Å; K961-L964 PolarHBondContact O-N 3.39Å; K961-L964 VanDerWaalsContact O-N 3.14Å; E962-L964 VanDerWaalsContact C-N 3.35Å; E962-L964 PolarHBondContact O-N 2.91Å; L964-T966 VanDerWaalsContact C-N 3.27Å; L964-T966 PolarHBondContact O-N 2.9Å; L964-K967 PolarHBondContact O-N 3.03Å; L964-L968 WeakPolarHBondContact O-CB 3.25Å; L964-L968 PolarHBondContact O-N 3.36Å; L964-I1163 HydrophobicContact CD2-CD1 4.01Å
965	E	92	Very high	90.1	Very high	49 Å²	49	48.6 Å²	48.6	23%	0.229	28%	0.281	C	S	.	.	H	α-helix	trans	-62.4	-36.1	178	-73.9	177.4	153.4	0	0	111.7	K961 E962 S969 T983 I1163	K961-E965 VanDerWaalsContact CE-CD 3.44Å; K961-E965 WeakPolarHBondContact CE-OE1 3.46Å; K961-E965 HydrophobicContact CG-CG 4.28Å; K961-E965 IonicContact NZ-OE1 3.7Å; K961-E965 WeakPolarHBondContact O-CG 2.99Å; K961-E965 PolarHBondContact O-N 3.29Å; E962-E965 PolarHBondContact O-N 3.06Å; E965-S969 VanDerWaalsContact O-CB 3.25Å; E965-S969 WeakPolarHBondContact O-CB 3.46Å; E965-S969 PolarHBondContact O-N 3.11Å; E965-T983 HydrophobicContact CB-CG2 4.41Å; E965-T983 WeakPolarHBondContact O-CG2 3.44Å; E965-T983 PolarHBondContact O-OG1 2.95Å; E965-I1163 HydrophobicContact CG-CD1 4.33Å; E965-I1163 HydrophobicContact CG-CG1 3.98Å; E965-I1163 HydrophobicContact CG-CG2 4.17Å; E965-I1163 WeakPolarHBondContact OE1-CG1 3.16Å
966	T	92.8	Very high	90.2	Very high	87 Å²	87	49.3 Å²	49.3	53%	0.534	29%	0.287	S	S	.	.	H	α-helix	trans	-71	-49.8	177.3	-60.4	0	0	0	0	111.6	E962 L964 S969 A970	E962-T966 VanDerWaalsContact O-CB 3.23Å; E962-T966 WeakPolarHBondContact O-CB 3.45Å; E962-T966 PolarHBondContact O-N 3.13Å; E962-T966 PolarHBondContact O-OG1 3.43Å; L964-T966 VanDerWaalsContact C-N 3.27Å; L964-T966 PolarHBondContact O-N 2.9Å; T966-S969 WeakPolarHBondContact O-CB 3.24Å; T966-S969 PolarHBondContact O-N 2.93Å; T966-A970 PolarHBondContact O-N 3.01Å
967	K	93.6	Very high	90.3	Very high	43 Å²	43	48.1 Å²	48.1	19%	0.187	29%	0.287	C	S	.	.	H	α-helix	trans	-62.2	-45.7	176.8	175.2	162.4	168.8	49.1	0	111.2	E954 F955 S963 L964 S969 A970 D971	E954-K967 WeakPolarHBondContact O-CE 3.48Å; F955-K967 HydrophobicContact CD1-CD 3.99Å; F955-K967 HydrophobicContact CD1-CG 4.24Å; F955-K967 HydrophobicContact CE1-CD 4.03Å; F955-K967 HydrophobicContact CE1-CG 3.85Å; S963-K967 WeakPolarHBondContact O-CB 3.46Å; S963-K967 PolarHBondContact O-N 2.82Å; L964-K967 PolarHBondContact O-N 3.03Å; K967-S969 VanDerWaalsContact C-N 3.33Å; K967-S969 PolarHBondContact O-N 3.45Å; K967-A970 PolarHBondContact O-N 2.86Å; K967-A970 VanDerWaalsContact O-N 3.14Å; K967-D971 WeakPolarHBondContact CE-OD2 3.43Å; K967-D971 VanDerWaalsContact CG-OD2 3.3Å; K967-D971 WeakPolarHBondContact CG-OD2 3.38Å; K967-D971 VanDerWaalsContact NZ-CG 3.26Å; K967-D971 IonicContact NZ-OD1 3.65Å; K967-D971 PolarHBondContact NZ-OD1 3.14Å; K967-D971 IonicContact NZ-OD2 3.86Å; K967-D971 PolarHBondContact NZ-OD2 3.02Å; K967-D971 WeakPolarHBondContact O-CB 3.4Å; K967-D971 VanDerWaalsContact O-CG 3.23Å; K967-D971 PolarHBondContact O-N 2.88Å
968	L	94.5	Very high	90.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60	-42.1	175.5	-177.3	59	0	0	0	111.5	I922 L946 L964 A970 L972 T983 L1165	I922-L968 HydrophobicContact CD1-CD1 3.87Å; L946-L968 HydrophobicContact CD1-CD1 3.93Å; L946-L968 HydrophobicContact CD2-CD1 4.02Å; L964-L968 WeakPolarHBondContact O-CB 3.25Å; L964-L968 PolarHBondContact O-N 3.36Å; L968-A970 VanDerWaalsContact C-N 3.33Å; L968-A970 PolarHBondContact O-N 2.99Å; L968-L972 HydrophobicContact CD1-CD1 3.99Å; L968-L972 HydrophobicContact CD1-CD2 4.33Å; L968-L972 HydrophobicContact CD1-CG 3.9Å; L968-L972 HydrophobicContact CG-CD1 4Å; L968-L972 HydrophobicContact CG-CG 4.32Å; L968-L972 VanDerWaalsContact O-CB 3.31Å; L968-L972 WeakPolarHBondContact O-CB 3.18Å; L968-L972 WeakPolarHBondContact O-CG 3.42Å; L968-L972 PolarHBondContact O-N 3.04Å; L968-T983 HydrophobicContact CB-CG2 4.18Å; L968-T983 HydrophobicContact CD2-CG2 3.94Å; L968-T983 HydrophobicContact CG-CG2 4.03Å; L968-L1165 HydrophobicContact CD2-CD2 4.3Å
969	S	94.3	Very high	90.1	Very high	15 Å²	15	50.7 Å²	50.7	11%	0.105	29%	0.288	C	S	.	.	H	α-helix	trans	-58.3	-42.7	173.8	-156.1	0	0	0	0	112.7	E965 T966 K967 K973 T983	E965-S969 VanDerWaalsContact O-CB 3.25Å; E965-S969 WeakPolarHBondContact O-CB 3.46Å; E965-S969 PolarHBondContact O-N 3.11Å; T966-S969 WeakPolarHBondContact O-CB 3.24Å; T966-S969 PolarHBondContact O-N 2.93Å; K967-S969 VanDerWaalsContact C-N 3.33Å; K967-S969 PolarHBondContact O-N 3.45Å; S969-K973 VanDerWaalsContact O-CD 3.29Å; S969-K973 WeakPolarHBondContact O-CD 3.47Å; S969-K973 VanDerWaalsContact O-CG 3.24Å; S969-K973 WeakPolarHBondContact O-CG 3.26Å; S969-K973 PolarHBondContact O-N 2.88Å; S969-K973 PolarHBondContact OG-NZ 3.13Å; S969-T983 VanDerWaalsContact CB-OG1 3.3Å; S969-T983 WeakPolarHBondContact CB-OG1 3.39Å; S969-T983 PolarHBondContact OG-OG1 2.98Å
970	A	93.7	Very high	90	Very high	50 Å²	50	49.3 Å²	49.3	41%	0.413	28%	0.281	S	S	.	.	H	α-helix	trans	-69.8	-50.8	179.5	0	0	0	0	0	111.5	T966 K967 L968 L972 K973 T974	T966-A970 PolarHBondContact O-N 3.01Å; K967-A970 PolarHBondContact O-N 2.86Å; K967-A970 VanDerWaalsContact O-N 3.14Å; L968-A970 VanDerWaalsContact C-N 3.33Å; L968-A970 PolarHBondContact O-N 2.99Å; A970-L972 VanDerWaalsContact C-N 3.33Å; A970-L972 PolarHBondContact O-N 3.3Å; A970-K973 PolarHBondContact O-N 3.28Å; A970-T974 WeakPolarHBondContact O-CB 3.41Å; A970-T974 PolarHBondContact O-N 3.14Å; A970-T974 PolarHBondContact O-OG1 2.92Å
971	D	94.4	Very high	90.1	Very high	24 Å²	24	46.7 Å²	46.7	13%	0.128	26%	0.263	C	S	.	.	H	α-helix	trans	-57.4	-45	178.9	-65.5	-21.2	0	0	0	110.6	L946 L949 F955 K967 K973 T974 L975	L946-D971 HydrophobicContact CD1-CB 4.31Å; L949-D971 HydrophobicContact CD1-CB 4.09Å; F955-D971 VanDerWaalsContact CZ-OD2 3.28Å; F955-D971 WeakPolarHBondContact CZ-OD2 3.11Å; K967-D971 WeakPolarHBondContact CE-OD2 3.43Å; K967-D971 VanDerWaalsContact CG-OD2 3.3Å; K967-D971 WeakPolarHBondContact CG-OD2 3.38Å; K967-D971 VanDerWaalsContact NZ-CG 3.26Å; K967-D971 IonicContact NZ-OD1 3.65Å; K967-D971 PolarHBondContact NZ-OD1 3.14Å; K967-D971 IonicContact NZ-OD2 3.86Å; K967-D971 PolarHBondContact NZ-OD2 3.02Å; K967-D971 WeakPolarHBondContact O-CB 3.4Å; K967-D971 VanDerWaalsContact O-CG 3.23Å; K967-D971 PolarHBondContact O-N 2.88Å; D971-K973 PolarHBondContact O-N 3.01Å; D971-T974 PolarHBondContact O-N 3.33Å; D971-L975 VanDerWaalsContact O-CB 3.29Å; D971-L975 WeakPolarHBondContact O-CB 3.47Å; D971-L975 WeakPolarHBondContact O-CG 3.21Å; D971-L975 PolarHBondContact O-N 3.45Å
972	L	93.8	Very high	90.3	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-62.6	-40.8	178.7	-71.2	-179.4	0	0	0	113.7	I929 V942 L946 L968 A970 S976 L981 L1165	I929-L972 HydrophobicContact CD1-CD1 4.17Å; I929-L972 HydrophobicContact CD1-CD2 3.31Å; I929-L972 HydrophobicContact CD1-CG 4.38Å; V942-L972 HydrophobicContact CG1-CD2 3.93Å; L946-L972 HydrophobicContact CD1-CD2 4.4Å; L946-L972 HydrophobicContact CD2-CD2 4.26Å; L968-L972 HydrophobicContact CD1-CD1 3.99Å; L968-L972 HydrophobicContact CD1-CD2 4.33Å; L968-L972 HydrophobicContact CD1-CG 3.9Å; L968-L972 HydrophobicContact CG-CD1 4Å; L968-L972 HydrophobicContact CG-CG 4.32Å; L968-L972 VanDerWaalsContact O-CB 3.31Å; L968-L972 WeakPolarHBondContact O-CB 3.18Å; L968-L972 WeakPolarHBondContact O-CG 3.42Å; L968-L972 PolarHBondContact O-N 3.04Å; A970-L972 VanDerWaalsContact C-N 3.33Å; A970-L972 PolarHBondContact O-N 3.3Å; L972-S976 WeakPolarHBondContact O-CB 3.41Å; L972-S976 PolarHBondContact O-N 3.49Å; L972-S976 VanDerWaalsContact O-N 3.07Å; L972-S976 PolarHBondContact O-OG 2.81Å; L972-L981 HydrophobicContact CB-CG 4.41Å; L972-L1165 HydrophobicContact CD1-CD2 3.79Å
973	K	90.6	Very high	90.5	Very high	65 Å²	65	40.2 Å²	40.2	28%	0.283	24%	0.235	S	C	.	.	H	α-helix	trans	-67	-42.4	175.7	-71.3	165.7	-175.2	155.9	0	111.7	S969 A970 D971 G977 K979 Q982	S969-K973 VanDerWaalsContact O-CD 3.29Å; S969-K973 WeakPolarHBondContact O-CD 3.47Å; S969-K973 VanDerWaalsContact O-CG 3.24Å; S969-K973 WeakPolarHBondContact O-CG 3.26Å; S969-K973 PolarHBondContact O-N 2.88Å; S969-K973 PolarHBondContact OG-NZ 3.13Å; A970-K973 PolarHBondContact O-N 3.28Å; D971-K973 PolarHBondContact O-N 3.01Å; K973-G977 WeakPolarHBondContact O-CA 3.47Å; K973-G977 PolarHBondContact O-N 2.82Å; K973-K979 WeakPolarHBondContact CE-O 3.49Å; K973-Q982 VanDerWaalsContact CE-CB 3.47Å
974	T	91.4	Very high	90.4	Very high	122 Å²	122	40.7 Å²	40.7	75%	0.748	24%	0.237	S	C	*	.	H	α-helix	trans	-70.4	-37.3	179.8	-68.1	0	0	0	0	112.5	A970 D971	A970-T974 WeakPolarHBondContact O-CB 3.41Å; A970-T974 PolarHBondContact O-N 3.14Å; A970-T974 PolarHBondContact O-OG1 2.92Å; D971-T974 PolarHBondContact O-N 3.33Å
975	L	92	Very high	89.9	Confident	39 Å²	39	45.6 Å²	45.6	20%	0.204	27%	0.267	C	S	.	.	H	α-helix	trans	-74.6	-38.2	179.1	-69.6	176.4	0	0	0	112.9	V942 K945 L946 L949 D971	V942-L975 HydrophobicContact CB-CB 4.45Å; V942-L975 HydrophobicContact CG1-CB 4.13Å; V942-L975 HydrophobicContact CG1-CD1 4.46Å; V942-L975 HydrophobicContact CG2-CB 4.05Å; K945-L975 HydrophobicContact CB-CD1 4.03Å; K945-L975 HydrophobicContact CB-CD2 3.62Å; K945-L975 HydrophobicContact CB-CG 4.44Å; K945-L975 HydrophobicContact CD-CD2 3.79Å; K945-L975 HydrophobicContact CG-CD2 4.3Å; L946-L975 HydrophobicContact CB-CD1 4.3Å; L946-L975 HydrophobicContact CD1-CD1 4.24Å; L949-L975 HydrophobicContact CD1-CD1 4.03Å; D971-L975 VanDerWaalsContact O-CB 3.29Å; D971-L975 WeakPolarHBondContact O-CB 3.47Å; D971-L975 WeakPolarHBondContact O-CG 3.21Å; D971-L975 PolarHBondContact O-N 3.45Å
976	S	87.7	Confident	89	Confident	21 Å²	21	48.8 Å²	48.8	15%	0.147	29%	0.285	C	S	.	.	H	α-helix	trans	-90	-26.5	-177.5	65.6	0	0	0	0	114.5	L972 D978	L972-S976 WeakPolarHBondContact O-CB 3.41Å; L972-S976 PolarHBondContact O-N 3.49Å; L972-S976 VanDerWaalsContact O-N 3.07Å; L972-S976 PolarHBondContact O-OG 2.81Å; S976-D978 PolarHBondContact O-N 3.39Å; S976-D978 PolarHBondContact OG-N 3.2Å; S976-D978 PolarHBondContact OG-O 2.73Å
977	G	82.2	Confident	87.3	Confident	53 Å²	53	49.5 Å²	49.5	55%	0.546	29%	0.29	S	S	.	.			trans	76.3	-9.5	-165.3	0	0	0	0	0	114.3	K973	K973-G977 WeakPolarHBondContact O-CA 3.47Å; K973-G977 PolarHBondContact O-N 2.82Å
978	D	82.8	Confident	85.3	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.021	31%	0.314	C	S	.	.			trans	-93.5	119.5	-177.6	-172.3	-7.9	0	0	0	111	Y933 S976 S980 L981 P1168	Y933-D978 WeakPolarHBondContact OH-CB 3.29Å; Y933-D978 PolarHBondContact OH-OD2 3.26Å; S976-D978 PolarHBondContact O-N 3.39Å; S976-D978 PolarHBondContact OG-N 3.2Å; S976-D978 PolarHBondContact OG-O 2.73Å; D978-S980 PolarHBondContact O-N 2.9Å; D978-S980 WeakPolarHBondContact OD1-CA 3.36Å; D978-S980 WeakPolarHBondContact OD1-CB 3.36Å; D978-S980 PolarHBondContact OD1-N 3.18Å; D978-S980 PolarHBondContact OD1-OG 3.33Å; D978-L981 HydrophobicContact CB-CB 4.39Å; D978-L981 PolarHBondContact O-N 3.07Å; D978-P1168 WeakPolarHBondContact OD2-CG 3.47Å
979	K	82.1	Confident	83.2	Confident	132 Å²	132	57.2 Å²	57.2	57%	0.574	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-21.6	178.1	-60.5	161.2	-166.7	160.6	0	112.4	K973 A1147	K973-K979 WeakPolarHBondContact CE-O 3.49Å; K979-A1147 PolarHBondContact NZ-O 3.5Å
980	S	84.1	Confident	80.8	Confident	22 Å²	22	64.2 Å²	64.2	15%	0.154	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-19.4	-172.8	-32.8	0	0	0	0	112.4	D978 Q982 S1150 S1166	D978-S980 PolarHBondContact O-N 2.9Å; D978-S980 WeakPolarHBondContact OD1-CA 3.36Å; D978-S980 WeakPolarHBondContact OD1-CB 3.36Å; D978-S980 PolarHBondContact OD1-N 3.18Å; D978-S980 PolarHBondContact OD1-OG 3.33Å; S980-Q982 PolarHBondContact O-N 3.37Å; S980-S1150 WeakPolarHBondContact CB-OG 3.4Å; S980-S1150 PolarHBondContact OG-OG 3.01Å; S980-S1166 PolarHBondContact O-OG 3.39Å
981	L	89.9	Confident	78.8	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	40%	0.401	C	S	.	.	S	Bend	trans	-83.8	98.5	172.8	-174.1	67.1	0	0	0	109.7	I929 Y933 V942 L972 D978 S1166 I1167	I929-L981 HydrophobicContact CG1-CD1 4.33Å; I929-L981 HydrophobicContact CG2-CD2 4.31Å; Y933-L981 HydrophobicContact CD2-CD1 4.04Å; Y933-L981 HydrophobicContact CD2-CD2 4.33Å; Y933-L981 HydrophobicContact CE2-CB 4.35Å; Y933-L981 HydrophobicContact CE2-CD1 4.44Å; Y933-L981 HydrophobicContact CE2-CD2 4.31Å; V942-L981 HydrophobicContact CG1-CD2 4.44Å; L972-L981 HydrophobicContact CB-CG 4.41Å; D978-L981 HydrophobicContact CB-CB 4.39Å; D978-L981 PolarHBondContact O-N 3.07Å; L981-S1166 WeakPolarHBondContact CA-O 3.49Å; L981-I1167 HydrophobicContact CD1-CB 4.19Å; L981-I1167 HydrophobicContact CD1-CG1 3.89Å; L981-I1167 HydrophobicContact CD1-CG2 4.11Å
982	Q	92.3	Very high	76.9	Confident	63 Å²	63	70.6 Å²	70.6	29%	0.294	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	168	-169.8	65.2	174.1	-7	0	0	113.6	K973 S980 L1165 S1166	K973-Q982 VanDerWaalsContact CE-CB 3.47Å; S980-Q982 PolarHBondContact O-N 3.37Å; Q982-L1165 CarbonylContact O-C 3.54Å; Q982-L1165 WeakPolarHBondContact O-CA 3.41Å; Q982-S1166 PolarHBondContact N-O 3.42Å; Q982-S1166 VanDerWaalsContact N-O 3.13Å; Q982-S1166 WeakPolarHBondContact O-CB 3.19Å; Q982-S1166 PolarHBondContact O-N 3.27Å
983	T	92.7	Very high	75	Confident	20 Å²	20	76.8 Å²	76.8	12%	0.123	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	152.2	164.2	51.4	0	0	0	0	111.2	E965 L968 S969 I1163 F1164 L1165	E965-T983 HydrophobicContact CB-CG2 4.41Å; E965-T983 WeakPolarHBondContact O-CG2 3.44Å; E965-T983 PolarHBondContact O-OG1 2.95Å; L968-T983 HydrophobicContact CB-CG2 4.18Å; L968-T983 HydrophobicContact CD2-CG2 3.94Å; L968-T983 HydrophobicContact CG-CG2 4.03Å; S969-T983 VanDerWaalsContact CB-OG1 3.3Å; S969-T983 WeakPolarHBondContact CB-OG1 3.39Å; S969-T983 PolarHBondContact OG-OG1 2.98Å; T983-I1163 HydrophobicContact CG2-CG2 4.2Å; T983-F1164 CarbonylContact C-O 3.59Å; T983-F1164 VanDerWaalsContact CA-O 3.31Å; T983-F1164 WeakPolarHBondContact CA-O 3.41Å; T983-L1165 HydrophobicContact CG2-CD2 3.95Å
984	T	88.7	Confident	73.5	Confident	45 Å²	45	82.9 Å²	82.9	28%	0.276	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	168.8	-177.5	-167.7	0	0	0	0	112.1	V1155 F1164	T984-V1155 HydrophobicContact CG2-CG1 3.83Å; T984-V1155 HydrophobicContact CG2-CG2 4.14Å; T984-F1164 HydrophobicContact CG2-CB 4.01Å; T984-F1164 PolarHBondContact N-O 3.22Å; T984-F1164 WeakPolarHBondContact O-CB 3.39Å
985	T	82.3	Confident	72.5	Confident	102 Å²	102	81.4 Å²	81.4	63%	0.626	47%	0.468	S	S	*	.			trans	-98.6	141.8	174.9	50	0	0	0	0	111.8	T987	T985-T987 PolarHBondContact O-N 3.45Å; T985-T987 PolarHBondContact O-OG1 2.64Å; T985-T987 VanDerWaalsContact O-OG1 3.1Å; T985-T987 PolarHBondContact OG1-OG1 3.44Å
986	N	73.2	Confident	71.7	Confident	116 Å²	116	81.8 Å²	81.8	62%	0.62	47%	0.474	S	S	*	.			trans	-72.5	74.8	173	-176.1	21.6	0	0	0	111.3	F1164	N986-F1164 HydrophobicContact CB-CD1 4.09Å; N986-F1164 HydrophobicContact CB-CD2 3.98Å; N986-F1164 HydrophobicContact CB-CE1 3.76Å; N986-F1164 HydrophobicContact CB-CE2 3.66Å; N986-F1164 HydrophobicContact CB-CG 4.21Å; N986-F1164 HydrophobicContact CB-CZ 3.55Å
987	T	56.3	Low	70.9	Confident	102 Å²	102	84.5 Å²	84.5	63%	0.626	49%	0.491	S	S	*	.			trans	-97.8	115.3	-174.9	-35	0	0	0	0	108.7	T985	T985-T987 PolarHBondContact O-N 3.45Å; T985-T987 PolarHBondContact O-OG1 2.64Å; T985-T987 VanDerWaalsContact O-OG1 3.1Å; T985-T987 PolarHBondContact OG1-OG1 3.44Å
988	P	52.6	Low	70.7	Confident	107 Å²	107	87.9 Å²	87.9	70%	0.695	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-66.2	144	177.5	28	-34.1	0	0	0	110.4	L990	P988-L990 PolarHBondContact O-N 2.81Å
989	A	50.1	Low	70.3	Confident	99 Å²	99	92.2 Å²	92.2	82%	0.818	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-59.3	137.8	175.2	0	0	0	0	0	110.8
990	L	44.8	Very low	70	Confident	162 Å²	162	88.9 Å²	88.9	85%	0.848	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-64.7	143.5	172.7	-69.5	170.5	0	0	0	109.7	P988	P988-L990 PolarHBondContact O-N 2.81Å
991	P	50.3	Low	69.7	Low	105 Å²	105	89.9 Å²	89.9	68%	0.682	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-63.3	143	172.6	28	-34.2	0	0	0	110.1
992	P	54.8	Low	69.2	Low	102 Å²	102	94.5 Å²	94.5	66%	0.662	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-62.5	139.6	179.7	26.4	-34.5	0	0	0	110.8
993	M	54.4	Low	68.5	Low	132 Å²	132	94.8 Å²	94.8	65%	0.65	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-87	123.8	175.8	-69.8	-162.6	-68.1	0	0	110.7	Y995	M993-Y995 HydrophobicContact CB-CE2 4.09Å; M993-Y995 WeakPolarHBondContact CE-OH 3.36Å; M993-Y995 WeakPolarHBondContact O-CD2 3.38Å; M993-Y995 WeakPolarHBondContact O-CE2 3.44Å; M993-Y995 PolarHBondContact O-N 2.79Å
994	E	59.1	Low	67.9	Low	193 Å²	193	94.2 Å²	94.2	90%	0.902	52%	0.522	S	S	*	.			trans	-74.6	112.3	169.7	-64.6	-174.7	156.8	0	0	109.8
995	Y	69.6	Low	67.5	Low	90 Å²	90	96.8 Å²	96.8	35%	0.353	53%	0.529	S	S	.	.			trans	-93.4	156	172	-56.3	-96	0	0	0	110.5	M993 M999 Y1000 L1003	M993-Y995 HydrophobicContact CB-CE2 4.09Å; M993-Y995 WeakPolarHBondContact CE-OH 3.36Å; M993-Y995 WeakPolarHBondContact O-CD2 3.38Å; M993-Y995 WeakPolarHBondContact O-CE2 3.44Å; M993-Y995 PolarHBondContact O-N 2.79Å; Y995-M999 HydrophobicContact CD1-CE 3.86Å; Y995-M999 HydrophobicContact CD1-CG 3.91Å; Y995-M999 HydrophobicContact CD1-SD 4.04Å; Y995-M999 HydrophobicContact CG-CE 4.44Å; Y995-Y1000 AromaticContact CD2-CE1 3.8Å; Y995-Y1000 HydrophobicContact CD2-CE1 3.8Å; Y995-Y1000 AromaticContact CD2-CZ 3.87Å; Y995-Y1000 HydrophobicContact CG-CE1 4.3Å; Y995-Y1000 WeakPolarHBondContact O-CE2 3.37Å; Y995-L1003 HydrophobicContact CD1-CD1 3.76Å; Y995-L1003 HydrophobicContact CE1-CD1 3.76Å; Y995-L1003 HydrophobicContact CG-CD1 4.24Å
996	S	76.6	Confident	67.5	Low	48 Å²	48	98.4 Å²	98.4	34%	0.336	53%	0.533	S	S	.	.			trans	-75.8	157.7	170.9	87.6	0	0	0	0	111.2	E998 M999 Y1000	S996-E998 WeakPolarHBondContact CB-OE2 3.27Å; S996-E998 PolarHBondContact O-N 3.36Å; S996-E998 PolarHBondContact OG-OE2 3.2Å; S996-M999 PolarHBondContact O-N 3.47Å; S996-M999 PolarHBondContact OG-N 2.82Å; S996-Y1000 WeakPolarHBondContact O-CD2 3.32Å; S996-Y1000 PolarHBondContact O-N 3.33Å
997	P	71	Confident	67.9	Low	77 Å²	77	96 Å²	96	50%	0.5	53%	0.525	S	S	.	.	H	α-helix	trans	-54.9	-37.1	177.9	-26.8	36.2	0	0	0	113.6	Y1000 I1001	P997-Y1000 PolarHBondContact O-N 2.89Å; P997-I1001 WeakPolarHBondContact O-CD1 3.32Å; P997-I1001 VanDerWaalsContact O-CG1 3.29Å; P997-I1001 WeakPolarHBondContact O-CG1 3.4Å; P997-I1001 PolarHBondContact O-N 2.87Å
998	E	77.1	Confident	69.5	Low	125 Å²	125	93.1 Å²	93.1	58%	0.584	50%	0.504	S	S	*	.	H	α-helix	trans	-67.7	-39.4	177.1	-51.6	73.3	-159.3	0	0	111.3	S996 I1001 E1002	S996-E998 WeakPolarHBondContact CB-OE2 3.27Å; S996-E998 PolarHBondContact O-N 3.36Å; S996-E998 PolarHBondContact OG-OE2 3.2Å; E998-I1001 WeakPolarHBondContact O-CB 3.28Å; E998-I1001 PolarHBondContact O-N 2.69Å; E998-E1002 PolarHBondContact O-N 2.57Å; E998-E1002 VanDerWaalsContact O-N 3.08Å
999	M	74.1	Confident	71.4	Confident	94 Å²	94	93.2 Å²	93.2	46%	0.463	50%	0.495	S	S	.	.	H	α-helix	trans	-71.6	-35.4	178.1	-171.8	154	47.9	0	0	111.7	Y995 S996 E1002 L1003	Y995-M999 HydrophobicContact CD1-CE 3.86Å; Y995-M999 HydrophobicContact CD1-CG 3.91Å; Y995-M999 HydrophobicContact CD1-SD 4.04Å; Y995-M999 HydrophobicContact CG-CE 4.44Å; S996-M999 PolarHBondContact O-N 3.47Å; S996-M999 PolarHBondContact OG-N 2.82Å; M999-E1002 PolarHBondContact O-N 2.74Å; M999-L1003 HydrophobicContact CG-CD1 4.32Å; M999-L1003 WeakPolarHBondContact O-CB 3.33Å; M999-L1003 VanDerWaalsContact O-CG 3.25Å; M999-L1003 WeakPolarHBondContact O-CG 3.45Å; M999-L1003 PolarHBondContact O-N 3.32Å
1000	Y	75.9	Confident	73.5	Confident	63 Å²	63	89.8 Å²	89.8	25%	0.247	46%	0.464	C	S	.	.	H	α-helix	trans	-60.8	-43.3	166.9	-77.7	-65.4	0	0	0	112.1	Y995 S996 P997 E1002 L1003 I1004 I1034	Y995-Y1000 AromaticContact CD2-CE1 3.8Å; Y995-Y1000 HydrophobicContact CD2-CE1 3.8Å; Y995-Y1000 AromaticContact CD2-CZ 3.87Å; Y995-Y1000 HydrophobicContact CG-CE1 4.3Å; Y995-Y1000 WeakPolarHBondContact O-CE2 3.37Å; S996-Y1000 WeakPolarHBondContact O-CD2 3.32Å; S996-Y1000 PolarHBondContact O-N 3.33Å; P997-Y1000 PolarHBondContact O-N 2.89Å; Y1000-E1002 PolarHBondContact O-N 2.68Å; Y1000-L1003 PolarHBondContact O-N 3.09Å; Y1000-I1004 WeakPolarHBondContact O-CB 3.39Å; Y1000-I1004 WeakPolarHBondContact O-CD1 3.33Å; Y1000-I1004 WeakPolarHBondContact O-CG1 3.39Å; Y1000-I1004 PolarHBondContact O-N 3.38Å; Y1000-I1034 HydrophobicContact CD1-CD1 3.89Å; Y1000-I1034 HydrophobicContact CD1-CG2 3.94Å; Y1000-I1034 HydrophobicContact CD2-CG2 4.05Å; Y1000-I1034 HydrophobicContact CE1-CD1 4.17Å; Y1000-I1034 HydrophobicContact CE1-CG2 4.2Å; Y1000-I1034 HydrophobicContact CE2-CG2 4.29Å; Y1000-I1034 HydrophobicContact CG-CG2 3.87Å
1001	I	77.4	Confident	75.8	Confident	42 Å²	42	85.8 Å²	85.8	22%	0.215	44%	0.443	C	S	.	.	H	α-helix	trans	-59.4	-45.5	178	-73.7	162.7	0	0	0	111.5	P997 E998 K1005 I1037	P997-I1001 WeakPolarHBondContact O-CD1 3.32Å; P997-I1001 VanDerWaalsContact O-CG1 3.29Å; P997-I1001 WeakPolarHBondContact O-CG1 3.4Å; P997-I1001 PolarHBondContact O-N 2.87Å; E998-I1001 WeakPolarHBondContact O-CB 3.28Å; E998-I1001 PolarHBondContact O-N 2.69Å; I1001-K1005 HydrophobicContact CG2-CD 4.26Å; I1001-K1005 VanDerWaalsContact CG2-CE 3.46Å; I1001-K1005 VanDerWaalsContact O-CG 3.3Å; I1001-K1005 WeakPolarHBondContact O-CG 3.13Å; I1001-K1005 PolarHBondContact O-N 2.89Å; I1001-K1005 VanDerWaalsContact O-N 3.12Å; I1001-I1037 HydrophobicContact CD1-CG2 4.49Å; I1001-I1037 HydrophobicContact CG1-CD1 4.49Å; I1001-I1037 HydrophobicContact CG1-CG2 3.5Å; I1001-I1037 VanDerWaalsContact CG1-CG2 3.5Å
