A0A087YFU8_POEFO Loading...

Interleukin 1 receptor accessory protein-like 1a

May regulate secretion and presynaptic differentiation through inhibition of the activity of N-type voltage-gated calcium channel. During presynaptic differentiation may regulate both synaptic vesicle accumulation in axon terminals and subsequent axon terminal remodeling.

AlphaFold DB , UniProt , Accession A0A087YFU8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 715 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.5	Very low	52.6	Low	249 Å²	249	134.5 Å²	134.5	100%	1.227	71%	0.714	S	S	*	*				0	140	0	-69.5	140.8	172.9	0	0	108.3
2	R	40.2	Very low	52.7	Low	245 Å²	245	138.8 Å²	138.8	93%	0.925	72%	0.716	S	S	*	*			trans	-106.5	142	173.9	-75.2	179.9	173.8	166.1	-2.5	109.1
3	P	53	Low	52.9	Low	119 Å²	119	138.8 Å²	138.8	77%	0.773	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-72	150.2	174.4	30.9	-34.6	0	0	0	111.3
4	P	48.8	Very low	53	Low	120 Å²	120	134.4 Å²	134.4	78%	0.779	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-71.4	157.6	170.4	31.5	-34.6	0	0	0	111.5
5	S	54.3	Low	53	Low	72 Å²	72	132.5 Å²	132.5	50%	0.503	68%	0.682	S	S	.	*	P	Polyproline II helix	trans	-81.7	152.2	-176.2	63.3	0	0	0	0	113.1	L7	S5-L7 PolarHBondContact O-N 3.08Å; S5-L7 VanDerWaalsContact O-N 3.14Å
6	P	56.4	Low	53	Low	102 Å²	102	128.2 Å²	128.2	66%	0.662	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-13.8	-177.2	26.3	-35.4	0	0	0	114.6	L8 I9	P6-L8 VanDerWaalsContact C-N 3.3Å; P6-L8 PolarHBondContact O-N 3.25Å; P6-I9 PolarHBondContact O-N 2.83Å
7	L	55.8	Low	52.7	Low	123 Å²	123	130 Å²	130	64%	0.644	67%	0.668	S	S	*	*	H	α-helix	trans	-61	-32.3	-179.5	-93.7	155.4	0	0	0	113.7	S5 I9 L11	S5-L7 PolarHBondContact O-N 3.08Å; S5-L7 VanDerWaalsContact O-N 3.14Å; L7-I9 VanDerWaalsContact C-N 3.31Å; L7-I9 PolarHBondContact O-N 3.46Å; L7-L11 PolarHBondContact O-N 3.27Å
8	L	55.2	Low	52.3	Low	121 Å²	121	127.3 Å²	127.3	63%	0.634	66%	0.662	S	S	*	*	H	α-helix	trans	-68	-31.1	179.5	-122.8	78.7	0	0	0	112.9	P6 Y12	P6-L8 VanDerWaalsContact C-N 3.3Å; P6-L8 PolarHBondContact O-N 3.25Å; L8-Y12 PolarHBondContact O-N 3.19Å
9	I	58.2	Low	51.8	Low	111 Å²	111	125.8 Å²	125.8	57%	0.569	66%	0.659	S	S	*	*	H	α-helix	trans	-73.7	-42.1	-176.4	-60.3	174.9	0	0	0	110.1	P6 L7 L11 Y12 F13	P6-I9 PolarHBondContact O-N 2.83Å; L7-I9 VanDerWaalsContact C-N 3.31Å; L7-I9 PolarHBondContact O-N 3.46Å; I9-L11 VanDerWaalsContact C-N 3.34Å; I9-L11 PolarHBondContact O-N 2.83Å; I9-Y12 PolarHBondContact O-N 3.36Å; I9-F13 HydrophobicContact CG2-CD2 4.05Å; I9-F13 HydrophobicContact CG2-CE2 4.16Å; I9-F13 WeakPolarHBondContact O-CD2 3.34Å; I9-F13 PolarHBondContact O-N 3.06Å; I9-F13 VanDerWaalsContact O-N 3.12Å
10	L	55.5	Low	51	Low	117 Å²	117	128 Å²	128	61%	0.613	66%	0.663	S	S	*	*	H	α-helix	trans	-60.6	-41.3	175.7	-85.7	160.9	0	0	0	112.3	Y12 F13 T14	L10-Y12 VanDerWaalsContact C-N 3.34Å; L10-Y12 PolarHBondContact O-N 3.1Å; L10-F13 PolarHBondContact O-N 3.11Å; L10-T14 PolarHBondContact O-N 3.39Å; L10-T14 PolarHBondContact O-OG1 3.06Å
11	L	56.1	Low	50.5	Low	101 Å²	101	127.7 Å²	127.7	53%	0.529	67%	0.666	S	S	.	*	H	α-helix	trans	-62.2	-38.1	176.1	-107.2	163.4	0	0	0	113	L7 I9 T14 L15	L7-L11 PolarHBondContact O-N 3.27Å; I9-L11 VanDerWaalsContact C-N 3.34Å; I9-L11 PolarHBondContact O-N 2.83Å; L11-T14