1002	E	79.3	Confident	77.9	Confident	98 Å²	98	83.7 Å²	83.7	46%	0.458	43%	0.429	S	S	.	.	H	α-helix	trans	-69.8	-40.4	177.9	-64.4	-50.4	122.4	0	0	112.5	E998 M999 Y1000 I1004 K1005 I1006	E998-E1002 PolarHBondContact O-N 2.57Å; E998-E1002 VanDerWaalsContact O-N 3.08Å; M999-E1002 PolarHBondContact O-N 2.74Å; Y1000-E1002 PolarHBondContact O-N 2.68Å; E1002-I1004 PolarHBondContact O-N 3.01Å; E1002-K1005 PolarHBondContact O-N 3.19Å; E1002-K1005 IonicContact OE1-NZ 3.55Å; E1002-K1005 PolarHBondContact OE1-NZ 3.48Å; E1002-K1005 IonicContact OE2-NZ 2.74Å; E1002-I1006 VanDerWaalsContact O-CG1 3.31Å; E1002-I1006 WeakPolarHBondContact O-CG1 3.47Å; E1002-I1006 PolarHBondContact O-N 3.04Å; E1002-I1006 VanDerWaalsContact O-N 3.11Å
1003	L	78.3	Confident	79.7	Confident	69 Å²	69	80.8 Å²	80.8	36%	0.361	41%	0.406	S	S	.	.	H	α-helix	trans	-59.5	-44.5	173.7	-73.7	168.8	0	0	0	111.7	Y995 M999 Y1000 K1005 I1006 S1007	Y995-L1003 HydrophobicContact CD1-CD1 3.76Å; Y995-L1003 HydrophobicContact CE1-CD1 3.76Å; Y995-L1003 HydrophobicContact CG-CD1 4.24Å; M999-L1003 HydrophobicContact CG-CD1 4.32Å; M999-L1003 WeakPolarHBondContact O-CB 3.33Å; M999-L1003 VanDerWaalsContact O-CG 3.25Å; M999-L1003 WeakPolarHBondContact O-CG 3.45Å; M999-L1003 PolarHBondContact O-N 3.32Å; Y1000-L1003 PolarHBondContact O-N 3.09Å; L1003-K1005 VanDerWaalsContact C-N 3.35Å; L1003-K1005 PolarHBondContact O-N 2.95Å; L1003-I1006 PolarHBondContact O-N 3.37Å; L1003-I1006 VanDerWaalsContact O-N 3.16Å; L1003-S1007 WeakPolarHBondContact O-CB 3.45Å; L1003-S1007 PolarHBondContact O-N 3.3Å; L1003-S1007 PolarHBondContact O-OG 3.34Å
1004	I	81.1	Confident	81.2	Confident	8 Å²	8	81.7 Å²	81.7	4%	0.041	41%	0.408	C	S	.	.	H	α-helix	trans	-60.7	-42.1	176.9	-70.7	161.8	0	0	0	111.2	Y1000 E1002 I1006 F1008 I1034 I1037 I1038 I1042	Y1000-I1004 WeakPolarHBondContact O-CB 3.39Å; Y1000-I1004 WeakPolarHBondContact O-CD1 3.33Å; Y1000-I1004 WeakPolarHBondContact O-CG1 3.39Å; Y1000-I1004 PolarHBondContact O-N 3.38Å; E1002-I1004 PolarHBondContact O-N 3.01Å; I1004-I1006 VanDerWaalsContact C-N 3.27Å; I1004-I1006 PolarHBondContact O-N 3.25Å; I1004-F1008 HydrophobicContact CG2-CD2 4.22Å; I1004-F1008 WeakPolarHBondContact O-CB 3.46Å; I1004-F1008 PolarHBondContact O-N 3.02Å; I1004-F1008 VanDerWaalsContact O-N 3.07Å; I1004-I1034 HydrophobicContact CD1-CD1 4.34Å; I1004-I1037 HydrophobicContact CD1-CB 3.99Å; I1004-I1037 HydrophobicContact CD1-CG2 3.64Å; I1004-I1038 HydrophobicContact CD1-CG1 3.67Å; I1004-I1038 HydrophobicContact CG1-CG1 3.99Å; I1004-I1038 HydrophobicContact CG2-CG1 4.16Å; I1004-I1042 HydrophobicContact CG2-CD1 4.05Å; I1004-I1042 HydrophobicContact CG2-CG1 3.56Å
1005	K	79	Confident	82.6	Confident	98 Å²	98	76.2 Å²	76.2	43%	0.426	39%	0.385	S	S	.	.	H	α-helix	trans	-65.2	-27.3	176.9	-71.7	166.9	-175	170.1	0	113.7	I1001 E1002 L1003	I1001-K1005 HydrophobicContact CG2-CD 4.26Å; I1001-K1005 VanDerWaalsContact CG2-CE 3.46Å; I1001-K1005 VanDerWaalsContact O-CG 3.3Å; I1001-K1005 WeakPolarHBondContact O-CG 3.13Å; I1001-K1005 PolarHBondContact O-N 2.89Å; I1001-K1005 VanDerWaalsContact O-N 3.12Å; E1002-K1005 PolarHBondContact O-N 3.19Å; E1002-K1005 IonicContact OE1-NZ 3.55Å; E1002-K1005 PolarHBondContact OE1-NZ 3.48Å; E1002-K1005 IonicContact OE2-NZ 2.74Å; L1003-K1005 VanDerWaalsContact C-N 3.35Å; L1003-K1005 PolarHBondContact O-N 2.95Å
1006	I	81.8	Confident	83.7	Confident	136 Å²	136	74.9 Å²	74.9	70%	0.697	38%	0.384	S	S	*	.	H	α-helix	trans	-86.4	-41.7	179.7	-66.7	166.1	0	0	0	110.6	E1002 L1003 I1004	E1002-I1006 VanDerWaalsContact O-CG1 3.31Å; E1002-I1006 WeakPolarHBondContact O-CG1 3.47Å; E1002-I1006 PolarHBondContact O-N 3.04Å; E1002-I1006 VanDerWaalsContact O-N 3.11Å; L1003-I1006 PolarHBondContact O-N 3.37Å; L1003-I1006 VanDerWaalsContact O-N 3.16Å; I1004-I1006 VanDerWaalsContact C-N 3.27Å; I1004-I1006 PolarHBondContact O-N 3.25Å
1007	S	83.4	Confident	84.6	Confident	66 Å²	66	72.6 Å²	72.6	46%	0.462	37%	0.368	S	S	.	.	H	α-helix	trans	-75.3	-24.4	-178.4	-62.5	0	0	0	0	114.4	L1003 F1022	L1003-S1007 WeakPolarHBondContact O-CB 3.45Å; L1003-S1007 PolarHBondContact O-N 3.3Å; L1003-S1007 PolarHBondContact O-OG 3.34Å; S1007-F1022 WeakPolarHBondContact O-CA 3.44Å; S1007-F1022 WeakPolarHBondContact O-CB 3.32Å
1008	F	89.4	Confident	85.8	Confident	42 Å²	42	69 Å²	69	18%	0.184	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	119.3	-179.7	-68.4	-89.6	0	0	0	111.8	I1004 L1020 R1021 F1022 I1042	I1004-F1008 HydrophobicContact CG2-CD2 4.22Å; I1004-F1008 WeakPolarHBondContact O-CB 3.46Å; I1004-F1008 PolarHBondContact O-N 3.02Å; I1004-F1008 VanDerWaalsContact O-N 3.07Å; F1008-L1020 HydrophobicContact CD1-CD1 4.17Å; F1008-R1021 WeakPolarHBondContact CA-O 3.36Å; F1008-F1022 HydrophobicContact CD1-CB 3.52Å; F1008-F1022 HydrophobicContact CD1-CD1 4.33Å; F1008-F1022 HydrophobicContact CD1-CG 4.04Å; F1008-F1022 HydrophobicContact CE1-CB 3.58Å; F1008-F1022 HydrophobicContact CE1-CD1 4.09Å; F1008-F1022 HydrophobicContact CE1-CD2 4.15Å; F1008-F1022 AromaticContact CE1-CG 3.69Å; F1008-F1022 HydrophobicContact CE1-CG 3.69Å; F1008-F1022 HydrophobicContact CG-CB 4.24Å; F1008-F1022 HydrophobicContact CZ-CB 4.36Å; F1008-I1042 HydrophobicContact CB-CB 4.47Å; F1008-I1042 HydrophobicContact CB-CD1 3.59Å; F1008-I1042 HydrophobicContact CB-CG1 3.78Å; F1008-I1042 HydrophobicContact CB-CG2 3.82Å; F1008-I1042 HydrophobicContact CD1-CG2 4.15Å; F1008-I1042 HydrophobicContact CD2-CG1 4.49Å; F1008-I1042 HydrophobicContact CG-CG1 4.2Å; F1008-I1042 HydrophobicContact CG-CG2 4.13Å
1009	H	92.6	Very high	86.8	Confident	109 Å²	109	63.9 Å²	63.9	51%	0.505	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	130.7	172.5	-179	99.5	0	0	0	110.4	Y1019 R1021	H1009-Y1019 AromaticContact CD2-CD1 3.9Å; H1009-Y1019 AromaticContact CD2-CE1 3.61Å; H1009-R1021 HydrophobicContact CB-CB 4.36Å; H1009-R1021 PolarHBondContact N-O 2.89Å; H1009-R1021 PolarHBondContact O-N 3.23Å
1010	T	93.5	Very high	87.8	Confident	26 Å²	26	59.5 Å²	59.5	16%	0.16	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	137.1	-178.2	53.3	0	0	0	0	112.1	Y1019 L1020 I1042 K1045 V1046	T1010-Y1019 VanDerWaalsContact CA-O 3.27Å; T1010-Y1019 WeakPolarHBondContact CA-O 3.46Å; T1010-L1020 HydrophobicContact CG2-CD1 3.75Å; T1010-I1042 HydrophobicContact CG2-CG2 3.57Å; T1010-K1045 VanDerWaalsContact OG1-CD 3.28Å; T1010-K1045 WeakPolarHBondContact OG1-CD 3.21Å; T1010-V1046 HydrophobicContact CG2-CG1 4.15Å
1011	D	93.8	Very high	88.8	Confident	78 Å²	78	60 Å²	60	42%	0.417	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	167.8	173.6	-162.7	8.4	0	0	0	110.8	F1013 Y1019	D1011-F1013 HydrophobicContact CB-CE1 4.09Å; D1011-F1013 VanDerWaalsContact OD2-CE1 3.26Å; D1011-F1013 WeakPolarHBondContact OD2-CE1 3.42Å; D1011-Y1019 HydrophobicContact CB-CD1 4.07Å; D1011-Y1019 PolarHBondContact N-O 3.49Å; D1011-Y1019 VanDerWaalsContact N-O 3.11Å; D1011-Y1019 PolarHBondContact O-N 3.19Å
1012	V	93.8	Very high	89.5	Confident	62 Å²	62	58.4 Å²	58.4	38%	0.376	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	106.1	172.1	-178.5	0	0	0	0	109.2	I1017 T1049	V1012-I1017 CarbonylContact C-O 3.52Å; V1012-I1017 WeakPolarHBondContact CA-O 3.33Å; V1012-T1049 HydrophobicContact CG1-CG2 4.15Å; V1012-T1049 HydrophobicContact CG2-CG2 4.04Å
1013	F	92.4	Very high	90	Very high	41 Å²	41	56.3 Å²	56.3	18%	0.18	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	174.7	178.7	-50.9	-43.7	0	0	0	112.3	D1011 N1016 I1017 Y1019 I1053 L1197 K1201	D1011-F1013 HydrophobicContact CB-CE1 4.09Å; D1011-F1013 VanDerWaalsContact OD2-CE1 3.26Å; D1011-F1013 WeakPolarHBondContact OD2-CE1 3.42Å; F1013-N1016 PolarHBondContact O-N 3.23Å; F1013-I1017 HydrophobicContact CB-CB 4.35Å; F1013-I1017 HydrophobicContact CD2-CG2 4.34Å; F1013-I1017 PolarHBondContact N-O 3.02Å; F1013-I1017 PolarHBondContact O-N 3.03Å; F1013-Y1019 AromaticContact CE2-CD2 3.91Å; F1013-Y1019 HydrophobicContact CE2-CD2 3.91Å; F1013-Y1019 AromaticContact CE2-CG 3.81Å; F1013-Y1019 HydrophobicContact CE2-CG 3.81Å; F1013-Y1019 AromaticContact CZ-CD1 3.91Å; F1013-Y1019 HydrophobicContact CZ-CD1 3.91Å; F1013-Y1019 AromaticContact CZ-CD2 3.94Å; F1013-Y1019 HydrophobicContact CZ-CD2 3.94Å; F1013-Y1019 AromaticContact CZ-CG 3.57Å; F1013-Y1019 HydrophobicContact CZ-CG 3.57Å; F1013-I1053 HydrophobicContact CE2-CD1 4.34Å; F1013-L1197 HydrophobicContact CE2-CD1 4.09Å; F1013-L1197 HydrophobicContact CZ-CD1 4.42Å; F1013-K1201 HydrophobicContact CD2-CD 4.36Å; F1013-K1201 HydrophobicContact CD2-CG 4.1Å; F1013-K1201 HydrophobicContact CE2-CD 4.42Å; F1013-K1201 HydrophobicContact CE2-CG 4.3Å
1014	E	86.8	Confident	90.5	Very high	151 Å²	151	58.4 Å²	58.4	71%	0.706	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-46.4	152.4	172.6	-61.1	-176.6	164.7	0	0	113	N1016 I1017	E1014-N1016 PolarHBondContact O-N 2.92Å; E1014-I1017 WeakPolarHBondContact O-CD1 3.4Å; E1014-I1017 WeakPolarHBondContact O-CG1 3.37Å
1015	N	88.1	Confident	90.8	Very high	77 Å²	77	58.6 Å²	58.6	41%	0.412	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	60	19.7	-173.6	-55.9	-57.6	0	0	0	115.2	N1050 N1205 L1208	N1015-N1050 PolarHBondContact O-ND2 2.84Å; N1015-N1205 PolarHBondContact ND2-OD1 3.23Å; N1015-L1208 HydrophobicContact CB-CD1 4.12Å
1016	N	92.8	Very high	90.9	Very high	62 Å²	62	55.3 Å²	55.3	33%	0.332	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	61.2	49.7	-179.6	-172.4	34.8	0	0	0	111.7	F1013 E1014 N1048 T1049 N1050	F1013-N1016 PolarHBondContact O-N 3.23Å; E1014-N1016 PolarHBondContact O-N 2.92Å; N1016-N1048 PolarHBondContact ND2-O 2.93Å; N1016-T1049 WeakPolarHBondContact ND2-CA 3.47Å; N1016-T1049 WeakPolarHBondContact O-CB 3.37Å; N1016-N1050 HydrophobicContact CB-CB 4.48Å; N1016-N1050 PolarHBondContact ND2-N 2.68Å; N1016-N1050 PolarHBondContact ND2-OD1 3.4Å; N1016-N1050 PolarHBondContact O-N 2.91Å
1017	I	95.8	Very high	90.8	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	116.5	175.4	-62.8	166	0	0	0	109	V1012 F1013 E1014 A1051 I1053 L1204 N1205 L1208	V1012-I1017 CarbonylContact C-O 3.52Å; V1012-I1017 WeakPolarHBondContact CA-O 3.33Å; F1013-I1017 HydrophobicContact CB-CB 4.35Å; F1013-I1017 HydrophobicContact CD2-CG2 4.34Å; F1013-I1017 PolarHBondContact N-O 3.02Å; F1013-I1017 PolarHBondContact O-N 3.03Å; E1014-I1017 WeakPolarHBondContact O-CD1 3.4Å; E1014-I1017 WeakPolarHBondContact O-CG1 3.37Å; I1017-A1051 CarbonylContact C-O 3.4Å; I1017-A1051 WeakPolarHBondContact CA-O 3.47Å; I1017-I1053 HydrophobicContact CG2-CD1 4.15Å; I1017-I1053 HydrophobicContact CG2-CG1 4.17Å; I1017-L1204 HydrophobicContact CD1-CB 3.6Å; I1017-L1204 HydrophobicContact CD1-CD1 4.44Å; I1017-L1204 HydrophobicContact CG1-CB 4.28Å; I1017-L1204 HydrophobicContact CG2-CD1 3.7Å; I1017-N1205 WeakPolarHBondContact CD1-OD1 3.49Å; I1017-L1208 HydrophobicContact CD1-CD1 4.14Å; I1017-L1208 HydrophobicContact CG1-CD1 3.72Å
1018	G	96.3	Very high	90.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	147.6	175.2	0	0	0	0	0	112.9	T1049 A1051 M1052 I1053	G1018-T1049 VanDerWaalsContact CA-CG2 3.48Å; G1018-A1051 PolarHBondContact N-O 2.78Å; G1018-M1052 CarbonylContact O-C 3.42Å; G1018-M1052 VanDerWaalsContact O-CA 3.31Å; G1018-M1052 WeakPolarHBondContact O-CA 3.28Å; G1018-I1053 PolarHBondContact O-N 3.46Å
1019	Y	97.3	Very high	90.3	Very high	19 Å²	19	53.6 Å²	53.6	8%	0.075	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.8	173.4	178.4	-115.4	0	0	0	109.6	H1009 T1010 D1011 F1013 R1021 I1053 D1055 L1197	H1009-Y1019 AromaticContact CD2-CD1 3.9Å; H1009-Y1019 AromaticContact CD2-CE1 3.61Å; T1010-Y1019 VanDerWaalsContact CA-O 3.27Å; T1010-Y1019 WeakPolarHBondContact CA-O 3.46Å; D1011-Y1019 HydrophobicContact CB-CD1 4.07Å; D1011-Y1019 PolarHBondContact N-O 3.49Å; D1011-Y1019 VanDerWaalsContact N-O 3.11Å; D1011-Y1019 PolarHBondContact O-N 3.19Å; F1013-Y1019 AromaticContact CE2-CD2 3.91Å; F1013-Y1019 HydrophobicContact CE2-CD2 3.91Å; F1013-Y1019 AromaticContact CE2-CG 3.81Å; F1013-Y1019 HydrophobicContact CE2-CG 3.81Å; F1013-Y1019 AromaticContact CZ-CD1 3.91Å; F1013-Y1019 HydrophobicContact CZ-CD1 3.91Å; F1013-Y1019 AromaticContact CZ-CD2 3.94Å; F1013-Y1019 HydrophobicContact CZ-CD2 3.94Å; F1013-Y1019 AromaticContact CZ-CG 3.57Å; F1013-Y1019 HydrophobicContact CZ-CG 3.57Å; Y1019-R1021 HydrophobicContact CE1-CB 4.4Å; Y1019-I1053 WeakPolarHBondContact CA-O 3.34Å; Y1019-I1053 HydrophobicContact CD2-CB 4.2Å; Y1019-I1053 HydrophobicContact CD2-CG2 4.12Å; Y1019-I1053 HydrophobicContact CE2-CG2 4.42Å; Y1019-D1055 HydrophobicContact CE2-CB 3.75Å; Y1019-D1055 PolarHBondContact OH-OD2 3.28Å; Y1019-L1197 HydrophobicContact CD2-CD1 4.09Å; Y1019-L1197 HydrophobicContact CE2-CD1 3.77Å; Y1019-L1197 HydrophobicContact CE2-CD2 4.4Å
1020	L	96.1	Very high	89.6	Confident	2 Å²	2	54 Å²	54	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	110.4	180	176.3	64.2	0	0	0	109.3	F1008 T1010 F1022 I1042 W1043 M1052 I1053 I1054 D1055 F1070	F1008-L1020 HydrophobicContact CD1-CD1 4.17Å; T1010-L1020 HydrophobicContact CG2-CD1 3.75Å; L1020-F1022 HydrophobicContact CG-CD1 4.38Å; L1020-I1042 HydrophobicContact CD1-CG2 3.8Å; L1020-W1043 HydrophobicContact CD2-CZ3 4.27Å; L1020-M1052 HydrophobicContact CB-SD 4.41Å; L1020-I1053 PolarHBondContact N-O 2.99Å; L1020-I1054 CarbonylContact O-C 3.53Å; L1020-I1054 VanDerWaalsContact O-CA 3.3Å; L1020-I1054 WeakPolarHBondContact O-CA 3.44Å; L1020-D1055 PolarHBondContact O-N 3.49Å; L1020-F1070 HydrophobicContact CD2-CE2 4.47Å; L1020-F1070 HydrophobicContact CD2-CZ 4.15Å
1021	R	95.2	Very high	88.8	Confident	74 Å²	74	54.9 Å²	54.9	28%	0.279	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	139.4	170.8	178.3	175.5	157.1	-156.9	-10.7	110.2	F1008 H1009 Y1019 D1023 D1055 N1058	F1008-R1021 WeakPolarHBondContact CA-O 3.36Å; H1009-R1021 HydrophobicContact CB-CB 4.36Å; H1009-R1021 PolarHBondContact N-O 2.89Å; H1009-R1021 PolarHBondContact O-N 3.23Å; Y1019-R1021 HydrophobicContact CE1-CB 4.4Å; R1021-D1023 IonicContact CZ-OD1 2.69Å; R1021-D1023 IonicContact CZ-OD2 2.9Å; R1021-D1023 IonicContact NE-OD1 2.74Å; R1021-D1023 PolarHBondContact NE-OD1 3.12Å; R1021-D1023 IonicContact NE-OD2 3.98Å; R1021-D1023 IonicContact NH2-OD1 3.82Å; R1021-D1023 PolarHBondContact NH2-OD1 2.83Å; R1021-D1023 IonicContact NH2-OD2 3.71Å; R1021-D1023 PolarHBondContact NH2-OD2 3.29Å; R1021-D1055 HydrophobicContact CB-CB 3.95Å; R1021-D1055 HydrophobicContact CG-CB 4.17Å; R1021-N1058 PolarHBondContact NH2-ND2 3.41Å
1022	F	93.1	Very high	88.2	Confident	7 Å²	7	56.2 Å²	56.2	3%	0.031	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	146.8	166.5	63.3	-78.4	0	0	0	109.4	S1007 F1008 L1020 M1024 F1025 I1054 L1056 N1059 F1070	S1007-F1022 WeakPolarHBondContact O-CA 3.44Å; S1007-F1022 WeakPolarHBondContact O-CB 3.32Å; F1008-F1022 HydrophobicContact CD1-CB 3.52Å; F1008-F1022 HydrophobicContact CD1-CD1 4.33Å; F1008-F1022 HydrophobicContact CD1-CG 4.04Å; F1008-F1022 HydrophobicContact CE1-CB 3.58Å; F1008-F1022 HydrophobicContact CE1-CD1 4.09Å; F1008-F1022 HydrophobicContact CE1-CD2 4.15Å; F1008-F1022 AromaticContact CE1-CG 3.69Å; F1008-F1022 HydrophobicContact CE1-CG 3.69Å; F1008-F1022 HydrophobicContact CG-CB 4.24Å; F1008-F1022 HydrophobicContact CZ-CB 4.36Å; L1020-F1022 HydrophobicContact CG-CD1 4.38Å; F1022-M1024 WeakPolarHBondContact CD2-O 3.36Å; F1022-F1025 HydrophobicContact CE2-CD1 4.45Å; F1022-F1025 AromaticContact CE2-CD2 3.91Å; F1022-F1025 HydrophobicContact CE2-CD2 3.91Å; F1022-F1025 HydrophobicContact CE2-CE1 4.2Å; F1022-F1025 AromaticContact CE2-CE2 3.62Å; F1022-F1025 HydrophobicContact CE2-CE2 3.62Å; F1022-F1025 HydrophobicContact CE2-CG 4.32Å; F1022-F1025 AromaticContact CE2-CZ 3.78Å; F1022-F1025 HydrophobicContact CE2-CZ 3.78Å; F1022-F1025 HydrophobicContact CZ-CE1 4.33Å; F1022-F1025 AromaticContact CZ-CE2 3.99Å; F1022-F1025 HydrophobicContact CZ-CE2 3.99Å; F1022-F1025 AromaticContact CZ-CZ 3.79Å; F1022-F1025 HydrophobicContact CZ-CZ 3.79Å; F1022-I1054 HydrophobicContact CE1-CG2 3.98Å; F1022-L1056 HydrophobicContact CD1-CD2 4.23Å; F1022-L1056 HydrophobicContact CE1-CD2 3.67Å; F1022-L1056 HydrophobicContact CE2-CD2 4.15Å; F1022-L1056 HydrophobicContact CZ-CD2 3.63Å; F1022-N1059 WeakPolarHBondContact CD2-ND2 3.49Å; F1022-N1059 WeakPolarHBondContact CE2-ND2 3.4Å; F1022-N1059 PolarHBondContact O-ND2 3.16Å; F1022-F1070 AromaticContact CE1-CE1 3.77Å; F1022-F1070 HydrophobicContact CE1-CE1 3.77Å; F1022-F1070 HydrophobicContact CE1-CE2 4.42Å; F1022-F1070 AromaticContact CE1-CZ 3.53Å; F1022-F1070 HydrophobicContact CE1-CZ 3.53Å; F1022-F1070 HydrophobicContact CZ-CD1 4.22Å; F1022-F1070 AromaticContact CZ-CE1 3.53Å; F1022-F1070 HydrophobicContact CZ-CE1 3.53Å; F1022-F1070 HydrophobicContact CZ-CE2 4.48Å; F1022-F1070 AromaticContact CZ-CZ 3.69Å; F1022-F1070 HydrophobicContact CZ-CZ 3.69Å
1023	D	89.9	Confident	87.6	Confident	54 Å²	54	58.1 Å²	58.1	29%	0.289	29%	0.293	S	S	.	.	S	Bend	trans	-108.7	-1.2	-166.4	-61.9	-14.8	0	0	0	114.1	R1021 N1059 L1060	R1021-D1023 IonicContact CZ-OD1 2.69Å; R1021-D1023 IonicContact CZ-OD2 2.9Å; R1021-D1023 IonicContact NE-OD1 2.74Å; R1021-D1023 PolarHBondContact NE-OD1 3.12Å; R1021-D1023 IonicContact NE-OD2 3.98Å; R1021-D1023 IonicContact NH2-OD1 3.82Å; R1021-D1023 PolarHBondContact NH2-OD1 2.83Å; R1021-D1023 IonicContact NH2-OD2 3.71Å; R1021-D1023 PolarHBondContact NH2-OD2 3.29Å; D1023-N1059 VanDerWaalsContact C-CG 3.5Å; D1023-N1059 VanDerWaalsContact O-CA 3.28Å; D1023-N1059 WeakPolarHBondContact O-CA 3.39Å; D1023-L1060 PolarHBondContact O-N 3.28Å; D1023-L1060 VanDerWaalsContact O-N 3.07Å
1024	M	87.8	Confident	87.2	Confident	114 Å²	114	57.2 Å²	57.2	56%	0.562	29%	0.29	S	S	*	.			trans	-148.4	145.7	177.4	-74.8	-74.9	-69.5	0	0	111.2	F1022 N1059 L1060 G1061	F1022-M1024 WeakPolarHBondContact CD2-O 3.36Å; M1024-N1059 PolarHBondContact N-ND2 2.89Å; M1024-L1060 HydrophobicContact SD-CB 4.11Å; M1024-G1061 CarbonylContact C-O 3.57Å; M1024-G1061 WeakPolarHBondContact CA-O 3.36Å
1025	F	87.2	Confident	87.1	Confident	11 Å²	11	50.7 Å²	50.7	5%	0.048	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-89.2	140	161.6	-75.9	-106	0	0	0	109.7	F1022 G1061 P1063 I1067 F1070 A1125 A1126 F1129	F1022-F1025 HydrophobicContact CE2-CD1 4.45Å; F1022-F1025 AromaticContact CE2-CD2 3.91Å; F1022-F1025 HydrophobicContact CE2-CD2 3.91Å; F1022-F1025 HydrophobicContact CE2-CE1 4.2Å; F1022-F1025 AromaticContact CE2-CE2 3.62Å; F1022-F1025 HydrophobicContact CE2-CE2 3.62Å; F1022-F1025 HydrophobicContact CE2-CG 4.32Å; F1022-F1025 AromaticContact CE2-CZ 3.78Å; F1022-F1025 HydrophobicContact CE2-CZ 3.78Å; F1022-F1025 HydrophobicContact CZ-CE1 4.33Å; F1022-F1025 AromaticContact CZ-CE2 3.99Å; F1022-F1025 HydrophobicContact CZ-CE2 3.99Å; F1022-F1025 AromaticContact CZ-CZ 3.79Å; F1022-F1025 HydrophobicContact CZ-CZ 3.79Å; F1025-G1061 PolarHBondContact N-O 3.03Å; F1025-P1063 VanDerWaalsContact O-CD 3.31Å; F1025-P1063 WeakPolarHBondContact O-CD 3.27Å; F1025-I1067 HydrophobicContact CD1-CG1 4.48Å; F1025-I1067 HydrophobicContact CE1-CG1 4.38Å; F1025-F1070 HydrophobicContact CE1-CD1 4.09Å; F1025-F1070 HydrophobicContact CZ-CD1 4.38Å; F1025-A1125 HydrophobicContact CB-CB 4.24Å; F1025-A1125 HydrophobicContact CD2-CB 4.26Å; F1025-A1125 HydrophobicContact CG-CB 4.14Å; F1025-A1126 HydrophobicContact CD2-CB 4.33Å; F1025-A1126 HydrophobicContact CE2-CB 3.79Å; F1025-F1129 HydrophobicContact CE1-CB 4.5Å; F1025-F1129 HydrophobicContact CZ-CB 3.94Å; F1025-F1129 HydrophobicContact CZ-CD1 4.46Å; F1025-F1129 HydrophobicContact CZ-CG 4.11Å
1026	G	81.4	Confident	87.1	Confident	30 Å²	30	51.6 Å²	51.6	31%	0.309	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-97.8	170.6	171.3	0	0	0	0	0	112	A1066	G1026-A1066 WeakPolarHBondContact O-CB 3.45Å
1027	D	81.1	Confident	86.8	Confident	41 Å²	41	50.1 Å²	50.1	22%	0.219	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-71.5	144.2	171.9	-174.4	-94	0	0	0	111.7	E1029 E1030 V1031 P1063 T1065	D1027-E1029 PolarHBondContact O-N 3.21Å; D1027-E1029 PolarHBondContact OD1-N 3.43Å; D1027-E1030 HydrophobicContact CB-CB 4.24Å; D1027-E1030 HydrophobicContact CB-CG 4.07Å; D1027-E1030 PolarHBondContact O-N 3.14Å; D1027-V1031 VanDerWaalsContact O-CB 3.31Å; D1027-V1031 WeakPolarHBondContact O-CB 3.43Å; D1027-V1031 VanDerWaalsContact O-CG2 3.23Å; D1027-V1031 WeakPolarHBondContact O-CG2 3.29Å; D1027-V1031 PolarHBondContact O-N 3.04Å; D1027-P1063 HydrophobicContact CB-CB 4.15Å; D1027-P1063 HydrophobicContact CB-CG 4.01Å; D1027-T1065 WeakPolarHBondContact OD2-CB 3.35Å; D1027-T1065 WeakPolarHBondContact OD2-CG2 3.47Å; D1027-T1065 PolarHBondContact OD2-OG1 3.22Å
1028	F	81.4	Confident	86.5	Confident	58 Å²	58	51.4 Å²	51.4	25%	0.254	26%	0.262	S	S	.	.	H	α-helix	trans	-60.7	-42.4	-178.9	-174.3	-107.7	0	0	0	113.8	E1030 V1031 K1032 T1065 A1066 L1100	F1028-E1030 VanDerWaalsContact C-N 3.33Å; F1028-V1031 PolarHBondContact O-N 3.34Å; F1028-K1032 HydrophobicContact CD1-CD 4.43Å; F1028-K1032 HydrophobicContact CE1-CD 4Å; F1028-K1032 WeakPolarHBondContact O-CB 3.42Å; F1028-K1032 PolarHBondContact O-N 2.88Å; F1028-T1065 PolarHBondContact N-OG1 2.84Å; F1028-T1065 VanDerWaalsContact N-OG1 3.1Å; F1028-A1066 HydrophobicContact CB-CB 4.46Å; F1028-L1100 HydrophobicContact CE2-CD1 3.82Å; F1028-L1100 HydrophobicContact CZ-CD1 3.59Å
1029	E	79.4	Confident	86.2	Confident	109 Å²	109	51.7 Å²	51.7	51%	0.509	26%	0.264	S	S	.	.	H	α-helix	trans	-77.6	-20	-178.8	-65.8	-64	133.2	0	0	112.4	D1027 K1032 P1033	D1027-E1029 PolarHBondContact O-N 3.21Å; D1027-E1029 PolarHBondContact OD1-N 3.43Å; E1029-K1032 WeakPolarHBondContact OE1-CD 3.46Å; E1029-K1032 IonicContact OE1-NZ 3.47Å; E1029-K1032 PolarHBondContact OE1-NZ 3.43Å; E1029-K1032 WeakPolarHBondContact OE2-CD 3.25Å; E1029-K1032 IonicContact OE2-NZ 2.72Å; E1029-K1032 PolarHBondContact OE2-NZ 3.4Å; E1029-P1033 WeakPolarHBondContact O-CD 3.45Å
1030	E	78.1	Confident	85.8	Confident	117 Å²	117	55.6 Å²	55.6	55%	0.547	28%	0.283	S	S	.	.	H	α-helix	trans	-78.5	-37.3	168	-65	-174.6	158.4	0	0	112.5	D1027 F1028	D1027-E1030 HydrophobicContact CB-CB 4.24Å; D1027-E1030 HydrophobicContact CB-CG 4.07Å; D1027-E1030 PolarHBondContact O-N 3.14Å; F1028-E1030 VanDerWaalsContact C-N 3.33Å
1031	V	78.3	Confident	85.4	Confident	44 Å²	44	58.1 Å²	58.1	27%	0.267	30%	0.295	S	S	.	.	H	α-helix	trans	-78	-33.8	-179.3	168.8	0	0	0	0	112.2	D1027 F1028 I1034 A1035 I1038	D1027-V1031 VanDerWaalsContact O-CB 3.31Å; D1027-V1031 WeakPolarHBondContact O-CB 3.43Å; D1027-V1031 VanDerWaalsContact O-CG2 3.23Å; D1027-V1031 WeakPolarHBondContact O-CG2 3.29Å; D1027-V1031 PolarHBondContact O-N 3.04Å; F1028-V1031 PolarHBondContact O-N 3.34Å; V1031-I1034 CarbonylContact O-C 3.58Å; V1031-I1034 WeakPolarHBondContact O-CG1 3.33Å; V1031-I1034 PolarHBondContact O-N 3.25Å; V1031-A1035 PolarHBondContact O-N 3.48Å; V1031-I1038 HydrophobicContact CG1-CD1 3.89Å
1032	K	79.9	Confident	85.3	Confident	106 Å²	106	54.8 Å²	54.8	46%	0.461	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-56.9	-43.9	-176.8	169.6	-172.6	-176.6	-173.1	0	114.2	F1028 E1029 I1034 A1035	F1028-K1032 HydrophobicContact CD1-CD 4.43Å; F1028-K1032 HydrophobicContact CE1-CD 4Å; F1028-K1032 WeakPolarHBondContact O-CB 3.42Å; F1028-K1032 PolarHBondContact O-N 2.88Å; E1029-K1032 WeakPolarHBondContact OE1-CD 3.46Å; E1029-K1032 IonicContact OE1-NZ 3.47Å; E1029-K1032 PolarHBondContact OE1-NZ 3.43Å; E1029-K1032 WeakPolarHBondContact OE2-CD 3.25Å; E1029-K1032 IonicContact OE2-NZ 2.72Å; E1029-K1032 PolarHBondContact OE2-NZ 3.4Å; K1032-I1034 VanDerWaalsContact C-N 3.27Å; K1032-I1034 PolarHBondContact O-N 3.31Å; K1032-A1035 WeakPolarHBondContact O-CB 3.25Å; K1032-A1035 PolarHBondContact O-N 2.87Å
1033	P	80.8	Confident	85.3	Confident	103 Å²	103	55.1 Å²	55.1	67%	0.669	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-59.7	-31.3	171.5	-26.8	35	0	0	0	114.8	E1029	E1029-P1033 WeakPolarHBondContact O-CD 3.45Å
1034	I	84.5	Confident	85.4	Confident	22 Å²	22	56.2 Å²	56.2	11%	0.113	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-101.1	2.9	-177.3	61.6	176	0	0	0	113.4	Y1000 I1004 V1031 K1032 Q1036 I1037 I1038	Y1000-I1034 HydrophobicContact CD1-CD1 3.89Å; Y1000-I1034 HydrophobicContact CD1-CG2 3.94Å; Y1000-I1034 HydrophobicContact CD2-CG2 4.05Å; Y1000-I1034 HydrophobicContact CE1-CD1 4.17Å; Y1000-I1034 HydrophobicContact CE1-CG2 4.2Å; Y1000-I1034 HydrophobicContact CE2-CG2 4.29Å; Y1000-I1034 HydrophobicContact CG-CG2 3.87Å; I1004-I1034 HydrophobicContact CD1-CD1 4.34Å; V1031-I1034 CarbonylContact O-C 3.58Å; V1031-I1034 WeakPolarHBondContact O-CG1 3.33Å; V1031-I1034 PolarHBondContact O-N 3.25Å; K1032-I1034 VanDerWaalsContact C-N 3.27Å; K1032-I1034 PolarHBondContact O-N 3.31Å; I1034-Q1036 VanDerWaalsContact C-N 3.27Å; I1034-Q1036 PolarHBondContact O-N 2.92Å; I1034-I1037 HydrophobicContact CB-CD1 4.4Å; I1034-I1037 HydrophobicContact CG2-CD1 4.33Å; I1034-I1037 WeakPolarHBondContact O-CA 3.3Å; I1034-I1037 WeakPolarHBondContact O-CB 3.42Å; I1034-I1037 PolarHBondContact O-N 3.48Å; I1034-I1038 HydrophobicContact CD1-CD1 4.45Å; I1034-I1038 HydrophobicContact CG1-CD1 4.23Å; I1034-I1038 PolarHBondContact O-N 2.93Å; I1034-I1038 VanDerWaalsContact O-N 3.15Å
1035	A	85.9	Confident	85.6	Confident	14 Å²	14	56.4 Å²	56.4	12%	0.116	29%	0.287	C	S	.	.	H	α-helix	trans	-57.4	-37.4	-175.7	0	0	0	0	0	113	V1031 K1032 I1037 I1038 V1039	V1031-A1035 PolarHBondContact O-N 3.48Å; K1032-A1035 WeakPolarHBondContact O-CB 3.25Å; K1032-A1035 PolarHBondContact O-N 2.87Å; A1035-I1037 VanDerWaalsContact C-N 3.32Å; A1035-I1037 PolarHBondContact O-N 2.93Å; A1035-I1038 PolarHBondContact O-N 3.2Å; A1035-V1039 WeakPolarHBondContact O-CB 3.45Å; A1035-V1039 VanDerWaalsContact O-CG2 3.31Å; A1035-V1039 WeakPolarHBondContact O-CG2 3.32Å; A1035-V1039 PolarHBondContact O-N 3.24Å
1036	Q	88.1	Confident	85.9	Confident	96 Å²	96	55.9 Å²	55.9	45%	0.449	28%	0.284	S	S	.	.	H	α-helix	trans	-61.3	-40.1	174.8	-177.7	64	22.6	0	0	112	I1034 V1039 E1040 T1104	I1034-Q1036 VanDerWaalsContact C-N 3.27Å; I1034-Q1036 PolarHBondContact O-N 2.92Å; Q1036-V1039 PolarHBondContact O-N 3.13Å; Q1036-E1040 PolarHBondContact NE2-OE1 3.06Å; Q1036-E1040 WeakPolarHBondContact O-CG 3.39Å; Q1036-E1040 PolarHBondContact O-N 2.76Å; Q1036-T1104 HydrophobicContact CB-CG2 4.17Å
1037	I	86.4	Confident	86.5	Confident	31 Å²	31	54.7 Å²	54.7	16%	0.159	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-44.1	179.1	-54.8	177.3	0	0	0	110.1	I1001 I1004 I1034 A1035 V1039 E1040 H1041	I1001-I1037 HydrophobicContact CD1-CG2 4.49Å; I1001-I1037 HydrophobicContact CG1-CD1 4.49Å; I1001-I1037 HydrophobicContact CG1-CG2 3.5Å; I1001-I1037 VanDerWaalsContact CG1-CG2 3.5Å; I1004-I1037 HydrophobicContact CD1-CB 3.99Å; I1004-I1037 HydrophobicContact CD1-CG2 3.64Å; I1034-I1037 HydrophobicContact CB-CD1 4.4Å; I1034-I1037 HydrophobicContact CG2-CD1 4.33Å; I1034-I1037 WeakPolarHBondContact O-CA 3.3Å; I1034-I1037 WeakPolarHBondContact O-CB 3.42Å; I1034-I1037 PolarHBondContact O-N 3.48Å; A1035-I1037 VanDerWaalsContact C-N 3.32Å; A1035-I1037 PolarHBondContact O-N 2.93Å; I1037-V1039 VanDerWaalsContact C-N 3.32Å; I1037-V1039 PolarHBondContact O-N 2.74Å; I1037-E1040 PolarHBondContact O-N 2.9Å; I1037-H1041 WeakPolarHBondContact O-CB 3.36Å; I1037-H1041 PolarHBondContact O-N 2.87Å; I1037-H1041 PolarHBondContact O-ND1 2.62Å
1038	I	88.4	Confident	87.1	Confident	28 Å²	28	58.8 Å²	58.8	14%	0.144	29%	0.293	C	S	.	.	H	α-helix	trans	-61.8	-41.9	175.3	-60.2	171.6	0	0	0	110.3	I1004 V1031 I1034 A1035 I1042 W1043	I1004-I1038 HydrophobicContact CD1-CG1 3.67Å; I1004-I1038 HydrophobicContact CG1-CG1 3.99Å; I1004-I1038 HydrophobicContact CG2-CG1 4.16Å; V1031-I1038 HydrophobicContact CG1-CD1 3.89Å; I1034-I1038 HydrophobicContact CD1-CD1 4.45Å; I1034-I1038 HydrophobicContact CG1-CD1 4.23Å; I1034-I1038 PolarHBondContact O-N 2.93Å; I1034-I1038 VanDerWaalsContact O-N 3.15Å; A1035-I1038 PolarHBondContact O-N 3.2Å; I1038-I1042 HydrophobicContact CG2-CB 4.31Å; I1038-I1042 WeakPolarHBondContact O-CA 3.48Å; I1038-I1042 VanDerWaalsContact O-CB 3.28Å; I1038-I1042 WeakPolarHBondContact O-CB 3.27Å; I1038-I1042 PolarHBondContact O-N 2.84Å; I1038-W1043 PolarHBondContact O-N 2.69Å; I1038-W1043 VanDerWaalsContact O-N 3.1Å
1039	V	90.5	Very high	87.7	Confident	6 Å²	6	56 Å²	56	4%	0.036	28%	0.281	C	S	.	.	I	π-helix	trans	-61.7	-48.6	177.8	164.8	0	0	0	0	111.6	A1035 Q1036 I1037 W1043 N1044 T1104	A1035-V1039 WeakPolarHBondContact O-CB 3.45Å; A1035-V1039 VanDerWaalsContact O-CG2 3.31Å; A1035-V1039 WeakPolarHBondContact O-CG2 3.32Å; A1035-V1039 PolarHBondContact O-N 3.24Å; Q1036-V1039 PolarHBondContact O-N 3.13Å; I1037-V1039 VanDerWaalsContact C-N 3.32Å; I1037-V1039 PolarHBondContact O-N 2.74Å; V1039-W1043 HydrophobicContact CG2-CB 4.48Å; V1039-W1043 PolarHBondContact O-N 3.03Å; V1039-N1044 WeakPolarHBondContact O-CB 3.44Å; V1039-N1044 PolarHBondContact O-N 2.74Å; V1039-N1044 PolarHBondContact O-ND2 3.27Å; V1039-T1104 HydrophobicContact CB-CG2 4.5Å; V1039-T1104 HydrophobicContact CG2-CG2 4.07Å; V1039-T1104 VanDerWaalsContact CG2-O 3.29Å; V1039-T1104 WeakPolarHBondContact CG2-O 3.05Å
1040	E	89.1	Confident	88.4	Confident	101 Å²	101	54.9 Å²	54.9	47%	0.472	28%	0.279	S	S	.	.	I	π-helix	trans	-64.3	-45.3	179.9	-73.8	171.9	-175.9	0	0	113	Q1036 I1037	Q1036-E1040 PolarHBondContact NE2-OE1 3.06Å; Q1036-E1040 WeakPolarHBondContact O-CG 3.39Å; Q1036-E1040 PolarHBondContact O-N 2.76Å; I1037-E1040 PolarHBondContact O-N 2.9Å
1041	H	87.9	Confident	89.2	Confident	55 Å²	55	49.3 Å²	49.3	26%	0.255	25%	0.253	S	S	.	.	I	π-helix	trans	-91.8	-25.8	-169.8	-67.3	80.1	0	0	0	114.2	I1037 K1045	I1037-H1041 WeakPolarHBondContact O-CB 3.36Å; I1037-H1041 PolarHBondContact O-N 2.87Å; I1037-H1041 PolarHBondContact O-ND1 2.62Å; H1041-K1045 WeakPolarHBondContact O-CD 3.13Å; H1041-K1045 WeakPolarHBondContact O-CE 3.31Å; H1041-K1045 PolarHBondContact O-NZ 3.22Å
1042	I	91.7	Very high	90	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.021	24%	0.24	C	C	.	.	I	π-helix	trans	-119.8	-63.5	-173	-54.3	-57.9	0	0	0	110.2	I1004 F1008 T1010 L1020 I1038 N1044 K1045	I1004-I1042 HydrophobicContact CG2-CD1 4.05Å; I1004-I1042 HydrophobicContact CG2-CG1 3.56Å; F1008-I1042 HydrophobicContact CB-CB 4.47Å; F1008-I1042 HydrophobicContact CB-CD1 3.59Å; F1008-I1042 HydrophobicContact CB-CG1 3.78Å; F1008-I1042 HydrophobicContact CB-CG2 3.82Å; F1008-I1042 HydrophobicContact CD1-CG2 4.15Å; F1008-I1042 HydrophobicContact CD2-CG1 4.49Å; F1008-I1042 HydrophobicContact CG-CG1 4.2Å; F1008-I1042 HydrophobicContact CG-CG2 4.13Å; T1010-I1042 HydrophobicContact CG2-CG2 3.57Å; L1020-I1042 HydrophobicContact CD1-CG2 3.8Å; I1038-I1042 HydrophobicContact CG2-CB 4.31Å; I1038-I1042 WeakPolarHBondContact O-CA 3.48Å; I1038-I1042 VanDerWaalsContact O-CB 3.28Å; I1038-I1042 WeakPolarHBondContact O-CB 3.27Å; I1038-I1042 PolarHBondContact O-N 2.84Å; I1042-N1044 PolarHBondContact O-N 3.03Å; I1042-K1045 WeakPolarHBondContact O-CB 3.38Å; I1042-K1045 PolarHBondContact O-N 2.64Å
1043	W	93.1	Very high	90.9	Very high	13 Å²	13	42.2 Å²	42.2	5%	0.049	22%	0.218	C	C	.	.	I	π-helix	trans	-66.2	-42.7	-166.5	-172	-118.6	0	0	0	113.9	L1020 I1038 V1039 K1045 V1046 V1047 M1052 Y1073 F1074 A1106	L1020-W1043 HydrophobicContact CD2-CZ3 4.27Å; I1038-W1043 PolarHBondContact O-N 2.69Å; I1038-W1043 VanDerWaalsContact O-N 3.1Å; V1039-W1043 HydrophobicContact CG2-CB 4.48Å; V1039-W1043 PolarHBondContact O-N 3.03Å; W1043-K1045 PolarHBondContact O-N 2.89Å; W1043-V1046 HydrophobicContact CE3-CG2 4.11Å; W1043-V1046 HydrophobicContact CZ3-CG2 4.47Å; W1043-V1046 WeakPolarHBondContact O-CG2 3.32Å; W1043-V1046 PolarHBondContact O-N 3.28Å; W1043-V1047 HydrophobicContact CD2-CB 4.38Å; W1043-V1047 HydrophobicContact CG-CB 4.47Å; W1043-V1047 HydrophobicContact CZ2-CB 4.36Å; W1043-V1047 HydrophobicContact CZ2-CG2 3.96Å; W1043-V1047 PolarHBondContact O-N 3.42Å; W1043-M1052 HydrophobicContact CH2-CE 4.01Å; W1043-M1052 HydrophobicContact CZ3-CE 4.19Å; W1043-M1052 HydrophobicContact CZ3-SD 4.47Å; W1043-Y1073 HydrophobicContact CD2-CD1 4.37Å; W1043-Y1073 AromaticContact CE2-CD1 3.57Å; W1043-Y1073 HydrophobicContact CH2-CD1 4.46Å; W1043-Y1073 HydrophobicContact CH2-CG 4.39Å; W1043-Y1073 AromaticContact CZ2-CD1 3.64Å; W1043-Y1073 HydrophobicContact CZ2-CD1 3.64Å; W1043-Y1073 AromaticContact CZ2-CG 3.98Å; W1043-Y1073 HydrophobicContact CZ2-CG 3.98Å; W1043-Y1073 AromaticContact NE1-CD1 3.54Å; W1043-Y1073 AromaticContact NE1-CE1 3.78Å; W1043-F1074 HydrophobicContact CH2-CD1 4.37Å; W1043-F1074 AromaticContact CH2-CE1 3.73Å; W1043-F1074 HydrophobicContact CH2-CE1 3.73Å; W1043-F1074 HydrophobicContact CH2-CZ 4.23Å; W1043-F1074 HydrophobicContact CZ3-CE1 4.13Å; W1043-F1074 HydrophobicContact CZ3-CZ 4.36Å; W1043-A1106 PolarHBondContact NE1-O 2.81Å
1044	N	93.1	Very high	91.7	Very high	77 Å²	77	37.3 Å²	37.3	41%	0.412	19%	0.186	S	C	.	.	H	α-helix	trans	-60.5	-20.5	-178.7	-77.1	-17.2	0	0	0	113.6	V1039 I1042	V1039-N1044 WeakPolarHBondContact O-CB 3.44Å; V1039-N1044 PolarHBondContact O-N 2.74Å; V1039-N1044 PolarHBondContact O-ND2 3.27Å; I1042-N1044 PolarHBondContact O-N 3.03Å
1045	K	92.1	Very high	92.3	Very high	118 Å²	118	36.3 Å²	36.3	51%	0.513	18%	0.181	S	C	.	.	H	α-helix	trans	-71.3	-33.4	174.4	-64.2	168.9	172.6	160.4	0	113	T1010 H1041 I1042 W1043	T1010-K1045 VanDerWaalsContact OG1-CD 3.28Å; T1010-K1045 WeakPolarHBondContact OG1-CD 3.21Å; H1041-K1045 WeakPolarHBondContact O-CD 3.13Å; H1041-K1045 WeakPolarHBondContact O-CE 3.31Å; H1041-K1045 PolarHBondContact O-NZ 3.22Å; I1042-K1045 WeakPolarHBondContact O-CB 3.38Å; I1042-K1045 PolarHBondContact O-N 2.64Å; W1043-K1045 PolarHBondContact O-N 2.89Å
1046	V	93.6	Very high	92.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-113.6	-21.1	-169	-64.6	0	0	0	0	114	T1010 W1043 N1048 T1049 M1052	T1010-V1046 HydrophobicContact CG2-CG1 4.15Å; W1043-V1046 HydrophobicContact CE3-CG2 4.11Å; W1043-V1046 HydrophobicContact CZ3-CG2 4.47Å; W1043-V1046 WeakPolarHBondContact O-CG2 3.32Å; W1043-V1046 PolarHBondContact O-N 3.28Å; V1046-N1048 PolarHBondContact O-N 2.7Å; V1046-N1048 VanDerWaalsContact O-N 3.12Å; V1046-T1049 VanDerWaalsContact O-CB 3.32Å; V1046-T1049 WeakPolarHBondContact O-CB 3.15Å; V1046-T1049 WeakPolarHBondContact O-CG2 3.45Å; V1046-T1049 PolarHBondContact O-N 2.95Å; V1046-T1049 VanDerWaalsContact O-N 3.08Å; V1046-T1049 PolarHBondContact O-OG1 3.3Å; V1046-M1052 HydrophobicContact CB-SD 4.44Å; V1046-M1052 HydrophobicContact CG2-SD 4.27Å
1047	V	93.6	Very high	93.2	Very high	6 Å²	6	32.7 Å²	32.7	4%	0.036	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-28.7	-175.8	69.8	0	0	0	0	114	W1043 T1049 A1106 Y1108 K1112	W1043-V1047 HydrophobicContact CD2-CB 4.38Å; W1043-V1047 HydrophobicContact CG-CB 4.47Å; W1043-V1047 HydrophobicContact CZ2-CB 4.36Å; W1043-V1047 HydrophobicContact CZ2-CG2 3.96Å; W1043-V1047 PolarHBondContact O-N 3.42Å; V1047-T1049 VanDerWaalsContact C-N 3.35Å; V1047-T1049 PolarHBondContact O-N 2.82Å; V1047-A1106 HydrophobicContact CG2-CB 4.24Å; V1047-Y1108 HydrophobicContact CG2-CD2 4.36Å; V1047-Y1108 VanDerWaalsContact O-CD2 3.25Å; V1047-Y1108 WeakPolarHBondContact O-CD2 3.45Å; V1047-Y1108 WeakPolarHBondContact O-CE2 3.27Å; V1047-K1112 PolarHBondContact O-NZ 3.03Å
1048	N	92.7	Very high	93.6	Very high	126 Å²	126	34.9 Å²	34.9	67%	0.674	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	6.9	-179.1	-68.4	-47.9	0	0	0	114.5	N1016 V1046	N1016-N1048 PolarHBondContact ND2-O 2.93Å; V1046-N1048 PolarHBondContact O-N 2.7Å; V1046-N1048 VanDerWaalsContact O-N 3.12Å
1049	T	94.9	Very high	93.8	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.006	17%	0.166	C	C	.	.			trans	-71.6	162	177.9	58.3	0	0	0	0	112.7	V1012 N1016 G1018 V1046 V1047 A1051 Y1108 K1112	V1012-T1049 HydrophobicContact CG1-CG2 4.15Å; V1012-T1049 HydrophobicContact CG2-CG2 4.04Å; N1016-T1049 WeakPolarHBondContact ND2-CA 3.47Å; N1016-T1049 WeakPolarHBondContact O-CB 3.37Å; G1018-T1049 VanDerWaalsContact CA-CG2 3.48Å; V1046-T1049 VanDerWaalsContact O-CB 3.32Å; V1046-T1049 WeakPolarHBondContact O-CB 3.15Å; V1046-T1049 WeakPolarHBondContact O-CG2 3.45Å; V1046-T1049 PolarHBondContact O-N 2.95Å; V1046-T1049 VanDerWaalsContact O-N 3.08Å; V1046-T1049 PolarHBondContact O-OG1 3.3Å; V1047-T1049 VanDerWaalsContact C-N 3.35Å; V1047-T1049 PolarHBondContact O-N 2.82Å; T1049-A1051 PolarHBondContact OG1-O 3.16Å; T1049-Y1108 WeakPolarHBondContact OG1-CE2 3.48Å; T1049-Y1108 PolarHBondContact OG1-OH 2.88Å; T1049-K1112 WeakPolarHBondContact O-CD 3.46Å; T1049-K1112 WeakPolarHBondContact O-CE 3.42Å; T1049-K1112 PolarHBondContact O-NZ 3.01Å
1050	N	92.8	Very high	93.7	Very high	85 Å²	85	38.7 Å²	38.7	46%	0.455	19%	0.192	S	C	.	.	S	Bend	trans	-80.2	-38.4	179.6	-67.7	-10.6	0	0	0	112	N1015 N1016 L1208	N1015-N1050 PolarHBondContact O-ND2 2.84Å; N1016-N1050 HydrophobicContact CB-CB 4.48Å; N1016-N1050 PolarHBondContact ND2-N 2.68Å; N1016-N1050 PolarHBondContact ND2-OD1 3.4Å; N1016-N1050 PolarHBondContact O-N 2.91Å; N1050-L1208 HydrophobicContact CB-CD1 4.3Å; N1050-L1208 HydrophobicContact CB-CD2 4.17Å
1051	A	95.4	Very high	93.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	163.3	173.5	0	0	0	0	0	109.1	I1017 G1018 T1049 Y1108 S1113 L1204 L1208	I1017-A1051 CarbonylContact C-O 3.4Å; I1017-A1051 WeakPolarHBondContact CA-O 3.47Å; G1018-A1051 PolarHBondContact N-O 2.78Å; T1049-A1051 PolarHBondContact OG1-O 3.16Å; A1051-Y1108 VanDerWaalsContact CA-OH 3.24Å; A1051-Y1108 WeakPolarHBondContact CA-OH 3.44Å; A1051-Y1108 PolarHBondContact N-OH 3.16Å; A1051-Y1108 PolarHBondContact O-OH 2.85Å; A1051-S1113 CarbonylContact C-O 3.59Å; A1051-S1113 VanDerWaalsContact CA-O 3.24Å; A1051-S1113 WeakPolarHBondContact CA-O 3.44Å; A1051-S1113 WeakPolarHBondContact CB-O 3.27Å; A1051-L1204 HydrophobicContact CB-CD1 4.03Å; A1051-L1204 HydrophobicContact CB-CD2 3.87Å; A1051-L1204 HydrophobicContact CB-CG 4.44Å; A1051-L1208 HydrophobicContact CB-CD1 4.24Å
1052	M	96.3	Very high	93.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	145.9	-177.6	175.8	161.6	43.3	0	0	112.9	G1018 L1020 W1043 V1046 I1054 F1074 Y1108 S1113 L1114 I1115	G1018-M1052 CarbonylContact O-C 3.42Å; G1018-M1052 VanDerWaalsContact O-CA 3.31Å; G1018-M1052 WeakPolarHBondContact O-CA 3.28Å; L1020-M1052 HydrophobicContact CB-SD 4.41Å; W1043-M1052 HydrophobicContact CH2-CE 4.01Å; W1043-M1052 HydrophobicContact CZ3-CE 4.19Å; W1043-M1052 HydrophobicContact CZ3-SD 4.47Å; V1046-M1052 HydrophobicContact CB-SD 4.44Å; V1046-M1052 HydrophobicContact CG2-SD 4.27Å; M1052-I1054 HydrophobicContact CG-CG1 4.42Å; M1052-F1074 HydrophobicContact CE-CD1 4.12Å; M1052-F1074 HydrophobicContact CE-CE1 3.64Å; M1052-Y1108 HydrophobicContact CB-CE1 4.06Å; M1052-Y1108 HydrophobicContact CB-CE2 4.49Å; M1052-Y1108 WeakPolarHBondContact CB-OH 3.46Å; M1052-Y1108 HydrophobicContact CE-CD1 3.68Å; M1052-Y1108 HydrophobicContact CE-CD2 3.74Å; M1052-Y1108 HydrophobicContact CE-CE1 3.67Å; M1052-Y1108 HydrophobicContact CE-CE2 3.75Å; M1052-Y1108 HydrophobicContact CE-CG 3.71Å; M1052-Y1108 PolarHBondContact N-OH 2.98Å; M1052-S1113 PolarHBondContact N-O 2.76Å; M1052-L1114 HydrophobicContact CB-CD1 3.94Å; M1052-L1114 HydrophobicContact CE-CD1 4.21Å; M1052-L1114 HydrophobicContact CG-CD1 4.07Å; M1052-L1114 WeakPolarHBondContact O-CA 3.49Å; M1052-I1115 PolarHBondContact O-N 3.49Å
1053	I	97.9	Very high	92.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	119	170.1	-58.4	173.3	0	0	0	107.6	F1013 I1017 G1018 Y1019 L1020 I1115 L1117 L1197 A1200 K1201 L1204	F1013-I1053 HydrophobicContact CE2-CD1 4.34Å; I1017-I1053 HydrophobicContact CG2-CD1 4.15Å; I1017-I1053 HydrophobicContact CG2-CG1 4.17Å; G1018-I1053 PolarHBondContact O-N 3.46Å; Y1019-I1053 WeakPolarHBondContact CA-O 3.34Å; Y1019-I1053 HydrophobicContact CD2-CB 4.2Å; Y1019-I1053 HydrophobicContact CD2-CG2 4.12Å; Y1019-I1053 HydrophobicContact CE2-CG2 4.42Å; L1020-I1053 PolarHBondContact N-O 2.99Å; I1053-I1115 CarbonylContact C-O 3.44Å; I1053-I1115 WeakPolarHBondContact CA-O 3.27Å; I1053-I1115 HydrophobicContact CG1-CB 4.47Å; I1053-L1117 HydrophobicContact CG2-CD1 3.79Å; I1053-L1117 HydrophobicContact CG2-CD2 4.09Å; I1053-L1117 HydrophobicContact CG2-CG 3.76Å; I1053-L1197 HydrophobicContact CD1-CD1 4.11Å; I1053-L1197 HydrophobicContact CG2-CD1 4.19Å; I1053-A1200 HydrophobicContact CD1-CB 3.84Å; I1053-A1200 HydrophobicContact CG1-CB 4.28Å; I1053-K1201 HydrophobicContact CD1-CG 4.07Å; I1053-L1204 HydrophobicContact CD1-CD1 4.09Å; I1053-L1204 HydrophobicContact CG1-CD1 3.65Å
1054	I	97.6	Very high	92.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	128.3	167.4	-54.8	174.6	0	0	0	107.6	L1020 F1022 M1052 L1056 F1074 L1114 I1115 I1116 L1117 F1129	L1020-I1054 CarbonylContact O-C 3.53Å; L1020-I1054 VanDerWaalsContact O-CA 3.3Å; L1020-I1054 WeakPolarHBondContact O-CA 3.44Å; F1022-I1054 HydrophobicContact CE1-CG2 3.98Å; M1052-I1054 HydrophobicContact CG-CG1 4.42Å; I1054-L1056 HydrophobicContact CG2-CD2 3.96Å; I1054-L1056 HydrophobicContact CG2-CG 4.03Å; I1054-F1074 HydrophobicContact CD1-CE1 3.74Å; I1054-F1074 HydrophobicContact CD1-CE2 4.16Å; I1054-F1074 HydrophobicContact CD1-CZ 3.51Å; I1054-L1114 HydrophobicContact CD1-CD1 3.97Å; I1054-L1114 HydrophobicContact CD1-CD2 4.5Å; I1054-L1114 HydrophobicContact CG1-CD1 4.01Å; I1054-I1115 PolarHBondContact N-O 3.14Å; I1054-I1116 HydrophobicContact CB-CG1 4.26Å; I1054-I1116 HydrophobicContact CD1-CG1 4.42Å; I1054-I1116 CarbonylContact O-C 3.07Å; I1054-I1116 VanDerWaalsContact O-CA 3.28Å; I1054-I1116 WeakPolarHBondContact O-CA 3.37Å; I1054-L1117 PolarHBondContact O-N 2.97Å; I1054-F1129 HydrophobicContact CD1-CE1 4.19Å; I1054-F1129 HydrophobicContact CD1-CZ 3.98Å
1055	D	97.3	Very high	91.7	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.011	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	112.9	178.3	-173.7	9	0	0	0	111.1	Y1019 L1020 R1021 R1057 L1117	Y1019-D1055 HydrophobicContact CE2-CB 3.75Å; Y1019-D1055 PolarHBondContact OH-OD2 3.28Å; L1020-D1055 PolarHBondContact O-N 3.49Å; R1021-D1055 HydrophobicContact CB-CB 3.95Å; R1021-D1055 HydrophobicContact CG-CB 4.17Å; D1055-R1057 VanDerWaalsContact CG-NE 3.33Å; D1055-R1057 VanDerWaalsContact OD1-CB 3.25Å; D1055-R1057 WeakPolarHBondContact OD1-CB 3.28Å; D1055-R1057 WeakPolarHBondContact OD1-CG 3.38Å; D1055-R1057 IonicContact OD1-CZ 2.92Å; D1055-R1057 PolarHBondContact OD1-N 2.78Å; D1055-R1057 IonicContact OD1-NE 3.7Å; D1055-R1057 PolarHBondContact OD1-NE 3.13Å; D1055-R1057 IonicContact OD1-NH2 3.82Å; D1055-R1057 IonicContact OD2-CZ 2.72Å; D1055-R1057 VanDerWaalsContact OD2-CZ 3.32Å; D1055-R1057 IonicContact OD2-NE 2.66Å; D1055-R1057 PolarHBondContact OD2-NE 3.01Å; D1055-R1057 VanDerWaalsContact OD2-NE 3.12Å; D1055-R1057 IonicContact OD2-NH2 3.77Å; D1055-R1057 PolarHBondContact OD2-NH2 2.88Å; D1055-L1117 HydrophobicContact CB-CD1 4.15Å
1056	L	97.1	Very high	91.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.17	C	C	.	.			trans	-115.4	14.9	177.6	-55.6	179.3	0	0	0	111.6	F1022 I1054 N1058 N1059 I1116 L1117 T1122 A1126 F1129 V1130	F1022-L1056 HydrophobicContact CD1-CD2 4.23Å; F1022-L1056 HydrophobicContact CE1-CD2 3.67Å; F1022-L1056 HydrophobicContact CE2-CD2 4.15Å; F1022-L1056 HydrophobicContact CZ-CD2 3.63Å; I1054-L1056 HydrophobicContact CG2-CD2 3.96Å; I1054-L1056 HydrophobicContact CG2-CG 4.03Å; L1056-N1058 PolarHBondContact O-N 3.28Å; L1056-N1058 VanDerWaalsContact O-N 3.07Å; L1056-N1059 HydrophobicContact CB-CB 3.96Å; L1056-N1059 HydrophobicContact CD2-CB 4.09Å; L1056-N1059 WeakPolarHBondContact O-CB 3.25Å; L1056-N1059 PolarHBondContact O-N 3.15Å; L1056-I1116 HydrophobicContact CD1-CG2 3.71Å; L1056-I1116 HydrophobicContact CG-CG2 4.02Å; L1056-L1117 CarbonylContact C-O 3.57Å; L1056-L1117 WeakPolarHBondContact CA-O 3.45Å; L1056-L1117 PolarHBondContact N-O 3.22Å; L1056-T1122 HydrophobicContact CB-CG2 4.17Å; L1056-T1122 PolarHBondContact O-OG1 3.32Å; L1056-A1126 HydrophobicContact CD1-CB 4.46Å; L1056-F1129 HydrophobicContact CD1-CD1 3.71Å; L1056-F1129 HydrophobicContact CD1-CE1 4.08Å; L1056-V1130 HydrophobicContact CD1-CG2 3.93Å
1057	R	96.4	Very high	91.1	Very high	33 Å²	33	29.9 Å²	29.9	13%	0.125	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-25.5	-177.5	-72.7	177.1	-66.9	170.4	3.9	113.7	D1055 L1117 S1119 A1193	D1055-R1057 VanDerWaalsContact CG-NE 3.33Å; D1055-R1057 VanDerWaalsContact OD1-CB 3.25Å; D1055-R1057 WeakPolarHBondContact OD1-CB 3.28Å; D1055-R1057 WeakPolarHBondContact OD1-CG 3.38Å; D1055-R1057 IonicContact OD1-CZ 2.92Å; D1055-R1057 PolarHBondContact OD1-N 2.78Å; D1055-R1057 IonicContact OD1-NE 3.7Å; D1055-R1057 PolarHBondContact OD1-NE 3.13Å; D1055-R1057 IonicContact OD1-NH2 3.82Å; D1055-R1057 IonicContact OD2-CZ 2.72Å; D1055-R1057 VanDerWaalsContact OD2-CZ 3.32Å; D1055-R1057 IonicContact OD2-NE 2.66Å; D1055-R1057 PolarHBondContact OD2-NE 3.01Å; D1055-R1057 VanDerWaalsContact OD2-NE 3.12Å; D1055-R1057 IonicContact OD2-NH2 3.77Å; D1055-R1057 PolarHBondContact OD2-NH2 2.88Å; R1057-L1117 HydrophobicContact CG-CB 3.84Å; R1057-L1117 PolarHBondContact N-O 3.01Å; R1057-S1119 WeakPolarHBondContact O-CB 3.31Å; R1057-S1119 PolarHBondContact O-OG 2.85Å; R1057-A1193 WeakPolarHBondContact CD-O 3.48Å; R1057-A1193 PolarHBondContact NH1-O 3.46Å
1058	N	93.6	Very high	90.9	Very high	78 Å²	78	30.1 Å²	30.1	42%	0.417	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.9	12.2	178.3	-62.9	-11.4	0	0	0	112.8	R1021 L1056 L1060	R1021-N1058 PolarHBondContact NH2-ND2 3.41Å; L1056-N1058 PolarHBondContact O-N 3.28Å; L1056-N1058 VanDerWaalsContact O-N 3.07Å; N1058-L1060 PolarHBondContact O-N 3.02Å
1059	N	92.8	Very high	90.6	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.144	C	C	.	.			trans	-87.9	112	-169.5	-168.1	-52.4	0	0	0	112.7	F1022 D1023 M1024 L1056 G1061 T1122 A1123 A1126	F1022-N1059 WeakPolarHBondContact CD2-ND2 3.49Å; F1022-N1059 WeakPolarHBondContact CE2-ND2 3.4Å; F1022-N1059 PolarHBondContact O-ND2 3.16Å; D1023-N1059 VanDerWaalsContact C-CG 3.5Å; D1023-N1059 VanDerWaalsContact O-CA 3.28Å; D1023-N1059 WeakPolarHBondContact O-CA 3.39Å; M1024-N1059 PolarHBondContact N-ND2 2.89Å; L1056-N1059 HydrophobicContact CB-CB 3.96Å; L1056-N1059 HydrophobicContact CD2-CB 4.09Å; L1056-N1059 WeakPolarHBondContact O-CB 3.25Å; L1056-N1059 PolarHBondContact O-N 3.15Å; N1059-G1061 PolarHBondContact O-N 3.31Å; N1059-G1061 WeakPolarHBondContact OD1-CA 3.37Å; N1059-G1061 PolarHBondContact OD1-N 3.38Å; N1059-T1122 CarbonylContact O-C 3.59Å; N1059-T1122 VanDerWaalsContact O-CA 3.29Å; N1059-T1122 WeakPolarHBondContact O-CA 3.04Å; N1059-A1123 PolarHBondContact O-N 2.82Å; N1059-A1126 HydrophobicContact CB-CB 4.12Å; N1059-A1126 WeakPolarHBondContact OD1-CB 3.39Å
1060	L	88.3	Confident	90.4	Very high	113 Å²	113	26 Å²	26	59%	0.592	15%	0.151	S	C	*	.			trans	-80.3	2.7	-174.8	-57.3	178.7	0	0	0	113.9	D1023 M1024 N1058	D1023-L1060 PolarHBondContact O-N 3.28Å; D1023-L1060 VanDerWaalsContact O-N 3.07Å; M1024-L1060 HydrophobicContact SD-CB 4.11Å; N1058-L1060 PolarHBondContact O-N 3.02Å
1061	G	85.5	Confident	90.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.129	C	C	.	.			trans	86.6	-144.2	-176.4	0	0	0	0	0	112.6	M1024 F1025 N1059 A1123	M1024-G1061 CarbonylContact C-O 3.57Å; M1024-G1061 WeakPolarHBondContact CA-O 3.36Å; F1025-G1061 PolarHBondContact N-O 3.03Å; N1059-G1061 PolarHBondContact O-N 3.31Å; N1059-G1061 WeakPolarHBondContact OD1-CA 3.37Å; N1059-G1061 PolarHBondContact OD1-N 3.38Å; G1061-A1123 WeakPolarHBondContact CA-O 3.44Å; G1061-A1123 PolarHBondContact N-O 3.42Å
1062	G	84.1	Confident	90.2	Very high	22 Å²	22	21.9 Å²	21.9	23%	0.227	13%	0.129	C	C	.	.			trans	149.6	-162.3	-172.2	0	0	0	0	0	111.4	A1125	G1062-A1125 WeakPolarHBondContact O-CB 3.46Å
1063	P	79.3	Confident	90	Very high	49 Å²	49	23.4 Å²	23.4	32%	0.318	14%	0.135	S	C	.	.			trans	-62.7	134.4	173.5	-22.3	35.7	0	0	0	111.7	F1025 D1027 T1065	F1025-P1063 VanDerWaalsContact O-CD 3.31Å; F1025-P1063 WeakPolarHBondContact O-CD 3.27Å; D1027-P1063 HydrophobicContact CB-CB 4.15Å; D1027-P1063 HydrophobicContact CB-CG 4.01Å; P1063-T1065 PolarHBondContact O-N 3.28Å
1064	T	81.3	Confident	89.8	Confident	32 Å²	32	23.4 Å²	23.4	20%	0.196	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-12.7	-179.7	57.3	0	0	0	0	113.1	A1066 I1067 A1125 E1128 P1152	T1064-A1066 VanDerWaalsContact C-N 3.28Å; T1064-A1066 PolarHBondContact O-N 2.85Å; T1064-I1067 HydrophobicContact CG2-CD1 4.12Å; T1064-I1067 WeakPolarHBondContact O-CB 3.45Å; T1064-I1067 WeakPolarHBondContact O-CG1 3.24Å; T1064-I1067 PolarHBondContact O-N 3.19Å; T1064-I1067 VanDerWaalsContact O-N 3.12Å; T1064-A1125 HydrophobicContact CG2-CB 4.15Å; T1064-E1128 WeakPolarHBondContact CB-OE2 3.45Å; T1064-E1128 WeakPolarHBondContact CG2-OE2 3.21Å; T1064-P1152 HydrophobicContact CG2-CG 4.4Å
1065	T	82.6	Confident	89.6	Confident	68 Å²	68	24 Å²	24	42%	0.417	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-38.7	179.3	51.6	0	0	0	0	113.1	D1027 F1028 P1063 I1067	D1027-T1065 WeakPolarHBondContact OD2-CB 3.35Å; D1027-T1065 WeakPolarHBondContact OD2-CG2 3.47Å; D1027-T1065 PolarHBondContact OD2-OG1 3.22Å; F1028-T1065 PolarHBondContact N-OG1 2.84Å; F1028-T1065 VanDerWaalsContact N-OG1 3.1Å; P1063-T1065 PolarHBondContact O-N 3.28Å; T1065-I1067 VanDerWaalsContact C-N 3.31Å; T1065-I1067 PolarHBondContact O-N 2.89Å
1066	A	83.8	Confident	89.2	Confident	12 Å²	12	26 Å²	26	10%	0.099	15%	0.148	C	C	.	.	H	α-helix	trans	-76.2	-11.6	-178.1	0	0	0	0	0	114.7	G1026 F1028 T1064 A1068 G1069 F1070	G1026-A1066 WeakPolarHBondContact O-CB 3.45Å; F1028-A1066 HydrophobicContact CB-CB 4.46Å; T1064-A1066 VanDerWaalsContact C-N 3.28Å; T1064-A1066 PolarHBondContact O-N 2.85Å; A1066-A1068 PolarHBondContact O-N 2.94Å; A1066-G1069 PolarHBondContact O-N 2.92Å; A1066-F1070 PolarHBondContact O-N 3.07Å
1067	I	89.1	Confident	88.5	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.6	-43.8	-174.5	-63.2	172.7	0	0	0	111.3	F1025 T1064 T1065 G1069 F1070 C1071 L1097 A1125 E1128 I1132	F1025-I1067 HydrophobicContact CD1-CG1 4.48Å; F1025-I1067 HydrophobicContact CE1-CG1 4.38Å; T1064-I1067 HydrophobicContact CG2-CD1 4.12Å; T1064-I1067 WeakPolarHBondContact O-CB 3.45Å; T1064-I1067 WeakPolarHBondContact O-CG1 3.24Å; T1064-I1067 PolarHBondContact O-N 3.19Å; T1064-I1067 VanDerWaalsContact O-N 3.12Å; T1065-I1067 VanDerWaalsContact C-N 3.31Å; T1065-I1067 PolarHBondContact O-N 2.89Å; I1067-G1069 PolarHBondContact O-N 3.47Å; I1067-F1070 PolarHBondContact O-N 3.37Å; I1067-C1071 VanDerWaalsContact O-CB 3.29Å; I1067-C1071 WeakPolarHBondContact O-CB 3.31Å; I1067-C1071 PolarHBondContact O-N 3.17Å; I1067-C1071 PolarHBondContact O-SG 3.48Å; I1067-L1097 HydrophobicContact CG2-CD2 4.17Å; I1067-A1125 HydrophobicContact CD1-CB 3.93Å; I1067-A1125 WeakPolarHBondContact CD1-O 3.31Å; I1067-A1125 HydrophobicContact CG1-CB 4.35Å; I1067-E1128 HydrophobicContact CD1-CB 3.78Å; I1067-E1128 HydrophobicContact CD1-CG 3.71Å; I1067-E1128 WeakPolarHBondContact CD1-OE2 3.48Å; I1067-I1132 HydrophobicContact CG2-CD1 3.69Å
1068	A	89.3	Confident	87.7	Confident	12 Å²	12	32.3 Å²	32.3	10%	0.099	20%	0.197	C	C	.	.	H	α-helix	trans	-56.8	-48.6	176.2	0	0	0	0	0	111.8	A1066 S1072 L1083 L1097 R1098	A1066-A1068 PolarHBondContact O-N 2.94Å; A1068-S1072 WeakPolarHBondContact O-CB 3.41Å; A1068-S1072 PolarHBondContact O-N 3.18Å; A1068-S1072 PolarHBondContact O-OG 3.01Å; A1068-L1083 HydrophobicContact CB-CD1 4.44Å; A1068-L1097 HydrophobicContact CB-CD1 3.92Å; A1068-L1097 HydrophobicContact CB-CG 4.42Å; A1068-R1098 WeakPolarHBondContact CB-O 3.48Å
1069	G	88.1	Confident	87.1	Confident	6 Å²	6	35.2 Å²	35.2	6%	0.062	21%	0.206	C	C	.	.	H	α-helix	trans	-61.3	-45.8	177.2	0	0	0	0	0	112.7	A1066 I1067 S1072 Y1073	A1066-G1069 PolarHBondContact O-N 2.92Å; I1067-G1069 PolarHBondContact O-N 3.47Å; G1069-S1072 WeakPolarHBondContact O-CB 3.12Å; G1069-S1072 PolarHBondContact O-N 3.4Å; G1069-Y1073 WeakPolarHBondContact O-CD2 3.46Å
1070	F	89.6	Confident	86.8	Confident	33 Å²	33	39.7 Å²	39.7	15%	0.145	23%	0.226	C	C	.	.	H	α-helix	trans	-70	-46.4	-178.2	-167.2	-118.9	0	0	0	112.6	L1020 F1022 F1025 A1066 I1067 S1072 Y1073 F1074 F1129	L1020-F1070 HydrophobicContact CD2-CE2 4.47Å; L1020-F1070 HydrophobicContact CD2-CZ 4.15Å; F1022-F1070 AromaticContact CE1-CE1 3.77Å; F1022-F1070 HydrophobicContact CE1-CE1 3.77Å; F1022-F1070 HydrophobicContact CE1-CE2 4.42Å; F1022-F1070 AromaticContact CE1-CZ 3.53Å; F1022-F1070 HydrophobicContact CE1-CZ 3.53Å; F1022-F1070 HydrophobicContact CZ-CD1 4.22Å; F1022-F1070 AromaticContact CZ-CE1 3.53Å; F1022-F1070 HydrophobicContact CZ-CE1 3.53Å; F1022-F1070 HydrophobicContact CZ-CE2 4.48Å; F1022-F1070 AromaticContact CZ-CZ 3.69Å; F1022-F1070 HydrophobicContact CZ-CZ 3.69Å; F1025-F1070 HydrophobicContact CE1-CD1 4.09Å; F1025-F1070 HydrophobicContact CZ-CD1 4.38Å; A1066-F1070 PolarHBondContact O-N 3.07Å; I1067-F1070 PolarHBondContact O-N 3.37Å; F1070-S1072 PolarHBondContact O-N 2.97Å; F1070-Y1073 PolarHBondContact O-N 2.94Å; F1070-F1074 AromaticContact CD1-CE2 3.99Å; F1070-F1074 HydrophobicContact CD1-CE2 3.99Å; F1070-F1074 HydrophobicContact CD2-CE2 4.49Å; F1070-F1074 AromaticContact CE1-CE2 3.8Å; F1070-F1074 HydrophobicContact CE1-CE2 3.8Å; F1070-F1074 AromaticContact CE1-CZ 3.95Å; F1070-F1074 HydrophobicContact CE1-CZ 3.95Å; F1070-F1074 HydrophobicContact CE2-CE2 4.34Å; F1070-F1074 HydrophobicContact CE2-CZ 4.11Å; F1070-F1074 HydrophobicContact CG-CE2 4.32Å; F1070-F1074 AromaticContact CZ-CE2 3.99Å; F1070-F1074 HydrophobicContact CZ-CE2 3.99Å; F1070-F1074 AromaticContact CZ-CZ 3.71Å; F1070-F1074 HydrophobicContact CZ-CZ 3.71Å; F1070-F1074 WeakPolarHBondContact O-CD2 3.17Å; F1070-F1074 WeakPolarHBondContact O-CE2 3.4Å; F1070-F1129 AromaticContact CD1-CD2 3.84Å; F1070-F1129 HydrophobicContact CD1-CD2 3.84Å; F1070-F1129 HydrophobicContact CD1-CE1 4.44Å; F1070-F1129 AromaticContact CD1-CE2 3.4Å; F1070-F1129 HydrophobicContact CD1-CE2 3.4Å; F1070-F1129 VanDerWaalsContact CD1-CE2 3.4Å; F1070-F1129 AromaticContact CD1-CZ 3.74Å; F1070-F1129 HydrophobicContact CD1-CZ 3.74Å; F1070-F1129 HydrophobicContact CE1-CD2 4.42Å; F1070-F1129 HydrophobicContact CE1-CE1 4.08Å; F1070-F1129 AromaticContact CE1-CE2 3.76Å; F1070-F1129 HydrophobicContact CE1-CE2 3.76Å; F1070-F1129 AromaticContact CE1-CZ 3.55Å; F1070-F1129 HydrophobicContact CE1-CZ 3.55Å; F1070-F1129 HydrophobicContact CG-CE2 4.48Å
1071	C	92.3	Very high	86.9	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-53.5	-39.9	174.2	-80.5	0	0	0	0	112.4	I1067 Y1073 F1074 F1075 L1083 F1129	I1067-C1071 VanDerWaalsContact O-CB 3.29Å; I1067-C1071 WeakPolarHBondContact O-CB 3.31Å; I1067-C1071 PolarHBondContact O-N 3.17Å; I1067-C1071 PolarHBondContact O-SG 3.48Å; C1071-Y1073 PolarHBondContact O-N 3.03Å; C1071-Y1073 VanDerWaalsContact O-N 3.14Å; C1071-F1074 PolarHBondContact O-N 3.34Å; C1071-F1075 HydrophobicContact CB-CE2 4.49Å; C1071-F1075 VanDerWaalsContact O-CD2 3.25Å; C1071-F1075 WeakPolarHBondContact O-CD2 3.47Å; C1071-L1083 HydrophobicContact CB-CD1 3.59Å; C1071-L1083 HydrophobicContact CB-CD2 3.8Å; C1071-L1083 HydrophobicContact CB-CG 4.37Å; C1071-F1129 VanDerWaalsContact SG-CD2 3.5Å
1072	S	92.3	Very high	87.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.9	-26.1	-174.9	-62.2	0	0	0	0	114.3	A1068 G1069 F1070 F1074 T1099 L1100 R1107	A1068-S1072 WeakPolarHBondContact O-CB 3.41Å; A1068-S1072 PolarHBondContact O-N 3.18Å; A1068-S1072 PolarHBondContact O-OG 3.01Å; G1069-S1072 WeakPolarHBondContact O-CB 3.12Å; G1069-S1072 PolarHBondContact O-N 3.4Å; F1070-S1072 PolarHBondContact O-N 2.97Å; S1072-F1074 PolarHBondContact O-N 3.1Å; S1072-T1099 WeakPolarHBondContact OG-CA 3.46Å; S1072-T1099 WeakPolarHBondContact OG-CB 3.49Å; S1072-L1100 PolarHBondContact OG-N 2.79Å; S1072-R1107 PolarHBondContact O-NH1 3.15Å
1073	Y	92.3	Very high	87.5	Confident	31 Å²	31	38.3 Å²	38.3	12%	0.122	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-27.1	175.1	-77.3	-82.9	0	0	0	113.2	W1043 G1069 F1070 C1071 L1103 T1104 Y1108 G1109	W1043-Y1073 HydrophobicContact CD2-CD1 4.37Å; W1043-Y1073 AromaticContact CE2-CD1 3.57Å; W1043-Y1073 HydrophobicContact CH2-CD1 4.46Å; W1043-Y1073 HydrophobicContact CH2-CG 4.39Å; W1043-Y1073 AromaticContact CZ2-CD1 3.64Å; W1043-Y1073 HydrophobicContact CZ2-CD1 3.64Å; W1043-Y1073 AromaticContact CZ2-CG 3.98Å; W1043-Y1073 HydrophobicContact CZ2-CG 3.98Å; W1043-Y1073 AromaticContact NE1-CD1 3.54Å; W1043-Y1073 AromaticContact NE1-CE1 3.78Å; G1069-Y1073 WeakPolarHBondContact O-CD2 3.46Å; F1070-Y1073 PolarHBondContact O-N 2.94Å; C1071-Y1073 PolarHBondContact O-N 3.03Å; C1071-Y1073 VanDerWaalsContact O-N 3.14Å; Y1073-L1103 HydrophobicContact CD1-CD1 4.09Å; Y1073-L1103 HydrophobicContact CD2-CD1 4.23Å; Y1073-L1103 HydrophobicContact CE1-CB 4.48Å; Y1073-L1103 HydrophobicContact CE1-CD1 4.24Å; Y1073-L1103 HydrophobicContact CE2-CD1 4.38Å; Y1073-L1103 HydrophobicContact CE2-CD2 4.19Å; Y1073-L1103 HydrophobicContact CG-CD1 4.08Å; Y1073-T1104 VanDerWaalsContact CE1-O 3.3Å; Y1073-T1104 WeakPolarHBondContact CE1-O 3.4Å; Y1073-T1104 PolarHBondContact OH-O 2.93Å; Y1073-Y1108 WeakPolarHBondContact O-CA 3.23Å; Y1073-Y1108 WeakPolarHBondContact O-CB 3.36Å; Y1073-Y1108 PolarHBondContact O-N 2.83Å; Y1073-G1109 PolarHBondContact O-N 3.35Å
1074	F	93.7	Very high	87.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-0.1	-174	-50.7	-71	0	0	0	113.9	W1043 M1052 I1054 F1070 C1071 S1072 Y1108 G1109 L1114 F1129 M1133 R1138	W1043-F1074 HydrophobicContact CH2-CD1 4.37Å; W1043-F1074 AromaticContact CH2-CE1 3.73Å; W1043-F1074 HydrophobicContact CH2-CE1 3.73Å; W1043-F1074 HydrophobicContact CH2-CZ 4.23Å; W1043-F1074 HydrophobicContact CZ3-CE1 4.13Å; W1043-F1074 HydrophobicContact CZ3-CZ 4.36Å; M1052-F1074 HydrophobicContact CE-CD1 4.12Å; M1052-F1074 HydrophobicContact CE-CE1 3.64Å; I1054-F1074 HydrophobicContact CD1-CE1 3.74Å; I1054-F1074 HydrophobicContact CD1-CE2 4.16Å; I1054-F1074 HydrophobicContact CD1-CZ 3.51Å; F1070-F1074 AromaticContact CD1-CE2 3.99Å; F1070-F1074 HydrophobicContact CD1-CE2 3.99Å; F1070-F1074 HydrophobicContact CD2-CE2 4.49Å; F1070-F1074 AromaticContact CE1-CE2 3.8Å; F1070-F1074 HydrophobicContact CE1-CE2 3.8Å; F1070-F1074 AromaticContact CE1-CZ 3.95Å; F1070-F1074 HydrophobicContact CE1-CZ 3.95Å; F1070-F1074 HydrophobicContact CE2-CE2 4.34Å; F1070-F1074 HydrophobicContact CE2-CZ 4.11Å; F1070-F1074 HydrophobicContact CG-CE2 4.32Å; F1070-F1074 AromaticContact CZ-CE2 3.99Å; F1070-F1074 HydrophobicContact CZ-CE2 3.99Å; F1070-F1074 AromaticContact CZ-CZ 3.71Å; F1070-F1074 HydrophobicContact CZ-CZ 3.71Å; F1070-F1074 WeakPolarHBondContact O-CD2 3.17Å; F1070-F1074 WeakPolarHBondContact O-CE2 3.4Å; C1071-F1074 PolarHBondContact O-N 3.34Å; S1072-F1074 PolarHBondContact O-N 3.1Å; F1074-Y1108 HydrophobicContact CD1-CD1 4.49Å; F1074-G1109 CarbonylContact O-C 3.59Å; F1074-G1109 VanDerWaalsContact O-C 3.3Å; F1074-L1114 HydrophobicContact CB-CD2 4.22Å; F1074-L1114 HydrophobicContact CD1-CD2 3.84Å; F1074-L1114 HydrophobicContact CE1-CD2 4.5Å; F1074-L1114 HydrophobicContact CG-CD2 4.03Å; F1074-F1129 HydrophobicContact CD2-CE2 4.25Å; F1074-F1129 HydrophobicContact CD2-CZ 4.27Å; F1074-F1129 AromaticContact CE2-CE2 3.92Å; F1074-F1129 HydrophobicContact CE2-CE2 3.92Å; F1074-F1129 AromaticContact CE2-CZ 3.79Å; F1074-F1129 HydrophobicContact CE2-CZ 3.79Å; F1074-F1129 HydrophobicContact CZ-CZ 4.5Å; F1074-M1133 HydrophobicContact CB-CE 3.74Å; F1074-M1133 HydrophobicContact CD2-CE 3.7Å; F1074-M1133 HydrophobicContact CD2-SD 4.49Å; F1074-M1133 HydrophobicContact CG-CE 3.77Å; F1074-R1138 HydrophobicContact CB-CG 4.49Å; F1074-R1138 PolarHBondContact O-NE 3.28Å; F1074-R1138 PolarHBondContact O-NH2 2.9Å
1075	F	92.3	Very high	88.3	Confident	13 Å²	13	36.8 Å²	36.8	6%	0.057	20%	0.199	C	C	.	.	S	Bend	trans	-115.1	165.6	178.4	-63.8	-74.1	0	0	0	111.8	C1071 I1081 L1083 T1099 R1107 M1133 L1136 R1138	C1071-F1075 HydrophobicContact CB-CE2 4.49Å; C1071-F1075 VanDerWaalsContact O-CD2 3.25Å; C1071-F1075 WeakPolarHBondContact O-CD2 3.47Å; F1075-I1081 HydrophobicContact CB-CD1 3.82Å; F1075-I1081 HydrophobicContact CD1-CD1 3.46Å; F1075-I1081 VanDerWaalsContact CD1-CD1 3.46Å; F1075-I1081 HydrophobicContact CE1-CD1 4.16Å; F1075-I1081 HydrophobicContact CG-CD1 3.69Å; F1075-L1083 HydrophobicContact CD2-CD2 4.43Å; F1075-L1083 HydrophobicContact CE2-CD2 3.84Å; F1075-T1099 HydrophobicContact CD2-CG2 3.98Å; F1075-R1107 WeakPolarHBondContact O-CD 3.3Å; F1075-M1133 HydrophobicContact CE2-SD 4.11Å; F1075-M1133 HydrophobicContact CZ-SD 4.19Å; F1075-L1136 HydrophobicContact CE1-CD1 4.32Å; F1075-L1136 HydrophobicContact CE2-CD1 4.26Å; F1075-L1136 HydrophobicContact CZ-CB 4.41Å; F1075-L1136 HydrophobicContact CZ-CD1 3.62Å; F1075-R1138 HydrophobicContact CE1-CB 3.87Å; F1075-R1138 HydrophobicContact CE1-CG 3.73Å; F1075-R1138 HydrophobicContact CZ-CB 3.81Å; F1075-R1138 HydrophobicContact CZ-CG 3.75Å
1076	D	89.5	Confident	88.5	Confident	45 Å²	45	34.4 Å²	34.4	24%	0.241	18%	0.184	C	C	.	.			trans	-83	141.9	176.4	-63.6	-30.2	0	0	0	109.9	D1078 G1109 S1110	D1076-D1078 VanDerWaalsContact C-N 3.29Å; D1076-D1078 WeakPolarHBondContact CB-OD1 3.3Å; D1076-D1078 PolarHBondContact O-N 3.08Å; D1076-G1109 WeakPolarHBondContact OD1-CA 3.47Å; D1076-S1110 PolarHBondContact OD1-N 3.21Å; D1076-S1110 WeakPolarHBondContact OD2-CB 3.47Å; D1076-S1110 PolarHBondContact OD2-OG 2.89Å
1077	G	81.9	Confident	88.7	Confident	52 Å²	52	37 Å²	37	54%	0.536	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	12.6	-173.1	0	0	0	0	0	115.7
1078	D	79.9	Confident	88.6	Confident	113 Å²	113	38.4 Å²	38.4	60%	0.604	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-9.5	177.9	69.7	-58.7	0	0	0	113.5	D1076	D1076-D1078 VanDerWaalsContact C-N 3.29Å; D1076-D1078 WeakPolarHBondContact CB-OD1 3.3Å; D1076-D1078 PolarHBondContact O-N 3.08Å
1079	K	81.1	Confident	88.6	Confident	139 Å²	139	40.1 Å²	40.1	60%	0.604	20%	0.203	S	C	*	.	S	Bend	trans	-147.7	131.5	-178.4	-64.6	-179.4	-170.7	87.4	0	111.1
1080	E	86.6	Confident	88.3	Confident	93 Å²	93	42.2 Å²	42.2	44%	0.435	22%	0.217	S	C	.	.			trans	-66.6	133	164.4	-167.7	-169.1	-149.5	0	0	109.8	R1098	E1080-R1098 HydrophobicContact CG-CB 4.08Å; E1080-R1098 WeakPolarHBondContact OE1-CB 3.28Å; E1080-R1098 WeakPolarHBondContact OE1-CD 3.22Å; E1080-R1098 IonicContact OE2-CZ 3.6Å; E1080-R1098 IonicContact OE2-NH1 2.71Å; E1080-R1098 PolarHBondContact OE2-NH1 2.71Å
1081	I	90.4	Very high	88.1	Confident	49 Å²	49	43.7 Å²	43.7	25%	0.251	23%	0.231	S	C	.	.			trans	-115.2	129.6	179.9	-68.9	170	0	0	0	109.3	F1075 L1083 R1098 T1099 L1136	F1075-I1081 HydrophobicContact CB-CD1 3.82Å; F1075-I1081 HydrophobicContact CD1-CD1 3.46Å; F1075-I1081 VanDerWaalsContact CD1-CD1 3.46Å; F1075-I1081 HydrophobicContact CE1-CD1 4.16Å; F1075-I1081 HydrophobicContact CG-CD1 3.69Å; I1081-L1083 HydrophobicContact CG2-CD2 4.42Å; I1081-L1083 PolarHBondContact O-N 3.15Å; I1081-R1098 WeakPolarHBondContact O-CA 3.23Å; I1081-T1099 HydrophobicContact CB-CG2 3.95Å; I1081-T1099 PolarHBondContact N-OG1 3.02Å; I1081-T1099 PolarHBondContact O-N 2.61Å; I1081-L1136 HydrophobicContact CG2-CD1 3.96Å
1082	L	91.3	Very high	87.7	Confident	55 Å²	55	45.8 Å²	45.8	29%	0.288	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	114.6	167.4	-176.8	67.9	0	0	0	108.8	D1084 K1085 E1096 R1098	L1082-D1084 WeakPolarHBondContact CD1-O 3.41Å; L1082-K1085 HydrophobicContact CD1-CG 4.35Å; L1082-K1085 HydrophobicContact CD2-CG 4.16Å; L1082-E1096 HydrophobicContact CD1-CB 3.65Å; L1082-E1096 HydrophobicContact CD1-CG 3.93Å; L1082-R1098 HydrophobicContact CD1-CG 3.99Å
1083	L	90.4	Very high	87.5	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-49.9	179.7	-62.7	175.4	0	0	0	110.4	A1068 C1071 F1075 I1081 L1097 T1099 I1132 L1136	A1068-L1083 HydrophobicContact CB-CD1 4.44Å; C1071-L1083 HydrophobicContact CB-CD1 3.59Å; C1071-L1083 HydrophobicContact CB-CD2 3.8Å; C1071-L1083 HydrophobicContact CB-CG 4.37Å; F1075-L1083 HydrophobicContact CD2-CD2 4.43Å; F1075-L1083 HydrophobicContact CE2-CD2 3.84Å; I1081-L1083 HydrophobicContact CG2-CD2 4.42Å; I1081-L1083 PolarHBondContact O-N 3.15Å; L1083-L1097 WeakPolarHBondContact CA-O 3.03Å; L1083-L1097 HydrophobicContact CB-CB 4.44Å; L1083-L1097 HydrophobicContact CB-CD2 4.27Å; L1083-L1097 HydrophobicContact CB-CG 4.27Å; L1083-L1097 WeakPolarHBondContact CB-O 3.44Å; L1083-L1097 HydrophobicContact CD1-CG 4.38Å; L1083-L1097 PolarHBondContact N-O 2.67Å; L1083-T1099 HydrophobicContact CD1-CG2 4.22Å; L1083-T1099 HydrophobicContact CD2-CG2 3.77Å; L1083-T1099 HydrophobicContact CG-CG2 4.08Å; L1083-I1132 HydrophobicContact CB-CD1 4.27Å; L1083-I1132 HydrophobicContact CB-CG2 3.87Å; L1083-I1132 HydrophobicContact CD2-CG2 3.85Å; L1083-I1132 HydrophobicContact CG-CG2 4.42Å; L1083-L1136 HydrophobicContact CD2-CD1 3.91Å
1084	D	88.8	Confident	87.3	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.016	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	173.3	171.2	-155.8	8.9	0	0	0	111.8	L1082 L1097 Y1131 I1132 K1135 S1172	L1082-D1084 WeakPolarHBondContact CD1-O 3.41Å; D1084-L1097 PolarHBondContact N-O 3.49Å; D1084-L1097 PolarHBondContact O-N 2.69Å; D1084-Y1131 WeakPolarHBondContact OD2-CE1 3.34Å; D1084-I1132 HydrophobicContact CB-CD1 4.5Å; D1084-I1132 HydrophobicContact CB-CG1 4.24Å; D1084-K1135 IonicContact OD1-NZ 3.47Å; D1084-K1135 PolarHBondContact OD1-NZ 3.49Å; D1084-S1172 WeakPolarHBondContact OD2-CB 3.33Å; D1084-S1172 PolarHBondContact OD2-OG 3Å
1085	K	88.6	Confident	87	Confident	46 Å²	46	55.5 Å²	55.5	20%	0.2	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	135	158.5	-42.7	-162.8	-162	77.6	0	110.1	L1082 T1094 T1095 E1096 S1172 E1173	L1082-K1085 HydrophobicContact CD1-CG 4.35Å; L1082-K1085 HydrophobicContact CD2-CG 4.16Å; K1085-T1094 HydrophobicContact CB-CG2 3.69Å; K1085-T1094 HydrophobicContact CD-CG2 4.04Å; K1085-T1095 CarbonylContact C-O 3.59Å; K1085-T1095 WeakPolarHBondContact CA-O 3.46Å; K1085-E1096 HydrophobicContact CD-CG 4.04Å; K1085-E1096 VanDerWaalsContact CE-OE1 3.26Å; K1085-E1096 WeakPolarHBondContact CE-OE1 3.32Å; K1085-E1096 HydrophobicContact CG-CG 4.13Å; K1085-S1172 CarbonylContact O-C 3.52Å; K1085-E1173 HydrophobicContact CB-CB 4.12Å; K1085-E1173 IonicContact NZ-OE1 3.7Å; K1085-E1173 PolarHBondContact NZ-OE1 3.33Å; K1085-E1173 IonicContact NZ-OE2 3.72Å; K1085-E1173 PolarHBondContact NZ-OE2 3.03Å; K1085-E1173 PolarHBondContact O-N 3.46Å
1086	L	88.2	Confident	86.9	Confident	18 Å²	18	59 Å²	59	9%	0.094	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	126.3	179.2	-55.6	-175.2	0	0	0	109.1	T1094 T1095 E1128 H1151 V1170 H1171	L1086-T1094 CarbonylContact O-C 3.53Å; L1086-T1094 VanDerWaalsContact O-CA 3.28Å; L1086-T1094 WeakPolarHBondContact O-CA 3.3Å; L1086-T1095 PolarHBondContact N-O 3.16Å; L1086-T1095 PolarHBondContact O-N 3.48Å; L1086-E1128 WeakPolarHBondContact CD2-OE1 3.36Å; L1086-H1151 WeakPolarHBondContact CD2-NE2 3.36Å; L1086-V1170 HydrophobicContact CB-CG1 3.86Å; L1086-V1170 HydrophobicContact CD1-CG1 4.44Å; L1086-H1171 WeakPolarHBondContact CA-O 3.18Å
1087	Y	87.1	Confident	86.9	Confident	67 Å²	67	58.5 Å²	58.5	26%	0.263	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	116.5	173.9	175.7	-107.2	0	0	0	109.7	R1089 V1170 H1171	Y1087-R1089 HydrophobicContact CE1-CB 4.13Å; Y1087-V1170 WeakPolarHBondContact O-CA 3.48Å; Y1087-H1171 AromaticContact CD1-NE2 3.53Å; Y1087-H1171 PolarHBondContact N-O 2.91Å; Y1087-H1171 PolarHBondContact O-N 3.17Å
1088	D	88	Confident	87.3	Confident	29 Å²	29	60.1 Å²	60.1	16%	0.155	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	107.9	171	-177.7	-5.2	0	0	0	109.4	S1090 S1091 G1092 T1093 K1154 T1169 V1170	D1088-S1090 VanDerWaalsContact C-N 3.25Å; D1088-S1090 PolarHBondContact O-N 3.34Å; D1088-S1090 PolarHBondContact OD1-N 3.14Å; D1088-S1090 PolarHBondContact OD1-OG 3.2Å; D1088-S1091 WeakPolarHBondContact CB-OG 3.24Å; D1088-S1091 PolarHBondContact O-N 3.14Å; D1088-S1091 PolarHBondContact O-OG 2.93Å; D1088-S1091 PolarHBondContact OD2-OG 2.9Å; D1088-G1092 WeakPolarHBondContact O-CA 3.22Å; D1088-G1092 PolarHBondContact O-N 2.7Å; D1088-T1093 PolarHBondContact N-O 3.06Å; D1088-T1093 PolarHBondContact O-N 2.62Å; D1088-K1154 IonicContact OD1-NZ 3.44Å; D1088-K1154 PolarHBondContact OD1-NZ 2.67Å; D1088-K1154 IonicContact OD2-NZ 3.69Å; D1088-K1154 PolarHBondContact OD2-NZ 2.81Å; D1088-T1169 CarbonylContact C-O 3.38Å; D1088-T1169 WeakPolarHBondContact CA-O 3.34Å; D1088-T1169 PolarHBondContact OD1-OG1 2.61Å; D1088-V1170 HydrophobicContact CB-CG2 4.03Å
1089	R	88.2	Confident	87.9	Confident	48 Å²	48	55 Å²	55	18%	0.181	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-35.3	179.1	175.3	59	-173.4	-170.5	-6.7	112.9	N931 N932 Q936 Y1087 T1169	N931-R1089 WeakPolarHBondContact O-CG 3.39Å; N931-R1089 PolarHBondContact O-NE 3Å; N932-R1089 WeakPolarHBondContact O-CG 3.15Å; Q936-R1089 VanDerWaalsContact CD-NH2 3.29Å; Y1087-R1089 HydrophobicContact CE1-CB 4.13Å; R1089-T1169 WeakPolarHBondContact CB-O 3.35Å; R1089-T1169 PolarHBondContact N-O 2.93Å
1090	S	82.6	Confident	88.2	Confident	50 Å²	50	51 Å²	51	35%	0.35	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-25.8	-173.2	66.9	0	0	0	0	113.6	D1088 K1154	D1088-S1090 VanDerWaalsContact C-N 3.25Å; D1088-S1090 PolarHBondContact O-N 3.34Å; D1088-S1090 PolarHBondContact OD1-N 3.14Å; D1088-S1090 PolarHBondContact OD1-OG 3.2Å; S1090-K1154 PolarHBondContact OG-NZ 3.38Å
1091	S	84.3	Confident	88.1	Confident	64 Å²	64	52.7 Å²	52.7	45%	0.448	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-18.5	171.2	61.2	0	0	0	0	113	D1088 T1093	D1088-S1091 WeakPolarHBondContact CB-OG 3.24Å; D1088-S1091 PolarHBondContact O-N 3.14Å; D1088-S1091 PolarHBondContact O-OG 2.93Å; D1088-S1091 PolarHBondContact OD2-OG 2.9Å; S1091-T1093 VanDerWaalsContact C-N 3.26Å; S1091-T1093 PolarHBondContact O-N 3.41Å; S1091-T1093 PolarHBondContact OG-N 3.04Å; S1091-T1093 PolarHBondContact OG-OG1 3.43Å
1092	G	84.8	Confident	87.7	Confident	45 Å²	45	58.5 Å²	58.5	46%	0.464	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	14.3	-171.8	0	0	0	0	0	114.1	D1088	D1088-G1092 WeakPolarHBondContact O-CA 3.22Å; D1088-G1092 PolarHBondContact O-N 2.7Å
1093	T	87.3	Confident	87.5	Confident	71 Å²	71	58 Å²	58	44%	0.436	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	141.5	-174	61.2	0	0	0	0	112.7	D1088 S1091	D1088-T1093 PolarHBondContact N-O 3.06Å; D1088-T1093 PolarHBondContact O-N 2.62Å; S1091-T1093 VanDerWaalsContact C-N 3.26Å; S1091-T1093 PolarHBondContact O-N 3.41Å; S1091-T1093 PolarHBondContact OG-N 3.04Å; S1091-T1093 PolarHBondContact OG-OG1 3.43Å
1094	T	88.1	Confident	87.5	Confident	82 Å²	82	60.2 Å²	60.2	50%	0.503	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	126.3	164.7	-54	0	0	0	0	110	K1085 L1086	K1085-T1094 HydrophobicContact CB-CG2 3.69Å; K1085-T1094 HydrophobicContact CD-CG2 4.04Å; L1086-T1094 CarbonylContact O-C 3.53Å; L1086-T1094 VanDerWaalsContact O-CA 3.28Å; L1086-T1094 WeakPolarHBondContact O-CA 3.3Å
1095	T	87.8	Confident	87.4	Confident	81 Å²	81	62 Å²	62	50%	0.497	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	145.6	168.7	52.4	0	0	0	0	110.3	K1085 L1086	K1085-T1095 CarbonylContact C-O 3.59Å; K1085-T1095 WeakPolarHBondContact CA-O 3.46Å; L1086-T1095 PolarHBondContact N-O 3.16Å; L1086-T1095 PolarHBondContact O-N 3.48Å
1096	E	89.9	Confident	87.5	Confident	88 Å²	88	62.4 Å²	62.4	41%	0.411	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	121.3	176	-68	-160.9	150.7	0	0	110	L1082 K1085 R1098	L1082-E1096 HydrophobicContact CD1-CB 3.65Å; L1082-E1096 HydrophobicContact CD1-CG 3.93Å; K1085-E1096 HydrophobicContact CD-CG 4.04Å; K1085-E1096 VanDerWaalsContact CE-OE1 3.26Å; K1085-E1096 WeakPolarHBondContact CE-OE1 3.32Å; K1085-E1096 HydrophobicContact CG-CG 4.13Å; E1096-R1098 HydrophobicContact CB-CG 4.44Å; E1096-R1098 IonicContact OE2-CZ 3.73Å; E1096-R1098 IonicContact OE2-NE 2.83Å; E1096-R1098 PolarHBondContact OE2-NE 3.03Å; E1096-R1098 IonicContact OE2-NH2 2.72Å; E1096-R1098 PolarHBondContact OE2-NH2 2.81Å
1097	L	89.1	Confident	87.7	Confident	33 Å²	33	64.3 Å²	64.3	17%	0.173	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	120.4	172.5	-169	71.7	0	0	0	107.9	I1067 A1068 L1083 D1084 I1132	I1067-L1097 HydrophobicContact CG2-CD2 4.17Å; A1068-L1097 HydrophobicContact CB-CD1 3.92Å; A1068-L1097 HydrophobicContact CB-CG 4.42Å; L1083-L1097 WeakPolarHBondContact CA-O 3.03Å; L1083-L1097 HydrophobicContact CB-CB 4.44Å; L1083-L1097 HydrophobicContact CB-CD2 4.27Å; L1083-L1097 HydrophobicContact CB-CG 4.27Å; L1083-L1097 WeakPolarHBondContact CB-O 3.44Å; L1083-L1097 HydrophobicContact CD1-CG 4.38Å; L1083-L1097 PolarHBondContact N-O 2.67Å; D1084-L1097 PolarHBondContact N-O 3.49Å; D1084-L1097 PolarHBondContact O-N 2.69Å; L1097-I1132 HydrophobicContact CD2-CD1 3.78Å
1098	R	91.9	Very high	88	Confident	87 Å²	87	61.5 Å²	61.5	33%	0.328	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	157.4	-173.2	-73.9	168.3	169.9	-100.2	-3.3	111.2	A1068 E1080 I1081 L1082 E1096	A1068-R1098 WeakPolarHBondContact CB-O 3.48Å; E1080-R1098 HydrophobicContact CG-CB 4.08Å; E1080-R1098 WeakPolarHBondContact OE1-CB 3.28Å; E1080-R1098 WeakPolarHBondContact OE1-CD 3.22Å; E1080-R1098 IonicContact OE2-CZ 3.6Å; E1080-R1098 IonicContact OE2-NH1 2.71Å; E1080-R1098 PolarHBondContact OE2-NH1 2.71Å; I1081-R1098 WeakPolarHBondContact O-CA 3.23Å; L1082-R1098 HydrophobicContact CD1-CG 3.99Å; E1096-R1098 HydrophobicContact CB-CG 4.44Å; E1096-R1098 IonicContact OE2-CZ 3.73Å; E1096-R1098 IonicContact OE2-NE 2.83Å; E1096-R1098 PolarHBondContact OE2-NE 3.03Å; E1096-R1098 IonicContact OE2-NH2 2.72Å; E1096-R1098 PolarHBondContact OE2-NH2 2.81Å
1099	T	91.4	Very high	88	Confident	5 Å²	5	60.5 Å²	60.5	3%	0.031	35%	0.349	C	S	.	.			trans	-67.4	142.8	172.6	53.3	0	0	0	0	111.6	S1072 F1075 I1081 L1083	S1072-T1099 WeakPolarHBondContact OG-CA 3.46Å; S1072-T1099 WeakPolarHBondContact OG-CB 3.49Å; F1075-T1099 HydrophobicContact CD2-CG2 3.98Å; I1081-T1099 HydrophobicContact CB-CG2 3.95Å; I1081-T1099 PolarHBondContact N-OG1 3.02Å; I1081-T1099 PolarHBondContact O-N 2.61Å; L1083-T1099 HydrophobicContact CD1-CG2 4.22Å; L1083-T1099 HydrophobicContact CD2-CG2 3.77Å; L1083-T1099 HydrophobicContact CG-CG2 4.08Å
1100	L	88.6	Confident	87.9	Confident	56 Å²	56	60.6 Å²	60.6	29%	0.293	36%	0.357	S	S	.	.			trans	-70.6	143.1	172.3	-51.4	-177.8	0	0	0	111.1	F1028 S1072 L1103 R1107	F1028-L1100 HydrophobicContact CE2-CD1 3.82Å; F1028-L1100 HydrophobicContact CZ-CD1 3.59Å; S1072-L1100 PolarHBondContact OG-N 2.79Å; L1100-L1103 HydrophobicContact CB-CD2 4.23Å; L1100-L1103 HydrophobicContact CD1-CD2 4.08Å; L1100-R1107 PolarHBondContact O-NH1 2.61Å; L1100-R1107 PolarHBondContact O-NH2 3.49Å
1101	D	83.6	Confident	88.1	Confident	127 Å²	127	67 Å²	67	68%	0.679	38%	0.379	S	S	*	.	S	Bend	trans	-70.7	-44.3	174	-69.7	-38.7	0	0	0	112.4	R1107	D1101-R1107 VanDerWaalsContact C-NH2 3.3Å; D1101-R1107 PolarHBondContact O-NH2 2.78Å
1102	E	82.8	Confident	88.5	Confident	172 Å²	172	66.7 Å²	66.7	80%	0.804	37%	0.369	S	S	*	.			trans	-107.7	145.3	178.7	-63.8	-169.2	164.7	0	0	111.3
1103	L	86.6	Confident	88.9	Confident	44 Å²	44	66.3 Å²	66.3	23%	0.23	36%	0.359	C	S	.	.			trans	-142.3	155.9	177.6	-70	176	0	0	0	110.3	Y1073 L1100 R1107	Y1073-L1103 HydrophobicContact CD1-CD1 4.09Å; Y1073-L1103 HydrophobicContact CD2-CD1 4.23Å; Y1073-L1103 HydrophobicContact CE1-CB 4.48Å; Y1073-L1103 HydrophobicContact CE1-CD1 4.24Å; Y1073-L1103 HydrophobicContact CE2-CD1 4.38Å; Y1073-L1103 HydrophobicContact CE2-CD2 4.19Å; Y1073-L1103 HydrophobicContact CG-CD1 4.08Å; L1100-L1103 HydrophobicContact CB-CD2 4.23Å; L1100-L1103 HydrophobicContact CD1-CD2 4.08Å; L1103-R1107 HydrophobicContact CD1-CG 3.89Å
1104	T	89.6	Confident	89.4	Confident	48 Å²	48	63.4 Å²	63.4	29%	0.294	34%	0.341	S	S	.	.	S	Bend	trans	-79.5	127.5	167.6	-50.3	0	0	0	0	109	Q1036 V1039 Y1073	Q1036-T1104 HydrophobicContact CB-CG2 4.17Å; V1039-T1104 HydrophobicContact CB-CG2 4.5Å; V1039-T1104 HydrophobicContact CG2-CG2 4.07Å; V1039-T1104 VanDerWaalsContact CG2-O 3.29Å; V1039-T1104 WeakPolarHBondContact CG2-O 3.05Å; Y1073-T1104 VanDerWaalsContact CE1-O 3.3Å; Y1073-T1104 WeakPolarHBondContact CE1-O 3.4Å; Y1073-T1104 PolarHBondContact OH-O 2.93Å
1105	G	87.9	Confident	89.8	Confident	41 Å²	41	59.6 Å²	59.6	42%	0.423	32%	0.317	S	S	.	.	S	Bend	trans	79.2	-175.7	-178.5	0	0	0	0	0	115
1106	A	90.5	Very high	90.3	Very high	54 Å²	54	55.7 Å²	55.7	45%	0.446	29%	0.294	S	S	.	.			trans	-83.6	143	-174.9	0	0	0	0	0	112.8	W1043 V1047	W1043-A1106 PolarHBondContact NE1-O 2.81Å; V1047-A1106 HydrophobicContact CG2-CB 4.24Å
1107	R	91.8	Very high	90.7	Very high	59 Å²	59	51.5 Å²	51.5	22%	0.223	27%	0.274	C	S	.	.			trans	-72.2	143.8	168.6	-66.1	178.2	-170.2	-107.6	9.2	110.5	S1072 F1075 L1100 D1101 L1103 G1109	S1072-R1107 PolarHBondContact O-NH1 3.15Å; F1075-R1107 WeakPolarHBondContact O-CD 3.3Å; L1100-R1107 PolarHBondContact O-NH1 2.61Å; L1100-R1107 PolarHBondContact O-NH2 3.49Å; D1101-R1107 VanDerWaalsContact C-NH2 3.3Å; D1101-R1107 PolarHBondContact O-NH2 2.78Å; L1103-R1107 HydrophobicContact CD1-CG 3.89Å; R1107-G1109 VanDerWaalsContact C-N 3.29Å
1108	Y	92.8	Very high	91.2	Very high	7 Å²	7	50 Å²	50	3%	0.027	27%	0.266	C	S	.	.			trans	-70.3	-30.2	169	-163.1	-115.9	0	0	0	111.7	V1047 T1049 A1051 M1052 Y1073 F1074 K1112	V1047-Y1108 HydrophobicContact CG2-CD2 4.36Å; V1047-Y1108 VanDerWaalsContact O-CD2 3.25Å; V1047-Y1108 WeakPolarHBondContact O-CD2 3.45Å; V1047-Y1108 WeakPolarHBondContact O-CE2 3.27Å; T1049-Y1108 WeakPolarHBondContact OG1-CE2 3.48Å; T1049-Y1108 PolarHBondContact OG1-OH 2.88Å; A1051-Y1108 VanDerWaalsContact CA-OH 3.24Å; A1051-Y1108 WeakPolarHBondContact CA-OH 3.44Å; A1051-Y1108 PolarHBondContact N-OH 3.16Å; A1051-Y1108 PolarHBondContact O-OH 2.85Å; M1052-Y1108 HydrophobicContact CB-CE1 4.06Å; M1052-Y1108 HydrophobicContact CB-CE2 4.49Å; M1052-Y1108 WeakPolarHBondContact CB-OH 3.46Å; M1052-Y1108 HydrophobicContact CE-CD1 3.68Å; M1052-Y1108 HydrophobicContact CE-CD2 3.74Å; M1052-Y1108 HydrophobicContact CE-CE1 3.67Å; M1052-Y1108 HydrophobicContact CE-CE2 3.75Å; M1052-Y1108 HydrophobicContact CE-CG 3.71Å; M1052-Y1108 PolarHBondContact N-OH 2.98Å; Y1073-Y1108 WeakPolarHBondContact O-CA 3.23Å; Y1073-Y1108 WeakPolarHBondContact O-CB 3.36Å; Y1073-Y1108 PolarHBondContact O-N 2.83Å; F1074-Y1108 HydrophobicContact CD1-CD1 4.49Å; Y1108-K1112 HydrophobicContact CD1-CB 3.87Å; Y1108-K1112 HydrophobicContact CD1-CD 4.02Å; Y1108-K1112 HydrophobicContact CD2-CD 3.84Å; Y1108-K1112 HydrophobicContact CE1-CB 3.3Å; Y1108-K1112 HydrophobicContact CE1-CD 3.67Å; Y1108-K1112 HydrophobicContact CE1-CG 4.14Å; Y1108-K1112 HydrophobicContact CE2-CD 3.47Å; Y1108-K1112 VanDerWaalsContact CE2-CD 3.47Å; Y1108-K1112 HydrophobicContact CG-CD 4.1Å
1109	G	87.6	Confident	91.4	Very high	8 Å²	8	46.3 Å²	46.3	8%	0.082	25%	0.254	C	S	.	.			trans	79.4	167.2	176.5	0	0	0	0	0	114.1	Y1073 F1074 D1076 R1107 R1138	Y1073-G1109 PolarHBondContact O-N 3.35Å; F1074-G1109 CarbonylContact O-C 3.59Å; F1074-G1109 VanDerWaalsContact O-C 3.3Å; D1076-G1109 WeakPolarHBondContact OD1-CA 3.47Å; R1107-G1109 VanDerWaalsContact C-N 3.29Å; G1109-R1138 PolarHBondContact O-NH2 3.08Å
1110	S	87.1	Confident	91.5	Very high	50 Å²	50	52.9 Å²	52.9	35%	0.35	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-29.8	-174.1	72.4	0	0	0	0	113.7	D1076 K1112 R1138	D1076-S1110 PolarHBondContact OD1-N 3.21Å; D1076-S1110 WeakPolarHBondContact OD2-CB 3.47Å; D1076-S1110 PolarHBondContact OD2-OG 2.89Å; S1110-K1112 VanDerWaalsContact C-N 3.34Å; S1110-K1112 PolarHBondContact O-N 3.44Å; S1110-R1138 PolarHBondContact O-NH2 3.46Å
1111	K	87.7	Confident	91.7	Very high	186 Å²	186	52.2 Å²	52.2	81%	0.809	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-11.5	-163.9	-62.4	171.7	-173	167	0	115.2
1112	K	91.9	Very high	92.2	Very high	57 Å²	57	46.1 Å²	46.1	25%	0.248	25%	0.252	C	S	.	.	S	Bend	trans	-96.6	134.6	-176.8	-64.3	-175.4	-179.8	-165.6	0	111.6	V1047 T1049 Y1108 S1110 R1138	V1047-K1112 PolarHBondContact O-NZ 3.03Å; T1049-K1112 WeakPolarHBondContact O-CD 3.46Å; T1049-K1112 WeakPolarHBondContact O-CE 3.42Å; T1049-K1112 PolarHBondContact O-NZ 3.01Å; Y1108-K1112 HydrophobicContact CD1-CB 3.87Å; Y1108-K1112 HydrophobicContact CD1-CD 4.02Å; Y1108-K1112 HydrophobicContact CD2-CD 3.84Å; Y1108-K1112 HydrophobicContact CE1-CB 3.3Å; Y1108-K1112 HydrophobicContact CE1-CD 3.67Å; Y1108-K1112 HydrophobicContact CE1-CG 4.14Å; Y1108-K1112 HydrophobicContact CE2-CD 3.47Å; Y1108-K1112 VanDerWaalsContact CE2-CD 3.47Å; Y1108-K1112 HydrophobicContact CG-CD 4.1Å; S1110-K1112 VanDerWaalsContact C-N 3.34Å; S1110-K1112 PolarHBondContact O-N 3.44Å; K1112-R1138 PolarHBondContact O-NH1 3.31Å; K1112-R1138 PolarHBondContact O-NH2 3.39Å
1113	S	93.6	Very high	92.5	Very high	37 Å²	37	39 Å²	39	26%	0.259	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	136.5	-177.3	-59.9	0	0	0	0	112	A1051 M1052 H1207	A1051-S1113 CarbonylContact C-O 3.59Å; A1051-S1113 VanDerWaalsContact CA-O 3.24Å; A1051-S1113 WeakPolarHBondContact CA-O 3.44Å; A1051-S1113 WeakPolarHBondContact CB-O 3.27Å; M1052-S1113 PolarHBondContact N-O 2.76Å; S1113-H1207 PolarHBondContact OG-NE2 2.85Å
1114	L	96.6	Very high	92.6	Very high	9 Å²	9	38.1 Å²	38.1	5%	0.047	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	131.9	-171.8	-173.7	62	0	0	0	110.9	M1052 I1054 F1074 M1133 R1138 A1139 M1140	M1052-L1114 HydrophobicContact CB-CD1 3.94Å; M1052-L1114 HydrophobicContact CE-CD1 4.21Å; M1052-L1114 HydrophobicContact CG-CD1 4.07Å; M1052-L1114 WeakPolarHBondContact O-CA 3.49Å; I1054-L1114 HydrophobicContact CD1-CD1 3.97Å; I1054-L1114 HydrophobicContact CD1-CD2 4.5Å; I1054-L1114 HydrophobicContact CG1-CD1 4.01Å; F1074-L1114 HydrophobicContact CB-CD2 4.22Å; F1074-L1114 HydrophobicContact CD1-CD2 3.84Å; F1074-L1114 HydrophobicContact CE1-CD2 4.5Å; F1074-L1114 HydrophobicContact CG-CD2 4.03Å; L1114-M1133 HydrophobicContact CD2-CE 3.38Å; L1114-R1138 HydrophobicContact CD2-CG 4.43Å; L1114-A1139 HydrophobicContact CB-CB 4.33Å; L1114-A1139 HydrophobicContact CD2-CB 4.09Å; L1114-A1139 HydrophobicContact CG-CB 4Å; L1114-A1139 WeakPolarHBondContact O-CA 3.29Å; L1114-M1140 PolarHBondContact O-N 3.2Å; L1114-M1140 VanDerWaalsContact O-N 3.1Å
1115	I	98.1	Very high	92.5	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	142.5	172.7	-58.4	-176.9	0	0	0	108.8	M1052 I1053 I1054 L1117 M1140 I1142 A1200 L1204	M1052-I1115 PolarHBondContact O-N 3.49Å; I1053-I1115 CarbonylContact C-O 3.44Å; I1053-I1115 WeakPolarHBondContact CA-O 3.27Å; I1053-I1115 HydrophobicContact CG1-CB 4.47Å; I1054-I1115 PolarHBondContact N-O 3.14Å; I1115-L1117 HydrophobicContact CG2-CD2 3.99Å; I1115-M1140 CarbonylContact C-O 3.38Å; I1115-M1140 VanDerWaalsContact CA-O 3.31Å; I1115-M1140 WeakPolarHBondContact CA-O 3.47Å; I1115-M1140 HydrophobicContact CD1-CE 3.41Å; I1115-M1140 VanDerWaalsContact CD1-CE 3.41Å; I1115-M1140 HydrophobicContact CG1-CB 4.47Å; I1115-M1140 HydrophobicContact CG1-CE 3.7Å; I1115-I1142 HydrophobicContact CD1-CD1 4.25Å; I1115-I1142 HydrophobicContact CG2-CD1 3.9Å; I1115-I1142 HydrophobicContact CG2-CG1 3.94Å; I1115-A1200 HydrophobicContact CD1-CB 3.87Å; I1115-A1200 HydrophobicContact CG2-CB 3.88Å; I1115-L1204 HydrophobicContact CD1-CD1 3.92Å; I1115-L1204 HydrophobicContact CD1-CD2 3.89Å; I1115-L1204 HydrophobicContact CD1-CG 3.59Å; I1115-L1204 HydrophobicContact CG1-CD1 4.31Å; I1115-L1204 HydrophobicContact CG1-CD2 4.22Å; I1115-L1204 HydrophobicContact CG1-CG 4.29Å
1116	I	98.3	Very high	92.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	136.6	169.1	-54.8	165.1	0	0	0	109.1	I1054 L1056 F1129 V1130 M1133 A1139 M1140 I1141 I1142	I1054-I1116 HydrophobicContact CB-CG1 4.26Å; I1054-I1116 HydrophobicContact CD1-CG1 4.42Å; I1054-I1116 CarbonylContact O-C 3.07Å; I1054-I1116 VanDerWaalsContact O-CA 3.28Å; I1054-I1116 WeakPolarHBondContact O-CA 3.37Å; L1056-I1116 HydrophobicContact CD1-CG2 3.71Å; L1056-I1116 HydrophobicContact CG-CG2 4.02Å; I1116-F1129 HydrophobicContact CD1-CD1 4.24Å; I1116-F1129 HydrophobicContact CD1-CE1 3.61Å; I1116-F1129 HydrophobicContact CD1-CZ 4.29Å; I1116-F1129 HydrophobicContact CG1-CE1 4.33Å; I1116-V1130 HydrophobicContact CG2-CG2 3.89Å; I1116-M1133 HydrophobicContact CD1-CB 3.65Å; I1116-M1133 HydrophobicContact CD1-CG 4.07Å; I1116-A1139 HydrophobicContact CD1-CB 3.62Å; I1116-A1139 HydrophobicContact CG1-CB 3.85Å; I1116-M1140 PolarHBondContact N-O 2.91Å; I1116-I1141 HydrophobicContact CB-CD1 3.8Å; I1116-I1141 HydrophobicContact CD1-CD1 3.84Å; I1116-I1141 HydrophobicContact CG1-CD1 4.21Å; I1116-I1141 WeakPolarHBondContact O-CA 3.49Å; I1116-I1142 PolarHBondContact O-N 2.71Å
1117	L	98.3	Very high	92.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	136.4	176.6	-47	-177.4	0	0	0	111.5	I1053 I1054 D1055 L1056 R1057 I1115 I1142 A1196 L1197 A1200	I1053-L1117 HydrophobicContact CG2-CD1 3.79Å; I1053-L1117 HydrophobicContact CG2-CD2 4.09Å; I1053-L1117 HydrophobicContact CG2-CG 3.76Å; I1054-L1117 PolarHBondContact O-N 2.97Å; D1055-L1117 HydrophobicContact CB-CD1 4.15Å; L1056-L1117 CarbonylContact C-O 3.57Å; L1056-L1117 WeakPolarHBondContact CA-O 3.45Å; L1056-L1117 PolarHBondContact N-O 3.22Å; R1057-L1117 HydrophobicContact CG-CB 3.84Å; R1057-L1117 PolarHBondContact N-O 3.01Å; I1115-L1117 HydrophobicContact CG2-CD2 3.99Å; L1117-I1142 VanDerWaalsContact CA-O 3.28Å; L1117-I1142 WeakPolarHBondContact CA-O 3.37Å; L1117-I1142 HydrophobicContact CD2-CB 4.22Å; L1117-A1196 HydrophobicContact CD2-CB 4.24Å; L1117-L1197 HydrophobicContact CD1-CB 3.86Å; L1117-L1197 HydrophobicContact CD1-CD1 3.94Å; L1117-L1197 HydrophobicContact CD1-CG 4.49Å; L1117-A1200 HydrophobicContact CD2-CB 3.77Å
1118	T	97.9	Very high	92.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	153.7	-176	54.8	0	0	0	0	113.2	T1122 V1130 I1141 I1142 G1143 E1144 T1146	T1118-T1122 HydrophobicContact CG2-CG2 4.4Å; T1118-V1130 HydrophobicContact CG2-CG1 4.14Å; T1118-V1130 HydrophobicContact CG2-CG2 3.84Å; T1118-I1141 HydrophobicContact CG2-CG2 3.73Å; T1118-I1142 PolarHBondContact N-O 2.82Å; T1118-I1142 VanDerWaalsContact N-O 3.08Å; T1118-G1143 WeakPolarHBondContact O-CA 3.48Å; T1118-E1144 WeakPolarHBondContact CB-O 3.36Å; T1118-E1144 PolarHBondContact O-N 3Å; T1118-E1144 PolarHBondContact OG1-O 2.93Å; T1118-T1146 HydrophobicContact CG2-CG2 3.93Å
1119	S	96.6	Very high	92.7	Very high	10 Å²	10	28.2 Å²	28.2	7%	0.07	15%	0.153	C	C	.	.			trans	-139.6	177.1	167.2	91.5	0	0	0	0	110.5	R1057 A1121 T1122 T1145	R1057-S1119 WeakPolarHBondContact O-CB 3.31Å; R1057-S1119 PolarHBondContact O-OG 2.85Å; S1119-A1121 PolarHBondContact O-N 3.1Å; S1119-A1121 VanDerWaalsContact O-N 3.09Å; S1119-A1121 WeakPolarHBondContact OG-CB 3.24Å; S1119-A1121 PolarHBondContact OG-N 3.48Å; S1119-T1122 PolarHBondContact N-OG1 3.08Å; S1119-T1122 WeakPolarHBondContact O-CB 3.33Å; S1119-T1122 PolarHBondContact O-N 3.36Å; S1119-T1122 PolarHBondContact O-OG1 3.39Å; S1119-T1145 CarbonylContact C-O 3.58Å
1120	K	93.3	Very high	93	Very high	143 Å²	143	27.9 Å²	27.9	62%	0.622	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-16.7	169.2	-69.8	167.4	-173.2	123.9	0	114.9	E1144 T1145 A1147	K1120-E1144 WeakPolarHBondContact CE-OE1 3.34Å; K1120-E1144 HydrophobicContact CG-CB 4.45Å; K1120-E1144 WeakPolarHBondContact CG-OE2 3.41Å; K1120-E1144 PolarHBondContact N-OE2 2.83Å; K1120-E1144 IonicContact NZ-OE1 2.67Å; K1120-E1144 PolarHBondContact NZ-OE1 3.11Å; K1120-E1144 IonicContact NZ-OE2 2.7Å; K1120-T1145 WeakPolarHBondContact CA-O 3.41Å; K1120-T1145 PolarHBondContact N-O 2.97Å; K1120-A1147 WeakPolarHBondContact O-CB 3.07Å
1121	A	92.7	Very high	93.2	Very high	42 Å²	42	26.4 Å²	26.4	35%	0.347	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-10.4	175.3	0	0	0	0	0	113.7	S1119 A1123	S1119-A1121 PolarHBondContact O-N 3.1Å; S1119-A1121 VanDerWaalsContact O-N 3.09Å; S1119-A1121 WeakPolarHBondContact OG-CB 3.24Å; S1119-A1121 PolarHBondContact OG-N 3.48Å; A1121-A1123 PolarHBondContact O-N 2.9Å
1122	T	93.8	Very high	93.4	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.098	C	C	.	.			trans	-67.5	117.4	172.7	-53.1	0	0	0	0	109.2	L1056 N1059 T1118 S1119 A1126 E1127 T1146 A1147	L1056-T1122 HydrophobicContact CB-CG2 4.17Å; L1056-T1122 PolarHBondContact O-OG1 3.32Å; N1059-T1122 CarbonylContact O-C 3.59Å; N1059-T1122 VanDerWaalsContact O-CA 3.29Å; N1059-T1122 WeakPolarHBondContact O-CA 3.04Å; T1118-T1122 HydrophobicContact CG2-CG2 4.4Å; S1119-T1122 PolarHBondContact N-OG1 3.08Å; S1119-T1122 WeakPolarHBondContact O-CB 3.33Å; S1119-T1122 PolarHBondContact O-N 3.36Å; S1119-T1122 PolarHBondContact O-OG1 3.39Å; T1122-A1126 HydrophobicContact CG2-CB 3.79Å; T1122-E1127 WeakPolarHBondContact O-CG 3.33Å; T1122-T1146 HydrophobicContact CG2-CG2 3.9Å; T1122-T1146 WeakPolarHBondContact O-CB 3.29Å; T1122-A1147 VanDerWaalsContact O-CB 3.29Å; T1122-A1147 WeakPolarHBondContact O-CB 3.44Å; T1122-A1147 PolarHBondContact O-N 2.85Å
1123	A	89.6	Confident	93.4	Very high	21 Å²	21	14.9 Å²	14.9	17%	0.174	9%	0.086	C	C	.	.			trans	-136.3	155.7	-169.1	0	0	0	0	0	115.3	N1059 G1061 A1121 A1125 A1126 E1127 A1147	N1059-A1123 PolarHBondContact O-N 2.82Å; G1061-A1123 WeakPolarHBondContact CA-O 3.44Å; G1061-A1123 PolarHBondContact N-O 3.42Å; A1121-A1123 PolarHBondContact O-N 2.9Å; A1123-A1125 PolarHBondContact O-N 2.85Å; A1123-A1126 WeakPolarHBondContact O-CB 3.48Å; A1123-A1126 PolarHBondContact O-N 3.45Å; A1123-A1126 VanDerWaalsContact O-N 3.09Å; A1123-E1127 WeakPolarHBondContact CA-OE2 3.08Å; A1123-A1147 HydrophobicContact CB-CB 3.89Å
1124	S	88.3	Confident	93.4	Very high	27 Å²	27	16.3 Å²	16.3	19%	0.189	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	-119.8	168.1	-171.1	0	0	0	0	113.8	A1126 E1127 E1128 S1150	S1124-A1126 PolarHBondContact O-N 3.3Å; S1124-E1127 PolarHBondContact N-OE2 3.1Å; S1124-E1127 WeakPolarHBondContact O-CA 3.34Å; S1124-E1127 VanDerWaalsContact O-CB 3.26Å; S1124-E1127 WeakPolarHBondContact O-CB 3.32Å; S1124-E1127 PolarHBondContact O-N 2.67Å; S1124-E1128 PolarHBondContact O-N 2.78Å; S1124-S1150 PolarHBondContact OG-O 2.89Å
1125	A	89.1	Confident	93	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-54.8	-27.5	-179.8	0	0	0	0	0	114.5	F1025 G1062 T1064 I1067 A1123 F1129	F1025-A1125 HydrophobicContact CB-CB 4.24Å; F1025-A1125 HydrophobicContact CD2-CB 4.26Å; F1025-A1125 HydrophobicContact CG-CB 4.14Å; G1062-A1125 WeakPolarHBondContact O-CB 3.46Å; T1064-A1125 HydrophobicContact CG2-CB 4.15Å; I1067-A1125 HydrophobicContact CD1-CB 3.93Å; I1067-A1125 WeakPolarHBondContact CD1-O 3.31Å; I1067-A1125 HydrophobicContact CG1-CB 4.35Å; A1123-A1125 PolarHBondContact O-N 2.85Å; A1125-F1129 WeakPolarHBondContact O-CB 3.27Å; A1125-F1129 PolarHBondContact O-N 2.74Å
1126	A	91.9	Very high	92.6	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-72.1	-32.4	173.6	0	0	0	0	0	112.4	F1025 L1056 N1059 T1122 A1123 S1124 V1130	F1025-A1126 HydrophobicContact CD2-CB 4.33Å; F1025-A1126 HydrophobicContact CE2-CB 3.79Å; L1056-A1126 HydrophobicContact CD1-CB 4.46Å; N1059-A1126 HydrophobicContact CB-CB 4.12Å; N1059-A1126 WeakPolarHBondContact OD1-CB 3.39Å; T1122-A1126 HydrophobicContact CG2-CB 3.79Å; A1123-A1126 WeakPolarHBondContact O-CB 3.48Å; A1123-A1126 PolarHBondContact O-N 3.45Å; A1123-A1126 VanDerWaalsContact O-N 3.09Å; S1124-A1126 PolarHBondContact O-N 3.3Å; A1126-V1130 WeakPolarHBondContact O-CB 3.41Å; A1126-V1130 WeakPolarHBondContact O-CG2 3.39Å; A1126-V1130 PolarHBondContact O-N 2.99Å
1127	E	91.6	Very high	92.3	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-69.9	-45.3	173.8	-64	-174.2	96.2	0	0	111.1	T1122 A1123 S1124 F1129 V1130 Y1131 T1146 A1147 G1148 G1149 W1180 I1185	T1122-E1127 WeakPolarHBondContact O-CG 3.33Å; A1123-E1127 WeakPolarHBondContact CA-OE2 3.08Å; S1124-E1127 PolarHBondContact N-OE2 3.1Å; S1124-E1127 WeakPolarHBondContact O-CA 3.34Å; S1124-E1127 VanDerWaalsContact O-CB 3.26Å; S1124-E1127 WeakPolarHBondContact O-CB 3.32Å; S1124-E1127 PolarHBondContact O-N 2.67Å; E1127-F1129 PolarHBondContact O-N 2.67Å; E1127-V1130 CarbonylContact O-C 3.56Å; E1127-V1130 PolarHBondContact O-N 2.92Å; E1127-Y1131 VanDerWaalsContact O-CB 3.31Å; E1127-Y1131 WeakPolarHBondContact O-CB 3.43Å; E1127-Y1131 PolarHBondContact O-N 3.34Å; E1127-T1146 HydrophobicContact CG-CG2 4.3Å; E1127-T1146 WeakPolarHBondContact OE1-CB 3.42Å; E1127-T1146 PolarHBondContact OE1-OG1 3.45Å; E1127-A1147 PolarHBondContact OE1-N 2.97Å; E1127-A1147 VanDerWaalsContact OE1-N 3.16Å; E1127-G1148 WeakPolarHBondContact OE1-CA 3.35Å; E1127-G1148 PolarHBondContact OE1-N 3.11Å; E1127-G1149 PolarHBondContact OE2-N 3.37Å; E1127-W1180 HydrophobicContact CB-CD2 4.38Å; E1127-W1180 HydrophobicContact CB-CE3 3.54Å; E1127-W1180 HydrophobicContact CB-CH2 4.17Å; E1127-W1180 HydrophobicContact CB-CZ3 3.42Å; E1127-W1180 VanDerWaalsContact CB-CZ3 3.42Å; E1127-W1180 HydrophobicContact CG-CE3 4.47Å; E1127-W1180 HydrophobicContact CG-CZ3 4.29Å; E1127-I1185 HydrophobicContact CB-CD1 3.56Å; E1127-I1185 HydrophobicContact CG-CD1 4.21Å; E1127-I1185 VanDerWaalsContact O-CD1 3.24Å; E1127-I1185 WeakPolarHBondContact O-CD1 3.43Å
1128	E	89.9	Confident	92.1	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-60.2	-43.5	175.1	-178.6	169.5	-150.9	0	0	111.6	T1064 I1067 L1086 S1124 Y1131 I1132 H1151 W1180	T1064-E1128 WeakPolarHBondContact CB-OE2 3.45Å; T1064-E1128 WeakPolarHBondContact CG2-OE2 3.21Å; I1067-E1128 HydrophobicContact CD1-CB 3.78Å; I1067-E1128 HydrophobicContact CD1-CG 3.71Å; I1067-E1128 WeakPolarHBondContact CD1-OE2 3.48Å; L1086-E1128 WeakPolarHBondContact CD2-OE1 3.36Å; S1124-E1128 PolarHBondContact O-N 2.78Å; E1128-Y1131 PolarHBondContact O-N 2.89Å; E1128-I1132 HydrophobicContact CG-CD1 3.91Å; E1128-I1132 WeakPolarHBondContact O-CB 3.33Å; E1128-I1132 WeakPolarHBondContact O-CD1 3.37Å; E1128-I1132 VanDerWaalsContact O-CG1 3.26Å; E1128-I1132 WeakPolarHBondContact O-CG1 3.5Å; E1128-I1132 PolarHBondContact O-N 2.83Å; E1128-H1151 IonicContact OE1-CD2 3.37Å; E1128-H1151 IonicContact OE1-CE1 3.85Å; E1128-H1151 IonicContact OE1-NE2 2.86Å; E1128-H1151 PolarHBondContact OE1-NE2 3.4Å; E1128-H1151 IonicContact OE2-CD2 2.7Å; E1128-H1151 IonicContact OE2-NE2 2.76Å; E1128-H1151 PolarHBondContact OE2-NE2 2.77Å; E1128-W1180 HydrophobicContact CB-CH2 4.25Å; E1128-W1180 HydrophobicContact CB-CZ2 3.77Å; E1128-W1180 HydrophobicContact CG-CZ2 4.42Å
1129	F	92.7	Very high	92	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60	-46.5	171.9	175.6	-99.6	0	0	0	112.6	F1025 I1054 L1056 F1070 C1071 F1074 I1116 A1125 E1127 Y1131 I1132 M1133	F1025-F1129 HydrophobicContact CE1-CB 4.5Å; F1025-F1129 HydrophobicContact CZ-CB 3.94Å; F1025-F1129 HydrophobicContact CZ-CD1 4.46Å; F1025-F1129 HydrophobicContact CZ-CG 4.11Å; I1054-F1129 HydrophobicContact CD1-CE1 4.19Å; I1054-F1129 HydrophobicContact CD1-CZ 3.98Å; L1056-F1129 HydrophobicContact CD1-CD1 3.71Å; L1056-F1129 HydrophobicContact CD1-CE1 4.08Å; F1070-F1129 AromaticContact CD1-CD2 3.84Å; F1070-F1129 HydrophobicContact CD1-CD2 3.84Å; F1070-F1129 HydrophobicContact CD1-CE1 4.44Å; F1070-F1129 AromaticContact CD1-CE2 3.4Å; F1070-F1129 HydrophobicContact CD1-CE2 3.4Å; F1070-F1129 VanDerWaalsContact CD1-CE2 3.4Å; F1070-F1129 AromaticContact CD1-CZ 3.74Å; F1070-F1129 HydrophobicContact CD1-CZ 3.74Å; F1070-F1129 HydrophobicContact CE1-CD2 4.42Å; F1070-F1129 HydrophobicContact CE1-CE1 4.08Å; F1070-F1129 AromaticContact CE1-CE2 3.76Å; F1070-F1129 HydrophobicContact CE1-CE2 3.76Å; F1070-F1129 AromaticContact CE1-CZ 3.55Å; F1070-F1129 HydrophobicContact CE1-CZ 3.55Å; F1070-F1129 HydrophobicContact CG-CE2 4.48Å; C1071-F1129 VanDerWaalsContact SG-CD2 3.5Å; F1074-F1129 HydrophobicContact CD2-CE2 4.25Å; F1074-F1129 HydrophobicContact CD2-CZ 4.27Å; F1074-F1129 AromaticContact CE2-CE2 3.92Å; F1074-F1129 HydrophobicContact CE2-CE2 3.92Å; F1074-F1129 AromaticContact CE2-CZ 3.79Å; F1074-F1129 HydrophobicContact CE2-CZ 3.79Å; F1074-F1129 HydrophobicContact CZ-CZ 4.5Å; I1116-F1129 HydrophobicContact CD1-CD1 4.24Å; I1116-F1129 HydrophobicContact CD1-CE1 3.61Å; I1116-F1129 HydrophobicContact CD1-CZ 4.29Å; I1116-F1129 HydrophobicContact CG1-CE1 4.33Å; A1125-F1129 WeakPolarHBondContact O-CB 3.27Å; A1125-F1129 PolarHBondContact O-N 2.74Å; E1127-F1129 PolarHBondContact O-N 2.67Å; F1129-Y1131 VanDerWaalsContact C-N 3.33Å; F1129-Y1131 PolarHBondContact O-N 3.1Å; F1129-I1132 PolarHBondContact O-N 2.89Å; F1129-M1133 HydrophobicContact CD1-CG 4.41Å; F1129-M1133 HydrophobicContact CD2-CG 4.05Å; F1129-M1133 HydrophobicContact CE1-CG 4.13Å; F1129-M1133 HydrophobicContact CE2-CE 4.41Å; F1129-M1133 HydrophobicContact CE2-CG 3.71Å; F1129-M1133 HydrophobicContact CE2-SD 4.15Å; F1129-M1133 HydrophobicContact CG-CG 4.39Å; F1129-M1133 HydrophobicContact CZ-CE 4.13Å; F1129-M1133 HydrophobicContact CZ-CG 3.76Å; F1129-M1133 HydrophobicContact CZ-SD 4.38Å; F1129-M1133 WeakPolarHBondContact O-CB 3.16Å; F1129-M1133 WeakPolarHBondContact O-CG 3.42Å; F1129-M1133 PolarHBondContact O-N 2.99Å
1130	V	93.9	Very high	92	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.5	-41.3	176.3	163.2	0	0	0	0	111.5	L1056 I1116 T1118 A1126 E1127 K1134 I1141 I1185	L1056-V1130 HydrophobicContact CD1-CG2 3.93Å; I1116-V1130 HydrophobicContact CG2-CG2 3.89Å; T1118-V1130 HydrophobicContact CG2-CG1 4.14Å; T1118-V1130 HydrophobicContact CG2-CG2 3.84Å; A1126-V1130 WeakPolarHBondContact O-CB 3.41Å; A1126-V1130 WeakPolarHBondContact O-CG2 3.39Å; A1126-V1130 PolarHBondContact O-N 2.99Å; E1127-V1130 CarbonylContact O-C 3.56Å; E1127-V1130 PolarHBondContact O-N 2.92Å; V1130-K1134 WeakPolarHBondContact O-CB 3.29Å; V1130-K1134 PolarHBondContact O-N 3.3Å; V1130-I1141 HydrophobicContact CG1-CD1 4.2Å; V1130-I1141 HydrophobicContact CG1-CG1 4.41Å; V1130-I1141 HydrophobicContact CG1-CG2 4.14Å; V1130-I1185 HydrophobicContact CG1-CB 3.92Å; V1130-I1185 HydrophobicContact CG1-CD1 4.43Å; V1130-I1185 HydrophobicContact CG1-CG1 4.16Å; V1130-I1185 HydrophobicContact CG1-CG2 3.88Å
1131	Y	91.4	Very high	92.2	Very high	20 Å²	20	21.9 Å²	21.9	8%	0.078	13%	0.133	C	C	.	.	H	α-helix	trans	-61.6	-52.4	177	173.3	-101.8	0	0	0	111.1	D1084 E1127 E1128 F1129 M1133 K1134 K1135 E1173 W1180	D1084-Y1131 WeakPolarHBondContact OD2-CE1 3.34Å; E1127-Y1131 VanDerWaalsContact O-CB 3.31Å; E1127-Y1131 WeakPolarHBondContact O-CB 3.43Å; E1127-Y1131 PolarHBondContact O-N 3.34Å; E1128-Y1131 PolarHBondContact O-N 2.89Å; F1129-Y1131 VanDerWaalsContact C-N 3.33Å; F1129-Y1131 PolarHBondContact O-N 3.1Å; Y1131-M1133 PolarHBondContact O-N 2.92Å; Y1131-K1134 PolarHBondContact O-N 3.19Å; Y1131-K1135 HydrophobicContact CD1-CD 4.31Å; Y1131-K1135 HydrophobicContact CE1-CD 3.56Å; Y1131-K1135 WeakPolarHBondContact O-CB 3.48Å; Y1131-K1135 PolarHBondContact O-N 2.76Å; Y1131-K1135 PolarHBondContact OH-NZ 3.13Å; Y1131-E1173 PolarHBondContact OH-O 3.29Å; Y1131-W1180 AromaticContact CD1-CD1 3.75Å; Y1131-W1180 AromaticContact CD1-NE1 4Å; Y1131-W1180 HydrophobicContact CD2-CB 4.03Å; Y1131-W1180 AromaticContact CD2-CD1 3.53Å; Y1131-W1180 HydrophobicContact CD2-CG 4.04Å; Y1131-W1180 AromaticContact CE2-CD1 3.91Å; Y1131-W1180 AromaticContact CG-CD1 3.45Å; Y1131-W1180 VanDerWaalsContact CG-CD1 3.45Å; Y1131-W1180 HydrophobicContact CG-CG 4.1Å
1132	I	91.4	Very high	92.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-57.4	-50.8	177.4	-70.6	162	0	0	0	111	I1067 L1083 D1084 L1097 E1128 F1129 K1134 K1135 L1136	I1067-I1132 HydrophobicContact CG2-CD1 3.69Å; L1083-I1132 HydrophobicContact CB-CD1 4.27Å; L1083-I1132 HydrophobicContact CB-CG2 3.87Å; L1083-I1132 HydrophobicContact CD2-CG2 3.85Å; L1083-I1132 HydrophobicContact CG-CG2 4.42Å; D1084-I1132 HydrophobicContact CB-CD1 4.5Å; D1084-I1132 HydrophobicContact CB-CG1 4.24Å; L1097-I1132 HydrophobicContact CD2-CD1 3.78Å; E1128-I1132 HydrophobicContact CG-CD1 3.91Å; E1128-I1132 WeakPolarHBondContact O-CB 3.33Å; E1128-I1132 WeakPolarHBondContact O-CD1 3.37Å; E1128-I1132 VanDerWaalsContact O-CG1 3.26Å; E1128-I1132 WeakPolarHBondContact O-CG1 3.5Å; E1128-I1132 PolarHBondContact O-N 2.83Å; F1129-I1132 PolarHBondContact O-N 2.89Å; I1132-K1134 PolarHBondContact O-N 3.38Å; I1132-K1135 PolarHBondContact O-N 2.85Å; I1132-L1136 HydrophobicContact CG2-CD1 3.96Å; I1132-L1136 WeakPolarHBondContact O-CB 3.45Å; I1132-L1136 WeakPolarHBondContact O-CG 3.38Å; I1132-L1136 PolarHBondContact O-N 2.88Å
1133	M	93.4	Very high	92.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68.3	-25.5	-175.7	-65	-67.6	-80.4	0	0	112.6	F1074 F1075 L1114 I1116 F1129 Y1131 R1138 A1139	F1074-M1133 HydrophobicContact CB-CE 3.74Å; F1074-M1133 HydrophobicContact CD2-CE 3.7Å; F1074-M1133 HydrophobicContact CD2-SD 4.49Å; F1074-M1133 HydrophobicContact CG-CE 3.77Å; F1075-M1133 HydrophobicContact CE2-SD 4.11Å; F1075-M1133 HydrophobicContact CZ-SD 4.19Å; L1114-M1133 HydrophobicContact CD2-CE 3.38Å; I1116-M1133 HydrophobicContact CD1-CB 3.65Å; I1116-M1133 HydrophobicContact CD1-CG 4.07Å; F1129-M1133 HydrophobicContact CD1-CG 4.41Å; F1129-M1133 HydrophobicContact CD2-CG 4.05Å; F1129-M1133 HydrophobicContact CE1-CG 4.13Å; F1129-M1133 HydrophobicContact CE2-CE 4.41Å; F1129-M1133 HydrophobicContact CE2-CG 3.71Å; F1129-M1133 HydrophobicContact CE2-SD 4.15Å; F1129-M1133 HydrophobicContact CG-CG 4.39Å; F1129-M1133 HydrophobicContact CZ-CE 4.13Å; F1129-M1133 HydrophobicContact CZ-CG 3.76Å; F1129-M1133 HydrophobicContact CZ-SD 4.38Å; F1129-M1133 WeakPolarHBondContact O-CB 3.16Å; F1129-M1133 WeakPolarHBondContact O-CG 3.42Å; F1129-M1133 PolarHBondContact O-N 2.99Å; Y1131-M1133 PolarHBondContact O-N 2.92Å; M1133-R1138 HydrophobicContact CE-CB 4.23Å; M1133-R1138 HydrophobicContact CE-CG 3.58Å; M1133-R1138 PolarHBondContact O-N 3.2Å; M1133-R1138 HydrophobicContact SD-CB 4.25Å; M1133-R1138 HydrophobicContact SD-CG 4.06Å; M1133-A1139 HydrophobicContact CB-CB 4.14Å; M1133-A1139 PolarHBondContact O-N 2.76Å
1134	K	91.8	Very high	92.9	Very high	67 Å²	67	21 Å²	21	29%	0.291	12%	0.118	S	C	.	.	H	α-helix	trans	-77.7	-48.2	168.8	175	169.9	-174.3	-166.3	0	112.6	V1130 Y1131 I1132 L1136 G1137 I1141 I1185 T1186	V1130-K1134 WeakPolarHBondContact O-CB 3.29Å; V1130-K1134 PolarHBondContact O-N 3.3Å; Y1131-K1134 PolarHBondContact O-N 3.19Å; I1132-K1134 PolarHBondContact O-N 3.38Å; K1134-L1136 VanDerWaalsContact C-N 3.3Å; K1134-L1136 PolarHBondContact O-N 2.94Å; K1134-G1137 PolarHBondContact O-N 3.41Å; K1134-I1141 HydrophobicContact CB-CG1 4.13Å; K1134-I1141 HydrophobicContact CD-CG1 4.41Å; K1134-I1185 HydrophobicContact CD-CG2 3.69Å; K1134-T1186 PolarHBondContact NZ-O 3.46Å
1135	K	89.4	Confident	93.2	Very high	64 Å²	64	22.2 Å²	22.2	28%	0.278	12%	0.124	S	C	.	.	H	α-helix	trans	-57.6	-40.6	-178.8	-179.8	174	-173.3	162.8	0	111.9	D1084 Y1131 I1132 G1137 E1173 A1176	D1084-K1135 IonicContact OD1-NZ 3.47Å; D1084-K1135 PolarHBondContact OD1-NZ 3.49Å; Y1131-K1135 HydrophobicContact CD1-CD 4.31Å; Y1131-K1135 HydrophobicContact CE1-CD 3.56Å; Y1131-K1135 WeakPolarHBondContact O-CB 3.48Å; Y1131-K1135 PolarHBondContact O-N 2.76Å; Y1131-K1135 PolarHBondContact OH-NZ 3.13Å; I1132-K1135 PolarHBondContact O-N 2.85Å; K1135-G1137 VanDerWaalsContact C-N 3.3Å; K1135-G1137 PolarHBondContact O-N 2.67Å; K1135-E1173 PolarHBondContact NZ-O 2.87Å; K1135-A1176 HydrophobicContact CG-CB 4.5Å
1136	L	90.4	Very high	93.5	Very high	66 Å²	66	22.6 Å²	22.6	35%	0.346	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	0.9	175.8	-62.1	178	0	0	0	113.9	F1075 I1081 L1083 I1132 K1134 R1138	F1075-L1136 HydrophobicContact CE1-CD1 4.32Å; F1075-L1136 HydrophobicContact CE2-CD1 4.26Å; F1075-L1136 HydrophobicContact CZ-CB 4.41Å; F1075-L1136 HydrophobicContact CZ-CD1 3.62Å; I1081-L1136 HydrophobicContact CG2-CD1 3.96Å; L1083-L1136 HydrophobicContact CD2-CD1 3.91Å; I1132-L1136 HydrophobicContact CG2-CD1 3.96Å; I1132-L1136 WeakPolarHBondContact O-CB 3.45Å; I1132-L1136 WeakPolarHBondContact O-CG 3.38Å; I1132-L1136 PolarHBondContact O-N 2.88Å; K1134-L1136 VanDerWaalsContact C-N 3.3Å; K1134-L1136 PolarHBondContact O-N 2.94Å; L1136-R1138 PolarHBondContact O-N 3.34Å; L1136-R1138 VanDerWaalsContact O-N 3.16Å
1137	G	90.8	Very high	93.3	Very high	64 Å²	64	24 Å²	24	66%	0.66	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.4	15.7	-176.6	0	0	0	0	0	114.5	K1134 K1135	K1134-G1137 PolarHBondContact O-N 3.41Å; K1135-G1137 VanDerWaalsContact C-N 3.3Å; K1135-G1137 PolarHBondContact O-N 2.67Å
1138	R	93.9	Very high	92.9	Very high	26 Å²	26	24 Å²	24	10%	0.098	14%	0.138	C	C	.	.			trans	-76.2	-30.8	-172.5	179.4	58.3	-166.4	102.6	-12.9	113	F1074 F1075 G1109 S1110 K1112 L1114 M1133 L1136	F1074-R1138 HydrophobicContact CB-CG 4.49Å; F1074-R1138 PolarHBondContact O-NE 3.28Å; F1074-R1138 PolarHBondContact O-NH2 2.9Å; F1075-R1138 HydrophobicContact CE1-CB 3.87Å; F1075-R1138 HydrophobicContact CE1-CG 3.73Å; F1075-R1138 HydrophobicContact CZ-CB 3.81Å; F1075-R1138 HydrophobicContact CZ-CG 3.75Å; G1109-R1138 PolarHBondContact O-NH2 3.08Å; S1110-R1138 PolarHBondContact O-NH2 3.46Å; K1112-R1138 PolarHBondContact O-NH1 3.31Å; K1112-R1138 PolarHBondContact O-NH2 3.39Å; L1114-R1138 HydrophobicContact CD2-CG 4.43Å; M1133-R1138 HydrophobicContact CE-CB 4.23Å; M1133-R1138 HydrophobicContact CE-CG 3.58Å; M1133-R1138 PolarHBondContact O-N 3.2Å; M1133-R1138 HydrophobicContact SD-CB 4.25Å; M1133-R1138 HydrophobicContact SD-CG 4.06Å; L1136-R1138 PolarHBondContact O-N 3.34Å; L1136-R1138 VanDerWaalsContact O-N 3.16Å
1139	A	95.9	Very high	92.5	Very high	5 Å²	5	24.7 Å²	24.7	4%	0.041	15%	0.146	C	C	.	.			trans	-133.5	142.9	179.8	0	0	0	0	0	112.6	L1114 I1116 M1133 I1141	L1114-A1139 HydrophobicContact CB-CB 4.33Å; L1114-A1139 HydrophobicContact CD2-CB 4.09Å; L1114-A1139 HydrophobicContact CG-CB 4Å; L1114-A1139 WeakPolarHBondContact O-CA 3.29Å; I1116-A1139 HydrophobicContact CD1-CB 3.62Å; I1116-A1139 HydrophobicContact CG1-CB 3.85Å; M1133-A1139 HydrophobicContact CB-CB 4.14Å; M1133-A1139 PolarHBondContact O-N 2.76Å; A1139-I1141 HydrophobicContact CB-CD1 4.3Å
1140	M	96.3	Very high	91.8	Very high	56 Å²	56	25.1 Å²	25.1	28%	0.276	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	144.8	164.2	-177.2	175	53.1	0	0	109.2	L1114 I1115 I1116 I1142 H1188 I1189 I1203	L1114-M1140 PolarHBondContact O-N 3.2Å; L1114-M1140 VanDerWaalsContact O-N 3.1Å; I1115-M1140 CarbonylContact C-O 3.38Å; I1115-M1140 VanDerWaalsContact CA-O 3.31Å; I1115-M1140 WeakPolarHBondContact CA-O 3.47Å; I1115-M1140 HydrophobicContact CD1-CE 3.41Å; I1115-M1140 VanDerWaalsContact CD1-CE 3.41Å; I1115-M1140 HydrophobicContact CG1-CB 4.47Å; I1115-M1140 HydrophobicContact CG1-CE 3.7Å; I1116-M1140 PolarHBondContact N-O 2.91Å; M1140-I1142 HydrophobicContact CE-CD1 3.9Å; M1140-I1142 HydrophobicContact CG-CG1 4.36Å; M1140-I1142 HydrophobicContact SD-CD1 4.49Å; M1140-H1188 HydrophobicContact CG-CB 4.19Å; M1140-I1189 HydrophobicContact SD-CD1 3.78Å; M1140-I1189 HydrophobicContact SD-CG1 4.49Å; M1140-I1203 HydrophobicContact CE-CB 4.45Å; M1140-I1203 HydrophobicContact CE-CD1 4.01Å; M1140-I1203 HydrophobicContact CE-CG2 3.88Å
1141	I	97.6	Very high	91.2	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127.9	-173.3	-46.4	-60.4	0	0	0	108.4	I1116 T1118 V1130 K1134 A1139 P1187 H1188 I1189	I1116-I1141 HydrophobicContact CB-CD1 3.8Å; I1116-I1141 HydrophobicContact CD1-CD1 3.84Å; I1116-I1141 HydrophobicContact CG1-CD1 4.21Å; I1116-I1141 WeakPolarHBondContact O-CA 3.49Å; T1118-I1141 HydrophobicContact CG2-CG2 3.73Å; V1130-I1141 HydrophobicContact CG1-CD1 4.2Å; V1130-I1141 HydrophobicContact CG1-CG1 4.41Å; V1130-I1141 HydrophobicContact CG1-CG2 4.14Å; K1134-I1141 HydrophobicContact CB-CG1 4.13Å; K1134-I1141 HydrophobicContact CD-CG1 4.41Å; A1139-I1141 HydrophobicContact CB-CD1 4.3Å; I1141-P1187 HydrophobicContact CB-CB 4.41Å; I1141-P1187 HydrophobicContact CG2-CB 4.03Å; I1141-H1188 WeakPolarHBondContact CG1-ND1 3.44Å; I1141-H1188 PolarHBondContact N-ND1 3.4Å; I1141-H1188 VanDerWaalsContact N-ND1 3.1Å; I1141-H1188 WeakPolarHBondContact O-CA 3.47Å; I1141-H1188 WeakPolarHBondContact O-CB 3.44Å; I1141-H1188 PolarHBondContact O-N 3.49Å; I1141-I1189 PolarHBondContact O-N 3.16Å; I1141-I1189 VanDerWaalsContact O-N 3.14Å
1142	I	97.8	Very high	90.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	134.2	-174.4	-52.5	-172.4	0	0	0	110.2	I1115 I1116 L1117 T1118 M1140 I1189 A1191 A1196 V1199 A1200 I1203	I1115-I1142 HydrophobicContact CD1-CD1 4.25Å; I1115-I1142 HydrophobicContact CG2-CD1 3.9Å; I1115-I1142 HydrophobicContact CG2-CG1 3.94Å; I1116-I1142 PolarHBondContact O-N 2.71Å; L1117-I1142 VanDerWaalsContact CA-O 3.28Å; L1117-I1142 WeakPolarHBondContact CA-O 3.37Å; L1117-I1142 HydrophobicContact CD2-CB 4.22Å; T1118-I1142 PolarHBondContact N-O 2.82Å; T1118-I1142 VanDerWaalsContact N-O 3.08Å; M1140-I1142 HydrophobicContact CE-CD1 3.9Å; M1140-I1142 HydrophobicContact CG-CG1 4.36Å; M1140-I1142 HydrophobicContact SD-CD1 4.49Å; I1142-I1189 WeakPolarHBondContact CA-O 3.42Å; I1142-I1189 HydrophobicContact CD1-CD1 4.18Å; I1142-I1189 HydrophobicContact CG1-CB 4.18Å; I1142-I1189 HydrophobicContact CG1-CD1 4.45Å; I1142-I1189 HydrophobicContact CG2-CB 4.31Å; I1142-I1189 HydrophobicContact CG2-CG2 4.47Å; I1142-A1191 HydrophobicContact CG2-CB 4.24Å; I1142-A1196 HydrophobicContact CG2-CB 4.13Å; I1142-V1199 HydrophobicContact CD1-CG1 4.2Å; I1142-V1199 HydrophobicContact CG2-CB 4.2Å; I1142-V1199 HydrophobicContact CG2-CG1 3.98Å; I1142-A1200 HydrophobicContact CD1-CB 4.13Å; I1142-I1203 HydrophobicContact CD1-CD1 3.77Å
1143	G	97.1	Very high	90.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	136.1	-137.5	177.8	0	0	0	0	0	112.2	T1118 P1187 I1189 P1190 A1191	T1118-G1143 WeakPolarHBondContact O-CA 3.48Å; G1143-P1187 VanDerWaalsContact O-CG 3.27Å; G1143-P1187 WeakPolarHBondContact O-CG 3.42Å; G1143-I1189 PolarHBondContact N-O 2.93Å; G1143-P1190 CarbonylContact O-C 3.58Å; G1143-P1190 WeakPolarHBondContact O-CA 3.49Å; G1143-A1191 CarbonylContact C-O 3.58Å; G1143-A1191 WeakPolarHBondContact CA-O 3.29Å; G1143-A1191 PolarHBondContact O-N 3.26Å
1144	E	97.2	Very high	90.1	Very high	46 Å²	46	33.7 Å²	33.7	22%	0.215	20%	0.199	C	C	.	.	S	Bend	trans	-98.9	167.9	174.6	-44.8	-174.5	108.1	0	0	112	T1118 K1120 A1191 A1193	T1118-E1144 WeakPolarHBondContact CB-O 3.36Å; T1118-E1144 PolarHBondContact O-N 3Å; T1118-E1144 PolarHBondContact OG1-O 2.93Å; K1120-E1144 WeakPolarHBondContact CE-OE1 3.34Å; K1120-E1144 HydrophobicContact CG-CB 4.45Å; K1120-E1144 WeakPolarHBondContact CG-OE2 3.41Å; K1120-E1144 PolarHBondContact N-OE2 2.83Å; K1120-E1144 IonicContact NZ-OE1 2.67Å; K1120-E1144 PolarHBondContact NZ-OE1 3.11Å; K1120-E1144 IonicContact NZ-OE2 2.7Å; E1144-A1191 PolarHBondContact N-O 2.72Å; E1144-A1193 HydrophobicContact CG-CB 4.44Å
1145	T	94.8	Very high	90	Very high	52 Å²	52	34.2 Å²	34.2	32%	0.319	21%	0.207	S	C	.	.			trans	-62.4	141.6	162.9	-55.9	0	0	0	0	110.1	S1119 K1120	S1119-T1145 CarbonylContact C-O 3.58Å; K1120-T1145 WeakPolarHBondContact CA-O 3.41Å; K1120-T1145 PolarHBondContact N-O 2.97Å
1146	T	93.8	Very high	90.1	Very high	8 Å²	8	32.9 Å²	32.9	5%	0.049	20%	0.201	C	C	.	.			trans	-74.5	177.6	-177.8	65.4	0	0	0	0	113.2	T1118 T1122 E1127 G1148 G1184 I1185	T1118-T1146 HydrophobicContact CG2-CG2 3.93Å; T1122-T1146 HydrophobicContact CG2-CG2 3.9Å; T1122-T1146 WeakPolarHBondContact O-CB 3.29Å; E1127-T1146 HydrophobicContact CG-CG2 4.3Å; E1127-T1146 WeakPolarHBondContact OE1-CB 3.42Å; E1127-T1146 PolarHBondContact OE1-OG1 3.45Å; T1146-G1148 VanDerWaalsContact C-N 3.33Å; T1146-G1148 PolarHBondContact O-N 3.4Å; T1146-G1184 VanDerWaalsContact OG1-CA 3.27Å; T1146-G1184 WeakPolarHBondContact OG1-CA 3.4Å; T1146-I1185 HydrophobicContact CG2-CB 4.42Å; T1146-I1185 HydrophobicContact CG2-CD1 4.49Å; T1146-I1185 PolarHBondContact OG1-N 3.27Å
1147	A	88.2	Confident	90.2	Very high	28 Å²	28	33.3 Å²	33.3	23%	0.231	21%	0.208	C	C	.	.			trans	-65.5	-24.4	-167.5	0	0	0	0	0	116.1	K979 K1120 T1122 A1123 E1127	K979-A1147 PolarHBondContact NZ-O 3.5Å; K1120-A1147 WeakPolarHBondContact O-CB 3.07Å; T1122-A1147 VanDerWaalsContact O-CB 3.29Å; T1122-A1147 WeakPolarHBondContact O-CB 3.44Å; T1122-A1147 PolarHBondContact O-N 2.85Å; A1123-A1147 HydrophobicContact CB-CB 3.89Å; E1127-A1147 PolarHBondContact OE1-N 2.97Å; E1127-A1147 VanDerWaalsContact OE1-N 3.16Å
1148	G	83.8	Confident	90.2	Very high	2 Å²	2	30.3 Å²	30.3	2%	0.021	18%	0.177	C	C	.	.			trans	71.1	50.2	-172.4	0	0	0	0	0	112.4	E1127 T1146 G1182	E1127-G1148 WeakPolarHBondContact OE1-CA 3.35Å; E1127-G1148 PolarHBondContact OE1-N 3.11Å; T1146-G1148 VanDerWaalsContact C-N 3.33Å; T1146-G1148 PolarHBondContact O-N 3.4Å; G1148-G1182 VanDerWaalsContact O-CA 3.3Å; G1148-G1182 WeakPolarHBondContact O-CA 3.14Å; G1148-G1182 PolarHBondContact O-N 3Å
1149	G	80.6	Confident	89.8	Confident	15 Å²	15	31.3 Å²	31.3	16%	0.155	20%	0.196	C	C	.	.			trans	-77	-161.9	171	0	0	0	0	0	113.1	E1127 E1181 G1182	E1127-G1149 PolarHBondContact OE2-N 3.37Å; G1149-E1181 CarbonylContact O-C 3.53Å; G1149-E1181 VanDerWaalsContact O-CA 3.24Å; G1149-E1181 WeakPolarHBondContact O-CA 3.38Å; G1149-G1182 PolarHBondContact O-N 3.2Å
1150	S	77.9	Confident	89.2	Confident	9 Å²	9	40 Å²	40	6%	0.063	24%	0.236	C	C	.	.			trans	-135.8	173.7	171.8	74	0	0	0	0	111	S980 S1124	S980-S1150 WeakPolarHBondContact CB-OG 3.4Å; S980-S1150 PolarHBondContact OG-OG 3.01Å; S1124-S1150 PolarHBondContact OG-O 2.89Å
1151	H	81.2	Confident	88.4	Confident	6 Å²	6	38.4 Å²	38.4	3%	0.028	23%	0.23	C	C	.	.	S	Bend	trans	-57.7	154.3	158.1	-65.4	92.1	0	0	0	111.1	L1086 E1128 V1170 W1180 E1181	L1086-H1151 WeakPolarHBondContact CD2-NE2 3.36Å; E1128-H1151 IonicContact OE1-CD2 3.37Å; E1128-H1151 IonicContact OE1-CE1 3.85Å; E1128-H1151 IonicContact OE1-NE2 2.86Å; E1128-H1151 PolarHBondContact OE1-NE2 3.4Å; E1128-H1151 IonicContact OE2-CD2 2.7Å; E1128-H1151 IonicContact OE2-NE2 2.76Å; E1128-H1151 PolarHBondContact OE2-NE2 2.77Å; H1151-V1170 HydrophobicContact CB-CB 3.9Å; H1151-V1170 HydrophobicContact CB-CG1 4.25Å; H1151-W1180 AromaticContact CE1-CZ2 3.74Å; H1151-E1181 IonicContact CE1-OE1 3.45Å; H1151-E1181 IonicContact ND1-OE1 3.43Å
1152	P	79.9	Confident	87.8	Confident	69 Å²	69	43.8 Å²	43.8	45%	0.448	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-51.9	120.7	-178.1	-30.1	36.6	0	0	0	113.3	T1064	T1064-P1152 HydrophobicContact CG2-CG 4.4Å
1153	P	85.1	Confident	87.4	Confident	52 Å²	52	43.9 Å²	43.9	34%	0.338	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-73.1	152.8	-177.4	28.6	-34.4	0	0	0	112.2	S1166 P1168	P1153-S1166 VanDerWaalsContact CB-OG 3.29Å; P1153-S1166 WeakPolarHBondContact CB-OG 3.35Å; P1153-S1166 WeakPolarHBondContact CG-OG 3.39Å; P1153-P1168 HydrophobicContact CB-CG 4.11Å
1154	K	88.1	Confident	87.2	Confident	73 Å²	73	45.4 Å²	45.4	32%	0.317	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	146.4	172.7	-67.1	175.1	-174.3	154.5	0	109.9	D1088 S1090 F1156 I1167 T1169	D1088-K1154 IonicContact OD1-NZ 3.44Å; D1088-K1154 PolarHBondContact OD1-NZ 2.67Å; D1088-K1154 IonicContact OD2-NZ 3.69Å; D1088-K1154 PolarHBondContact OD2-NZ 2.81Å; S1090-K1154 PolarHBondContact OG-NZ 3.38Å; K1154-F1156 HydrophobicContact CB-CD2 4.36Å; K1154-F1156 HydrophobicContact CB-CE2 3.65Å; K1154-F1156 HydrophobicContact CB-CZ 4.17Å; K1154-F1156 WeakPolarHBondContact O-CD2 3.08Å; K1154-I1167 PolarHBondContact N-O 2.97Å; K1154-I1167 PolarHBondContact O-N 2.82Å; K1154-T1169 HydrophobicContact CB-CG2 4.11Å; K1154-T1169 HydrophobicContact CD-CG2 3.94Å; K1154-T1169 WeakPolarHBondContact CE-OG1 3.34Å; K1154-T1169 HydrophobicContact CG-CG2 4.28Å; K1154-T1169 PolarHBondContact NZ-OG1 3.43Å
1155	V	90	Very high	87.1	Confident	77 Å²	77	43.3 Å²	43.3	47%	0.467	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	123.3	-179.8	-176.8	0	0	0	0	109.8	T984 F1164 L1165	T984-V1155 HydrophobicContact CG2-CG1 3.83Å; T984-V1155 HydrophobicContact CG2-CG2 4.14Å; V1155-F1164 HydrophobicContact CG1-CB 3.77Å; V1155-F1164 HydrophobicContact CG1-CD1 4.15Å; V1155-F1164 HydrophobicContact CG1-CG 4.29Å; V1155-L1165 CarbonylContact C-O 3.56Å; V1155-L1165 WeakPolarHBondContact CA-O 3.48Å
1156	F	91	Very high	86.9	Confident	36 Å²	36	41.2 Å²	41.2	16%	0.158	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	129.4	179.4	-66.3	-94.7	0	0	0	110.8	L928 N932 K1154 F1164 L1165 I1167 T1169	L928-F1156 HydrophobicContact CD1-CB 4.19Å; L928-F1156 HydrophobicContact CD2-CB 4.12Å; L928-F1156 HydrophobicContact CD2-CD1 4.06Å; L928-F1156 HydrophobicContact CD2-CG 4.37Å; N932-F1156 HydrophobicContact CB-CE1 4.23Å; N932-F1156 HydrophobicContact CB-CE2 4.13Å; N932-F1156 HydrophobicContact CB-CZ 3.72Å; N932-F1156 WeakPolarHBondContact OD1-CE1 3.46Å; K1154-F1156 HydrophobicContact CB-CD2 4.36Å; K1154-F1156 HydrophobicContact CB-CE2 3.65Å; K1154-F1156 HydrophobicContact CB-CZ 4.17Å; K1154-F1156 WeakPolarHBondContact O-CD2 3.08Å; F1156-F1164 CarbonylContact O-C 3.55Å; F1156-F1164 VanDerWaalsContact O-CA 3.29Å; F1156-F1164 WeakPolarHBondContact O-CA 3.49Å; F1156-L1165 PolarHBondContact N-O 2.81Å; F1156-L1165 PolarHBondContact O-N 3.44Å; F1156-I1167 HydrophobicContact CB-CD1 4.35Å; F1156-I1167 HydrophobicContact CD2-CB 3.83Å; F1156-I1167 HydrophobicContact CD2-CD1 3.75Å; F1156-I1167 HydrophobicContact CD2-CG1 3.98Å; F1156-I1167 HydrophobicContact CE2-CB 3.86Å; F1156-I1167 HydrophobicContact CE2-CD1 4.31Å; F1156-I1167 HydrophobicContact CE2-CG1 4.47Å; F1156-I1167 HydrophobicContact CE2-CG2 4.46Å; F1156-I1167 HydrophobicContact CG-CD1 4.19Å; F1156-T1169 HydrophobicContact CE2-CG2 3.78Å; F1156-T1169 HydrophobicContact CZ-CG2 3.93Å
1157	P	92.2	Very high	86.8	Confident	76 Å²	76	40.8 Å²	40.8	49%	0.494	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	136.7	172	30.2	-33.1	0	0	0	111.3	G1159 F1164	P1157-G1159 PolarHBondContact O-N 3.49Å; P1157-F1164 HydrophobicContact CB-CD1 3.9Å; P1157-F1164 HydrophobicContact CB-CE1 3.83Å
1158	V	91.7	Very high	86.9	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	83.6	173	-170.9	0	0	0	0	108.6	I921 E924 L928 E1160 S1161 I1163 L1165	I921-V1158 HydrophobicContact CG2-CG1 4.14Å; I921-V1158 WeakPolarHBondContact O-CG1 3.36Å; E924-V1158 HydrophobicContact CB-CG1 3.69Å; L928-V1158 HydrophobicContact CD1-CG2 4.14Å; V1158-E1160 PolarHBondContact O-N 3.11Å; V1158-S1161 WeakPolarHBondContact O-CB 3.19Å; V1158-S1161 PolarHBondContact O-N 2.84Å; V1158-S1161 PolarHBondContact O-OG 2.92Å; V1158-I1163 HydrophobicContact CB-CB 4.25Å; V1158-I1163 HydrophobicContact CG2-CB 4.31Å; V1158-I1163 HydrophobicContact CG2-CG2 4.1Å; V1158-I1163 PolarHBondContact N-O 3.27Å; V1158-L1165 HydrophobicContact CG2-CD1 3.98Å; V1158-L1165 HydrophobicContact CG2-CD2 4.43Å; V1158-L1165 HydrophobicContact CG2-CG 3.69Å
1159	G	84.6	Confident	87.3	Confident	48 Å²	48	39.6 Å²	39.6	50%	0.495	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	-132.9	-179.6	0	0	0	0	0	113	E924 P1157	E924-G1159 WeakPolarHBondContact OE2-CA 3.36Å; E924-G1159 PolarHBondContact OE2-N 2.97Å; P1157-G1159 PolarHBondContact O-N 3.49Å
1160	E	83.3	Confident	87.6	Confident	187 Å²	187	40.1 Å²	40.1	87%	0.874	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	2.1	179.1	-59	-167.1	158.1	0	0	113.5	V1158 N1162	V1158-E1160 PolarHBondContact O-N 3.11Å; E1160-N1162 PolarHBondContact O-N 3.39Å; E1160-N1162 VanDerWaalsContact O-N 3.08Å; E1160-N1162 PolarHBondContact O-ND2 2.75Å
1161	S	80.4	Confident	88	Confident	22 Å²	22	41 Å²	41	15%	0.154	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-9.1	-174.1	72.1	0	0	0	0	115.2	K961 V1158 I1163	K961-S1161 PolarHBondContact NZ-O 2.96Å; V1158-S1161 WeakPolarHBondContact O-CB 3.19Å; V1158-S1161 PolarHBondContact O-N 2.84Å; V1158-S1161 PolarHBondContact O-OG 2.92Å; S1161-I1163 PolarHBondContact O-N 3.47Å; S1161-I1163 VanDerWaalsContact O-N 3.15Å; S1161-I1163 WeakPolarHBondContact OG-CB 3.49Å; S1161-I1163 PolarHBondContact OG-N 2.85Å; S1161-I1163 VanDerWaalsContact OG-N 3.15Å
1162	N	84.8	Confident	88.1	Confident	113 Å²	113	40.7 Å²	40.7	60%	0.604	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.4	21.5	-168.1	-63.9	-85.9	0	0	0	113.5	K961 E1160 F1164	K961-N1162 PolarHBondContact NZ-O 3.24Å; E1160-N1162 PolarHBondContact O-N 3.39Å; E1160-N1162 VanDerWaalsContact O-N 3.08Å; E1160-N1162 PolarHBondContact O-ND2 2.75Å; N1162-F1164 VanDerWaalsContact O-CE2 3.3Å; N1162-F1164 WeakPolarHBondContact O-CE2 3.47Å
1163	I	90.2	Very high	88	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	143.3	166.5	-61.1	166.5	0	0	0	107.1	I921 L964 E965 T983 V1158 S1161	I921-I1163 HydrophobicContact CD1-CD1 4.01Å; I921-I1163 HydrophobicContact CG1-CD1 4.43Å; I921-I1163 HydrophobicContact CG2-CD1 3.6Å; L964-I1163 HydrophobicContact CD2-CD1 4.01Å; E965-I1163 HydrophobicContact CG-CD1 4.33Å; E965-I1163 HydrophobicContact CG-CG1 3.98Å; E965-I1163 HydrophobicContact CG-CG2 4.17Å; E965-I1163 WeakPolarHBondContact OE1-CG1 3.16Å; T983-I1163 HydrophobicContact CG2-CG2 4.2Å; V1158-I1163 HydrophobicContact CB-CB 4.25Å; V1158-I1163 HydrophobicContact CG2-CB 4.31Å; V1158-I1163 HydrophobicContact CG2-CG2 4.1Å; V1158-I1163 PolarHBondContact N-O 3.27Å; S1161-I1163 PolarHBondContact O-N 3.47Å; S1161-I1163 VanDerWaalsContact O-N 3.15Å; S1161-I1163 WeakPolarHBondContact OG-CB 3.49Å; S1161-I1163 PolarHBondContact OG-N 2.85Å; S1161-I1163 VanDerWaalsContact OG-N 3.15Å
1164	F	93.2	Very high	87.2	Confident	33 Å²	33	41.1 Å²	41.1	15%	0.145	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.4	176.3	-53.3	-98.3	0	0	0	110.4	T983 T984 N986 V1155 F1156 P1157 N1162	T983-F1164 CarbonylContact C-O 3.59Å; T983-F1164 VanDerWaalsContact CA-O 3.31Å; T983-F1164 WeakPolarHBondContact CA-O 3.41Å; T984-F1164 HydrophobicContact CG2-CB 4.01Å; T984-F1164 PolarHBondContact N-O 3.22Å; T984-F1164 WeakPolarHBondContact O-CB 3.39Å; N986-F1164 HydrophobicContact CB-CD1 4.09Å; N986-F1164 HydrophobicContact CB-CD2 3.98Å; N986-F1164 HydrophobicContact CB-CE1 3.76Å; N986-F1164 HydrophobicContact CB-CE2 3.66Å; N986-F1164 HydrophobicContact CB-CG 4.21Å; N986-F1164 HydrophobicContact CB-CZ 3.55Å; V1155-F1164 HydrophobicContact CG1-CB 3.77Å; V1155-F1164 HydrophobicContact CG1-CD1 4.15Å; V1155-F1164 HydrophobicContact CG1-CG 4.29Å; F1156-F1164 CarbonylContact O-C 3.55Å; F1156-F1164 VanDerWaalsContact O-CA 3.29Å; F1156-F1164 WeakPolarHBondContact O-CA 3.49Å; P1157-F1164 HydrophobicContact CB-CD1 3.9Å; P1157-F1164 HydrophobicContact CB-CE1 3.83Å; N1162-F1164 VanDerWaalsContact O-CE2 3.3Å; N1162-F1164 WeakPolarHBondContact O-CE2 3.47Å
1165	L	93.4	Very high	86.2	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.9	174.3	-61.8	178.6	0	0	0	110.4	L928 I929 L968 L972 Q982 T983 V1155 F1156 V1158 I1167	L928-L1165 HydrophobicContact CB-CD1 4.46Å; L928-L1165 HydrophobicContact CD1-CD1 4.32Å; I929-L1165 HydrophobicContact CD1-CD1 4.35Å; I929-L1165 HydrophobicContact CG1-CD1 4.32Å; L968-L1165 HydrophobicContact CD2-CD2 4.3Å; L972-L1165 HydrophobicContact CD1-CD2 3.79Å; Q982-L1165 CarbonylContact O-C 3.54Å; Q982-L1165 WeakPolarHBondContact O-CA 3.41Å; T983-L1165 HydrophobicContact CG2-CD2 3.95Å; V1155-L1165 CarbonylContact C-O 3.56Å; V1155-L1165 WeakPolarHBondContact CA-O 3.48Å; F1156-L1165 PolarHBondContact N-O 2.81Å; F1156-L1165 PolarHBondContact O-N 3.44Å; V1158-L1165 HydrophobicContact CG2-CD1 3.98Å; V1158-L1165 HydrophobicContact CG2-CD2 4.43Å; V1158-L1165 HydrophobicContact CG2-CG 3.69Å; L1165-I1167 HydrophobicContact CB-CD1 3.96Å; L1165-I1167 HydrophobicContact CB-CG1 3.77Å; L1165-I1167 HydrophobicContact CD1-CD1 4.17Å
1166	S	92	Very high	84.7	Confident	8 Å²	8	42 Å²	42	6%	0.056	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	108.9	158.5	170.5	0	0	0	0	107.8	S980 L981 Q982 P1153	S980-S1166 PolarHBondContact O-OG 3.39Å; L981-S1166 WeakPolarHBondContact CA-O 3.49Å; Q982-S1166 PolarHBondContact N-O 3.42Å; Q982-S1166 VanDerWaalsContact N-O 3.13Å; Q982-S1166 WeakPolarHBondContact O-CB 3.19Å; Q982-S1166 PolarHBondContact O-N 3.27Å; P1153-S1166 VanDerWaalsContact CB-OG 3.29Å; P1153-S1166 WeakPolarHBondContact CB-OG 3.35Å; P1153-S1166 WeakPolarHBondContact CG-OG 3.39Å
1167	I	92.3	Very high	83.4	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	116.1	179.1	-57.7	176.1	0	0	0	109.1	L928 I929 N932 Y933 L981 K1154 F1156 L1165 T1169	L928-I1167 HydrophobicContact CB-CD1 3.89Å; I929-I1167 HydrophobicContact CG1-CD1 4.2Å; N932-I1167 HydrophobicContact CB-CG2 4.23Å; Y933-I1167 HydrophobicContact CD2-CG2 4.25Å; L981-I1167 HydrophobicContact CD1-CB 4.19Å; L981-I1167 HydrophobicContact CD1-CG1 3.89Å; L981-I1167 HydrophobicContact CD1-CG2 4.11Å; K1154-I1167 PolarHBondContact N-O 2.97Å; K1154-I1167 PolarHBondContact O-N 2.82Å; F1156-I1167 HydrophobicContact CB-CD1 4.35Å; F1156-I1167 HydrophobicContact CD2-CB 3.83Å; F1156-I1167 HydrophobicContact CD2-CD1 3.75Å; F1156-I1167 HydrophobicContact CD2-CG1 3.98Å; F1156-I1167 HydrophobicContact CE2-CB 3.86Å; F1156-I1167 HydrophobicContact CE2-CD1 4.31Å; F1156-I1167 HydrophobicContact CE2-CG1 4.47Å; F1156-I1167 HydrophobicContact CE2-CG2 4.46Å; F1156-I1167 HydrophobicContact CG-CD1 4.19Å; L1165-I1167 HydrophobicContact CB-CD1 3.96Å; L1165-I1167 HydrophobicContact CB-CG1 3.77Å; L1165-I1167 HydrophobicContact CD1-CD1 4.17Å; I1167-T1169 HydrophobicContact CG2-CG2 4.4Å; I1167-T1169 WeakPolarHBondContact O-CG2 3.34Å; I1167-T1169 PolarHBondContact O-N 3.48Å
1168	P	90.3	Very high	82.1	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.019	27%	0.271	C	S	.	.			trans	-61.8	118.3	166.7	-25	36.2	0	0	0	110.5	Y933 A934 D978 P1153	Y933-P1168 WeakPolarHBondContact CA-O 3.37Å; Y933-P1168 HydrophobicContact CD2-CB 4.43Å; Y933-P1168 WeakPolarHBondContact CD2-O 3.45Å; Y933-P1168 HydrophobicContact CE2-CB 4.18Å; Y933-P1168 HydrophobicContact CE2-CG 4.19Å; A934-P1168 PolarHBondContact N-O 2.98Å; D978-P1168 WeakPolarHBondContact OD2-CG 3.47Å; P1153-P1168 HydrophobicContact CB-CG 4.11Å
1169	T	90.2	Very high	81.2	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.006	28%	0.281	C	S	.	.			trans	-110.6	-2.7	-179.1	81.3	0	0	0	0	113.8	N932 D1088 R1089 K1154 F1156 I1167	N932-T1169 HydrophobicContact CB-CG2 4.26Å; N932-T1169 WeakPolarHBondContact O-CA 3.39Å; N932-T1169 WeakPolarHBondContact O-CB 3.37Å; N932-T1169 WeakPolarHBondContact O-CG2 3.33Å; D1088-T1169 CarbonylContact C-O 3.38Å; D1088-T1169 WeakPolarHBondContact CA-O 3.34Å; D1088-T1169 PolarHBondContact OD1-OG1 2.61Å; R1089-T1169 WeakPolarHBondContact CB-O 3.35Å; R1089-T1169 PolarHBondContact N-O 2.93Å; K1154-T1169 HydrophobicContact CB-CG2 4.11Å; K1154-T1169 HydrophobicContact CD-CG2 3.94Å; K1154-T1169 WeakPolarHBondContact CE-OG1 3.34Å; K1154-T1169 HydrophobicContact CG-CG2 4.28Å; K1154-T1169 PolarHBondContact NZ-OG1 3.43Å; F1156-T1169 HydrophobicContact CE2-CG2 3.78Å; F1156-T1169 HydrophobicContact CZ-CG2 3.93Å; I1167-T1169 HydrophobicContact CG2-CG2 4.4Å; I1167-T1169 WeakPolarHBondContact O-CG2 3.34Å; I1167-T1169 PolarHBondContact O-N 3.48Å
1170	V	87.1	Confident	81.1	Confident	26 Å²	26	42.7 Å²	42.7	16%	0.158	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	142.5	-175	-176.4	0	0	0	0	109.6	L1086 Y1087 D1088 H1151	L1086-V1170 HydrophobicContact CB-CG1 3.86Å; L1086-V1170 HydrophobicContact CD1-CG1 4.44Å; Y1087-V1170 WeakPolarHBondContact O-CA 3.48Å; D1088-V1170 HydrophobicContact CB-CG2 4.03Å; H1151-V1170 HydrophobicContact CB-CB 3.9Å; H1151-V1170 HydrophobicContact CB-CG1 4.25Å
1171	H	87	Confident	81.1	Confident	28 Å²	28	34.3 Å²	34.3	13%	0.13	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	157.4	167.7	73.6	81.7	0	0	0	112.4	A934 F935 L1086 Y1087 E1181	A934-H1171 HydrophobicContact CB-CB 4.12Å; A934-H1171 PolarHBondContact O-CD2 2.91Å; F935-H1171 HydrophobicContact CE1-CB 3.8Å; F935-H1171 AromaticContact CE1-CG 3.74Å; F935-H1171 HydrophobicContact CE2-CB 4.38Å; F935-H1171 HydrophobicContact CZ-CB 3.65Å; L1086-H1171 WeakPolarHBondContact CA-O 3.18Å; Y1087-H1171 AromaticContact CD1-NE2 3.53Å; Y1087-H1171 PolarHBondContact N-O 2.91Å; Y1087-H1171 PolarHBondContact O-N 3.17Å; H1171-E1181 VanDerWaalsContact CA-OE1 3.31Å; H1171-E1181 WeakPolarHBondContact CA-OE1 3.26Å; H1171-E1181 WeakPolarHBondContact CB-OE1 3.42Å
1172	S	84.2	Confident	80.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	156.4	173.4	-79.5	0	0	0	0	113.4	D1084 K1085 T1174 W1180 E1181	D1084-S1172 WeakPolarHBondContact OD2-CB 3.33Å; D1084-S1172 PolarHBondContact OD2-OG 3Å; K1085-S1172 CarbonylContact O-C 3.52Å; S1172-T1174 PolarHBondContact O-N 3.14Å; S1172-T1174 VanDerWaalsContact O-N 3.13Å; S1172-W1180 PolarHBondContact OG-NE1 3.38Å; S1172-W1180 VanDerWaalsContact OG-NE1 3.07Å; S1172-E1181 WeakPolarHBondContact CB-OE1 3.35Å; S1172-E1181 PolarHBondContact N-OE1 3.39Å
1173	E	76.4	Confident	80.6	Confident	64 Å²	64	34.5 Å²	34.5	30%	0.299	23%	0.229	S	C	.	.			trans	-74.4	104.9	-179.8	-169.8	-178.7	-121.3	0	0	112.3	K1085 Y1131 K1135 S1175	K1085-E1173 HydrophobicContact CB-CB 4.12Å; K1085-E1173 IonicContact NZ-OE1 3.7Å; K1085-E1173 PolarHBondContact NZ-OE1 3.33Å; K1085-E1173 IonicContact NZ-OE2 3.72Å; K1085-E1173 PolarHBondContact NZ-OE2 3.03Å; K1085-E1173 PolarHBondContact O-N 3.46Å; Y1131-E1173 PolarHBondContact OH-O 3.29Å; K1135-E1173 PolarHBondContact NZ-O 2.87Å; E1173-S1175 PolarHBondContact O-N 3.18Å; E1173-S1175 PolarHBondContact OE2-OG 3.07Å
1174	T	69.4	Low	80.4	Confident	65 Å²	65	34.6 Å²	34.6	40%	0.399	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-76	7.4	-176.9	55.7	0	0	0	0	115.2	S1172 A1176 G1177 A1179	S1172-T1174 PolarHBondContact O-N 3.14Å; S1172-T1174 VanDerWaalsContact O-N 3.13Å; T1174-A1176 PolarHBondContact O-N 2.8Å; T1174-G1177 CarbonylContact C-O 3.59Å; T1174-G1177 WeakPolarHBondContact CA-O 3.48Å; T1174-G1177 PolarHBondContact O-N 3.25Å; T1174-A1179 HydrophobicContact CG2-CB 3.93Å
1175	S	66.6	Low	80.3	Confident	95 Å²	95	33.4 Å²	33.4	66%	0.664	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-64.1	-21	179.2	65	0	0	0	0	113.7	E1173	E1173-S1175 PolarHBondContact O-N 3.18Å; E1173-S1175 PolarHBondContact OE2-OG 3.07Å
1176	A	58.1	Low	80.3	Confident	73 Å²	73	37 Å²	37	60%	0.603	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-101.5	-2.5	-177.7	0	0	0	0	0	114.4	K1135 T1174	K1135-A1176 HydrophobicContact CG-CB 4.5Å; T1174-A1176 PolarHBondContact O-N 2.8Å
1177	G	63.3	Low	80.4	Confident	31 Å²	31	37.1 Å²	37.1	32%	0.32	25%	0.249	S	C	.	.	S	Bend	trans	158.2	176.5	-174.9	0	0	0	0	0	112.8	T1174	T1174-G1177 CarbonylContact C-O 3.59Å; T1174-G1177 WeakPolarHBondContact CA-O 3.48Å; T1174-G1177 PolarHBondContact O-N 3.25Å
1178	P	65.4	Low	80.6	Confident	117 Å²	117	41.5 Å²	41.5	76%	0.76	27%	0.269	S	S	*	.	S	Bend	trans	-57.3	151.9	176.4	26.8	-35.2	0	0	0	111.6
1179	A	73.3	Confident	80.8	Confident	24 Å²	24	44.1 Å²	44.1	20%	0.198	28%	0.282	C	S	.	.			trans	-53.5	145	167.1	0	0	0	0	0	110.2	F935 T1174 E1181	F935-A1179 HydrophobicContact CE1-CB 4.1Å; F935-A1179 HydrophobicContact CZ-CB 3.85Å; T1174-A1179 HydrophobicContact CG2-CB 3.93Å; A1179-E1181 WeakPolarHBondContact CA-OE2 3.44Å; A1179-E1181 WeakPolarHBondContact CB-OE2 3.49Å
1180	W	82.2	Confident	81.1	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.015	31%	0.313	C	S	.	.			trans	-91.1	-23	170.9	64.8	-91.3	0	0	0	110.9	E1127 E1128 Y1131 H1151 S1172 V1183 G1184 I1185	E1127-W1180 HydrophobicContact CB-CD2 4.38Å; E1127-W1180 HydrophobicContact CB-CE3 3.54Å; E1127-W1180 HydrophobicContact CB-CH2 4.17Å; E1127-W1180 HydrophobicContact CB-CZ3 3.42Å; E1127-W1180 VanDerWaalsContact CB-CZ3 3.42Å; E1127-W1180 HydrophobicContact CG-CE3 4.47Å; E1127-W1180 HydrophobicContact CG-CZ3 4.29Å; E1128-W1180 HydrophobicContact CB-CH2 4.25Å; E1128-W1180 HydrophobicContact CB-CZ2 3.77Å; E1128-W1180 HydrophobicContact CG-CZ2 4.42Å; Y1131-W1180 AromaticContact CD1-CD1 3.75Å; Y1131-W1180 AromaticContact CD1-NE1 4Å; Y1131-W1180 HydrophobicContact CD2-CB 4.03Å; Y1131-W1180 AromaticContact CD2-CD1 3.53Å; Y1131-W1180 HydrophobicContact CD2-CG 4.04Å; Y1131-W1180 AromaticContact CE2-CD1 3.91Å; Y1131-W1180 AromaticContact CG-CD1 3.45Å; Y1131-W1180 VanDerWaalsContact CG-CD1 3.45Å; Y1131-W1180 HydrophobicContact CG-CG 4.1Å; H1151-W1180 AromaticContact CE1-CZ2 3.74Å; S1172-W1180 PolarHBondContact OG-NE1 3.38Å; S1172-W1180 VanDerWaalsContact OG-NE1 3.07Å; W1180-V1183 PolarHBondContact O-N 3.4Å; W1180-G1184 WeakPolarHBondContact O-CA 3.41Å; W1180-G1184 PolarHBondContact O-N 3.02Å; W1180-I1185 HydrophobicContact CB-CD1 3.66Å; W1180-I1185 HydrophobicContact CB-CG1 3.76Å; W1180-I1185 HydrophobicContact CD2-CD1 4.22Å; W1180-I1185 HydrophobicContact CE3-CD1 4.14Å; W1180-I1185 HydrophobicContact CG-CD1 4.06Å; W1180-I1185 HydrophobicContact CG-CG1 4.47Å
1181	E	83.9	Confident	81.5	Confident	10 Å²	10	48.8 Å²	48.8	5%	0.047	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	131.9	-179.9	-55.8	92.4	139.1	0	0	110.6	F935 G1149 H1151 H1171 S1172 A1179 V1183	F935-E1181 HydrophobicContact CE2-CB 4.06Å; F935-E1181 HydrophobicContact CZ-CB 4.08Å; G1149-E1181 CarbonylContact O-C 3.53Å; G1149-E1181 VanDerWaalsContact O-CA 3.24Å; G1149-E1181 WeakPolarHBondContact O-CA 3.38Å; H1151-E1181 IonicContact CE1-OE1 3.45Å; H1151-E1181 IonicContact ND1-OE1 3.43Å; H1171-E1181 VanDerWaalsContact CA-OE1 3.31Å; H1171-E1181 WeakPolarHBondContact CA-OE1 3.26Å; H1171-E1181 WeakPolarHBondContact CB-OE1 3.42Å; S1172-E1181 WeakPolarHBondContact CB-OE1 3.35Å; S1172-E1181 PolarHBondContact N-OE1 3.39Å; A1179-E1181 WeakPolarHBondContact CA-OE2 3.44Å; A1179-E1181 WeakPolarHBondContact CB-OE2 3.49Å; E1181-V1183 PolarHBondContact O-N 2.76Å
1182	G	73.5	Confident	81.8	Confident	31 Å²	31	50.1 Å²	50.1	32%	0.32	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	-14.9	-175.3	0	0	0	0	0	116.3	G1148 G1149	G1148-G1182 VanDerWaalsContact O-CA 3.3Å; G1148-G1182 WeakPolarHBondContact O-CA 3.14Å; G1148-G1182 PolarHBondContact O-N 3Å; G1149-G1182 PolarHBondContact O-N 3.2Å
1183	V	80.6	Confident	82.2	Confident	108 Å²	108	50.8 Å²	50.8	66%	0.655	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.6	-33.8	-172.7	-177.3	0	0	0	0	113.5	W1180 E1181	W1180-V1183 PolarHBondContact O-N 3.4Å; E1181-V1183 PolarHBondContact O-N 2.76Å
1184	G	86.8	Confident	83	Confident	5 Å²	5	55 Å²	55	5%	0.052	36%	0.356	C	S	.	.			trans	83.9	155.1	-175	0	0	0	0	0	113.8	T1146 W1180 T1186	T1146-G1184 VanDerWaalsContact OG1-CA 3.27Å; T1146-G1184 WeakPolarHBondContact OG1-CA 3.4Å; W1180-G1184 WeakPolarHBondContact O-CA 3.41Å; W1180-G1184 PolarHBondContact O-N 3.02Å; G1184-T1186 PolarHBondContact O-N 3.05Å
1185	I	90.8	Very high	84.2	Confident	8 Å²	8	54 Å²	54	4%	0.041	36%	0.355	C	S	.	.			trans	-83	111.2	178	-57.6	83.4	0	0	0	109.3	E1127 V1130 K1134 T1146 W1180	E1127-I1185 HydrophobicContact CB-CD1 3.56Å; E1127-I1185 HydrophobicContact CG-CD1 4.21Å; E1127-I1185 VanDerWaalsContact O-CD1 3.24Å; E1127-I1185 WeakPolarHBondContact O-CD1 3.43Å; V1130-I1185 HydrophobicContact CG1-CB 3.92Å; V1130-I1185 HydrophobicContact CG1-CD1 4.43Å; V1130-I1185 HydrophobicContact CG1-CG1 4.16Å; V1130-I1185 HydrophobicContact CG1-CG2 3.88Å; K1134-I1185 HydrophobicContact CD-CG2 3.69Å; T1146-I1185 HydrophobicContact CG2-CB 4.42Å; T1146-I1185 HydrophobicContact CG2-CD1 4.49Å; T1146-I1185 PolarHBondContact OG1-N 3.27Å; W1180-I1185 HydrophobicContact CB-CD1 3.66Å; W1180-I1185 HydrophobicContact CB-CG1 3.76Å; W1180-I1185 HydrophobicContact CD2-CD1 4.22Å; W1180-I1185 HydrophobicContact CE3-CD1 4.14Å; W1180-I1185 HydrophobicContact CG-CD1 4.06Å; W1180-I1185 HydrophobicContact CG-CG1 4.47Å
1186	T	92.3	Very high	85.6	Confident	77 Å²	77	49.5 Å²	49.5	47%	0.472	32%	0.323	S	S	.	.			trans	-62.6	129.6	168.9	-49.2	0	0	0	0	110.5	K1134 G1184	K1134-T1186 PolarHBondContact NZ-O 3.46Å; G1184-T1186 PolarHBondContact O-N 3.05Å
1187	P	94.4	Very high	87.4	Confident	10 Å²	10	47.1 Å²	47.1	7%	0.065	30%	0.3	C	S	.	.			trans	-67.7	165.3	178.8	26.8	-34.5	0	0	0	112.3	I1141 G1143	I1141-P1187 HydrophobicContact CB-CB 4.41Å; I1141-P1187 HydrophobicContact CG2-CB 4.03Å; G1143-P1187 VanDerWaalsContact O-CG 3.27Å; G1143-P1187 WeakPolarHBondContact O-CG 3.42Å
1188	H	95.9	Very high	88.9	Confident	92 Å²	92	51 Å²	51	43%	0.426	31%	0.31	S	S	.	.	S	Bend	trans	-75.1	-34.6	172.9	-67.1	107	0	0	0	111.9	M1140 I1141	M1140-H1188 HydrophobicContact CG-CB 4.19Å; I1141-H1188 WeakPolarHBondContact CG1-ND1 3.44Å; I1141-H1188 PolarHBondContact N-ND1 3.4Å; I1141-H1188 VanDerWaalsContact N-ND1 3.1Å; I1141-H1188 WeakPolarHBondContact O-CA 3.47Å; I1141-H1188 WeakPolarHBondContact O-CB 3.44Å; I1141-H1188 PolarHBondContact O-N 3.49Å
1189	I	95.9	Very high	90.3	Very high	57 Å²	57	48 Å²	48	29%	0.292	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	103.3	175.1	-57.1	177.6	0	0	0	107.8	M1140 I1141 I1142 G1143 A1191 V1199 I1203	M1140-I1189 HydrophobicContact SD-CD1 3.78Å; M1140-I1189 HydrophobicContact SD-CG1 4.49Å; I1141-I1189 PolarHBondContact O-N 3.16Å; I1141-I1189 VanDerWaalsContact O-N 3.14Å; I1142-I1189 WeakPolarHBondContact CA-O 3.42Å; I1142-I1189 HydrophobicContact CD1-CD1 4.18Å; I1142-I1189 HydrophobicContact CG1-CB 4.18Å; I1142-I1189 HydrophobicContact CG1-CD1 4.45Å; I1142-I1189 HydrophobicContact CG2-CB 4.31Å; I1142-I1189 HydrophobicContact CG2-CG2 4.47Å; G1143-I1189 PolarHBondContact N-O 2.93Å; I1189-A1191 PolarHBondContact O-N 3.19Å; I1189-V1199 HydrophobicContact CG2-CG1 4.28Å; I1189-I1203 HydrophobicContact CD1-CD1 3.47Å; I1189-I1203 VanDerWaalsContact CD1-CD1 3.47Å
1190	P	95.9	Very high	91.4	Very high	102 Å²	102	46.8 Å²	46.8	66%	0.662	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.1	129.5	173	-23.9	35.1	0	0	0	111.6	G1143	G1143-P1190 CarbonylContact O-C 3.58Å; G1143-P1190 WeakPolarHBondContact O-CA 3.49Å
1191	A	94.8	Very high	91.9	Very high	23 Å²	23	48.7 Å²	48.7	19%	0.19	29%	0.288	C	S	.	.			trans	-151.7	152.2	176.7	0	0	0	0	0	109.7	I1142 G1143 E1144 I1189	I1142-A1191 HydrophobicContact CG2-CB 4.24Å; G1143-A1191 CarbonylContact C-O 3.58Å; G1143-A1191 WeakPolarHBondContact CA-O 3.29Å; G1143-A1191 PolarHBondContact O-N 3.26Å; E1144-A1191 PolarHBondContact N-O 2.72Å; I1189-A1191 PolarHBondContact O-N 3.19Å
1192	A	94.1	Very high	92.3	Very high	56 Å²	56	49.7 Å²	49.7	46%	0.463	30%	0.301	S	S	.	.			trans	-58.9	144.4	166.9	0	0	0	0	0	109.8	E1194 A1195 A1196	A1192-E1194 PolarHBondContact O-N 3.42Å; A1192-E1194 VanDerWaalsContact O-N 3.16Å; A1192-A1195 PolarHBondContact O-N 3.41Å; A1192-A1196 PolarHBondContact O-N 2.91Å; A1192-A1196 VanDerWaalsContact O-N 3.12Å
1193	A	93.1	Very high	93.2	Very high	15 Å²	15	50.7 Å²	50.7	12%	0.124	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-39.4	-172.5	0	0	0	0	0	111.9	R1057 E1144 A1195 A1196	R1057-A1193 WeakPolarHBondContact CD-O 3.48Å; R1057-A1193 PolarHBondContact NH1-O 3.46Å; E1144-A1193 HydrophobicContact CG-CB 4.44Å; A1193-A1195 PolarHBondContact O-N 2.89Å; A1193-A1196 PolarHBondContact O-N 3Å
1194	E	93.3	Very high	93.8	Very high	152 Å²	152	45.9 Å²	45.9	71%	0.71	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-41.2	178.5	-56.5	70.4	-153	0	0	111.7	A1192	A1192-E1194 PolarHBondContact O-N 3.42Å; A1192-E1194 VanDerWaalsContact O-N 3.16Å
1195	A	93.6	Very high	93.8	Very high	45 Å²	45	48 Å²	48	37%	0.372	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-21.7	-175.6	0	0	0	0	0	113.9	A1192 A1193 L1197 E1198 V1199	A1192-A1195 PolarHBondContact O-N 3.41Å; A1193-A1195 PolarHBondContact O-N 2.89Å; A1195-L1197 VanDerWaalsContact C-N 3.26Å; A1195-L1197 PolarHBondContact O-N 3.49Å; A1195-L1197 VanDerWaalsContact O-N 3.15Å; A1195-E1198 PolarHBondContact O-N 3.34Å; A1195-E1198 VanDerWaalsContact O-N 3.12Å; A1195-V1199 WeakPolarHBondContact O-CG2 3.48Å; A1195-V1199 PolarHBondContact O-N 3.18Å; A1195-V1199 VanDerWaalsContact O-N 3.14Å
1196	A	95.4	Very high	93.6	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-54.8	-36.8	-171.9	0	0	0	0	0	113.9	L1117 I1142 A1192 A1193 A1200	L1117-A1196 HydrophobicContact CD2-CB 4.24Å; I1142-A1196 HydrophobicContact CG2-CB 4.13Å; A1192-A1196 PolarHBondContact O-N 2.91Å; A1192-A1196 VanDerWaalsContact O-N 3.12Å; A1193-A1196 PolarHBondContact O-N 3Å; A1196-A1200 WeakPolarHBondContact O-CB 3.05Å; A1196-A1200 PolarHBondContact O-N 3.43Å
1197	L	96.2	Very high	93.3	Very high	23 Å²	23	56.2 Å²	56.2	12%	0.12	31%	0.309	C	S	.	.	H	α-helix	trans	-65.9	-43.1	179	178.3	59.4	0	0	0	112.8	F1013 Y1019 I1053 L1117 A1195 A1200 K1201	F1013-L1197 HydrophobicContact CE2-CD1 4.09Å; F1013-L1197 HydrophobicContact CZ-CD1 4.42Å; Y1019-L1197 HydrophobicContact CD2-CD1 4.09Å; Y1019-L1197 HydrophobicContact CE2-CD1 3.77Å; Y1019-L1197 HydrophobicContact CE2-CD2 4.4Å; I1053-L1197 HydrophobicContact CD1-CD1 4.11Å; I1053-L1197 HydrophobicContact CG2-CD1 4.19Å; L1117-L1197 HydrophobicContact CD1-CB 3.86Å; L1117-L1197 HydrophobicContact CD1-CD1 3.94Å; L1117-L1197 HydrophobicContact CD1-CG 4.49Å; A1195-L1197 VanDerWaalsContact C-N 3.26Å; A1195-L1197 PolarHBondContact O-N 3.49Å; A1195-L1197 VanDerWaalsContact O-N 3.15Å; L1197-A1200 PolarHBondContact O-N 3.27Å; L1197-K1201 HydrophobicContact CG-CD 4.48Å; L1197-K1201 WeakPolarHBondContact O-CG 3.3Å; L1197-K1201 PolarHBondContact O-N 3.03Å
1198	E	94.7	Very high	92.8	Very high	112 Å²	112	57 Å²	57	52%	0.523	31%	0.313	S	S	.	.	H	α-helix	trans	-74.3	-32	179.9	-61.9	-50.4	127	0	0	111.9	A1195 K1201 G1202	A1195-E1198 PolarHBondContact O-N 3.34Å; A1195-E1198 VanDerWaalsContact O-N 3.12Å; E1198-K1201 WeakPolarHBondContact OE1-CD 3.28Å; E1198-K1201 WeakPolarHBondContact OE1-CE 3.4Å; E1198-K1201 IonicContact OE1-NZ 3.57Å; E1198-K1201 PolarHBondContact OE1-NZ 2.96Å; E1198-K1201 WeakPolarHBondContact OE2-CD 3.27Å; E1198-K1201 IonicContact OE2-NZ 2.85Å; E1198-G1202 PolarHBondContact O-N 2.71Å
1199	V	95.1	Very high	91.5	Very high	53 Å²	53	54.9 Å²	54.9	32%	0.321	32%	0.316	S	S	.	.	H	α-helix	trans	-61.7	-45.2	168.8	177.8	0	0	0	0	110.4	I1142 I1189 A1195 G1202 I1203	I1142-V1199 HydrophobicContact CD1-CG1 4.2Å; I1142-V1199 HydrophobicContact CG2-CB 4.2Å; I1142-V1199 HydrophobicContact CG2-CG1 3.98Å; I1189-V1199 HydrophobicContact CG2-CG1 4.28Å; A1195-V1199 WeakPolarHBondContact O-CG2 3.48Å; A1195-V1199 PolarHBondContact O-N 3.18Å; A1195-V1199 VanDerWaalsContact O-N 3.14Å; V1199-G1202 PolarHBondContact O-N 3.02Å; V1199-I1203 HydrophobicContact CG1-CD1 3.97Å; V1199-I1203 WeakPolarHBondContact O-CG1 3.28Å; V1199-I1203 PolarHBondContact O-N 3.01Å
1200	A	96	Very high	89.6	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-63	-49.2	177.9	0	0	0	0	0	112.9	I1053 I1115 L1117 I1142 A1196 L1197 G1202 I1203 L1204	I1053-A1200 HydrophobicContact CD1-CB 3.84Å; I1053-A1200 HydrophobicContact CG1-CB 4.28Å; I1115-A1200 HydrophobicContact CD1-CB 3.87Å; I1115-A1200 HydrophobicContact CG2-CB 3.88Å; L1117-A1200 HydrophobicContact CD2-CB 3.77Å; I1142-A1200 HydrophobicContact CD1-CB 4.13Å; A1196-A1200 WeakPolarHBondContact O-CB 3.05Å; A1196-A1200 PolarHBondContact O-N 3.43Å; L1197-A1200 PolarHBondContact O-N 3.27Å; A1200-G1202 VanDerWaalsContact C-N 3.32Å; A1200-G1202 PolarHBondContact O-N 2.99Å; A1200-I1203 PolarHBondContact O-N 3.24Å; A1200-L1204 PolarHBondContact O-N 2.64Å
1201	K	93.8	Very high	87.5	Confident	43 Å²	43	57.1 Å²	57.1	19%	0.187	33%	0.334	C	S	.	.	H	α-helix	trans	-55.7	-46.7	172.4	-72.9	171.6	-179.9	172.7	0	111.4	F1013 I1053 L1197 E1198 I1203 L1204 N1205	F1013-K1201 HydrophobicContact CD2-CD 4.36Å; F1013-K1201 HydrophobicContact CD2-CG 4.1Å; F1013-K1201 HydrophobicContact CE2-CD 4.42Å; F1013-K1201 HydrophobicContact CE2-CG 4.3Å; I1053-K1201 HydrophobicContact CD1-CG 4.07Å; L1197-K1201 HydrophobicContact CG-CD 4.48Å; L1197-K1201 WeakPolarHBondContact O-CG 3.3Å; L1197-K1201 PolarHBondContact O-N 3.03Å; E1198-K1201 WeakPolarHBondContact OE1-CD 3.28Å; E1198-K1201 WeakPolarHBondContact OE1-CE 3.4Å; E1198-K1201 IonicContact OE1-NZ 3.57Å; E1198-K1201 PolarHBondContact OE1-NZ 2.96Å; E1198-K1201 WeakPolarHBondContact OE2-CD 3.27Å; E1198-K1201 IonicContact OE2-NZ 2.85Å; K1201-I1203 VanDerWaalsContact C-N 3.27Å; K1201-I1203 PolarHBondContact O-N 3.16Å; K1201-L1204 PolarHBondContact O-N 3.16Å; K1201-N1205 VanDerWaalsContact O-CB 3.31Å; K1201-N1205 WeakPolarHBondContact O-CB 3.26Å; K1201-N1205 PolarHBondContact O-N 3.07Å
1202	G	91.6	Very high	84.8	Confident	32 Å²	32	67.6 Å²	67.6	33%	0.33	38%	0.378	S	S	.	.	H	α-helix	trans	-62.5	-29.4	-179.6	0	0	0	0	0	114.2	E1198 V1199 A1200 K1206	E1198-G1202 PolarHBondContact O-N 2.71Å; V1199-G1202 PolarHBondContact O-N 3.02Å; A1200-G1202 VanDerWaalsContact C-N 3.32Å; A1200-G1202 PolarHBondContact O-N 2.99Å; G1202-K1206 WeakPolarHBondContact O-CD 3.39Å; G1202-K1206 VanDerWaalsContact O-CG 3.28Å; G1202-K1206 WeakPolarHBondContact O-CG 3.38Å
1203	I	93.3	Very high	84.3	Confident	52 Å²	52	68.2 Å²	68.2	27%	0.267	37%	0.374	S	S	.	.	H	α-helix	trans	-80.1	-47.3	174	-64.5	161.5	0	0	0	110.9	M1140 I1142 I1189 V1199 A1200 K1201 N1205 K1206 H1207	M1140-I1203 HydrophobicContact CE-CB 4.45Å; M1140-I1203 HydrophobicContact CE-CD1 4.01Å; M1140-I1203 HydrophobicContact CE-CG2 3.88Å; I1142-I1203 HydrophobicContact CD1-CD1 3.77Å; I1189-I1203 HydrophobicContact CD1-CD1 3.47Å; I1189-I1203 VanDerWaalsContact CD1-CD1 3.47Å; V1199-I1203 HydrophobicContact CG1-CD1 3.97Å; V1199-I1203 WeakPolarHBondContact O-CG1 3.28Å; V1199-I1203 PolarHBondContact O-N 3.01Å; A1200-I1203 PolarHBondContact O-N 3.24Å; K1201-I1203 VanDerWaalsContact C-N 3.27Å; K1201-I1203 PolarHBondContact O-N 3.16Å; I1203-N1205 PolarHBondContact O-N 3.4Å; I1203-K1206 PolarHBondContact O-N 2.67Å; I1203-H1207 WeakPolarHBondContact O-CB 3.24Å; I1203-H1207 PolarHBondContact O-N 2.79Å
1204	L	92.6	Very high	83.9	Confident	6 Å²	6	70.9 Å²	70.9	3%	0.031	39%	0.387	C	S	.	.	H	α-helix	trans	-64.4	-40.7	-179.6	-69.2	179.5	0	0	0	112.5	I1017 A1051 I1053 I1115 A1200 K1201 K1206 H1207 L1208	I1017-L1204 HydrophobicContact CD1-CB 3.6Å; I1017-L1204 HydrophobicContact CD1-CD1 4.44Å; I1017-L1204 HydrophobicContact CG1-CB 4.28Å; I1017-L1204 HydrophobicContact CG2-CD1 3.7Å; A1051-L1204 HydrophobicContact CB-CD1 4.03Å; A1051-L1204 HydrophobicContact CB-CD2 3.87Å; A1051-L1204 HydrophobicContact CB-CG 4.44Å; I1053-L1204 HydrophobicContact CD1-CD1 4.09Å; I1053-L1204 HydrophobicContact CG1-CD1 3.65Å; I1115-L1204 HydrophobicContact CD1-CD1 3.92Å; I1115-L1204 HydrophobicContact CD1-CD2 3.89Å; I1115-L1204 HydrophobicContact CD1-CG 3.59Å; I1115-L1204 HydrophobicContact CG1-CD1 4.31Å; I1115-L1204 HydrophobicContact CG1-CD2 4.22Å; I1115-L1204 HydrophobicContact CG1-CG 4.29Å; A1200-L1204 PolarHBondContact O-N 2.64Å; K1201-L1204 PolarHBondContact O-N 3.16Å; L1204-K1206 VanDerWaalsContact C-N 3.32Å; L1204-K1206 PolarHBondContact O-N 2.96Å; L1204-H1207 PolarHBondContact O-N 2.67Å; L1204-L1208 WeakPolarHBondContact O-CB 3.5Å; L1204-L1208 WeakPolarHBondContact O-CG 3.32Å; L1204-L1208 PolarHBondContact O-N 3.14Å
1205	N	87.8	Confident	83.4	Confident	50 Å²	50	66.4 Å²	66.4	27%	0.267	37%	0.369	S	S	.	.	H	α-helix	trans	-62.3	-36.9	175.6	-79.4	-21.3	0	0	0	112.4	N1015 I1017 K1201 I1203 G1209	N1015-N1205 PolarHBondContact ND2-OD1 3.23Å; I1017-N1205 WeakPolarHBondContact CD1-OD1 3.49Å; K1201-N1205 VanDerWaalsContact O-CB 3.31Å; K1201-N1205 WeakPolarHBondContact O-CB 3.26Å; K1201-N1205 PolarHBondContact O-N 3.07Å; I1203-N1205 PolarHBondContact O-N 3.4Å; N1205-G1209 WeakPolarHBondContact O-CA 3.24Å; N1205-G1209 PolarHBondContact O-N 3.4Å
1206	K	86.6	Confident	82.8	Confident	172 Å²	172	67.7 Å²	67.7	75%	0.748	37%	0.369	S	S	*	.	H	α-helix	trans	-70.7	-38.2	173.6	-73	174.5	-175.6	176	0	112.5	G1202 I1203 L1204 G1210	G1202-K1206 WeakPolarHBondContact O-CD 3.39Å; G1202-K1206 VanDerWaalsContact O-CG 3.28Å; G1202-K1206 WeakPolarHBondContact O-CG 3.38Å; I1203-K1206 PolarHBondContact O-N 2.67Å; L1204-K1206 VanDerWaalsContact C-N 3.32Å; L1204-K1206 PolarHBondContact O-N 2.96Å; K1206-G1210 PolarHBondContact O-N 2.63Å
1207	H	85.3	Confident	82	Confident	85 Å²	85	71.9 Å²	71.9	39%	0.394	39%	0.392	S	S	.	.	H	α-helix	trans	-67.9	-44.1	179.6	178.8	74.9	0	0	0	112.2	S1113 I1203 L1204	S1113-H1207 PolarHBondContact OG-NE2 2.85Å; I1203-H1207 WeakPolarHBondContact O-CB 3.24Å; I1203-H1207 PolarHBondContact O-N 2.79Å; L1204-H1207 PolarHBondContact O-N 2.67Å
1208	L	83.5	Confident	81	Confident	26 Å²	26	75.2 Å²	75.2	14%	0.136	41%	0.411	C	S	.	.	H	α-helix	trans	-76.5	-38.9	177.9	-64.5	172.8	0	0	0	112.1	N1015 I1017 N1050 A1051 L1204 G1210 Q1211	N1015-L1208 HydrophobicContact CB-CD1 4.12Å; I1017-L1208 HydrophobicContact CD1-CD1 4.14Å; I1017-L1208 HydrophobicContact CG1-CD1 3.72Å; N1050-L1208 HydrophobicContact CB-CD1 4.3Å; N1050-L1208 HydrophobicContact CB-CD2 4.17Å; A1051-L1208 HydrophobicContact CB-CD1 4.24Å; L1204-L1208 WeakPolarHBondContact O-CB 3.5Å; L1204-L1208 WeakPolarHBondContact O-CG 3.32Å; L1204-L1208 PolarHBondContact O-N 3.14Å; L1208-G1210 PolarHBondContact O-N 2.97Å; L1208-Q1211 PolarHBondContact O-N 2.72Å; L1208-Q1211 VanDerWaalsContact O-N 3.13Å
1209	G	68.3	Low	80	Confident	48 Å²	48	72.6 Å²	72.6	50%	0.495	40%	0.402	S	S	.	.	H	α-helix	trans	-66.9	-15.2	175.3	0	0	0	0	0	114.4	N1205 Q1211	N1205-G1209 WeakPolarHBondContact O-CA 3.24Å; N1205-G1209 PolarHBondContact O-N 3.4Å; G1209-Q1211 VanDerWaalsContact C-N 3.33Å
1210	G	57.7	Low	78.9	Confident	64 Å²	64	74.1 Å²	74.1	66%	0.66	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	9.2	172	0	0	0	0	0	114.9	K1206 L1208	K1206-G1210 PolarHBondContact O-N 2.63Å; L1208-G1210 PolarHBondContact O-N 2.97Å
1211	Q	51	Low	77.5	Confident	143 Å²	143	80.3 Å²	80.3	67%	0.668	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.1	22	-179.6	-65	-171.7	-12.6	0	0	113.7	L1208 G1209	L1208-Q1211 PolarHBondContact O-N 2.72Å; L1208-Q1211 VanDerWaalsContact O-N 3.13Å; G1209-Q1211 VanDerWaalsContact C-N 3.33Å
1212	Q	38.2	Very low	76	Confident	242 Å²	242	83.6 Å²	83.6	100%	1.131	47%	0.466	S	S	*	.			trans	-102.2	0	169.3	-69	-169.6	-5.7	0	0	111.4

Retrieved 1,212 of 1,212 residues in 937.1 ms (Link to these results)

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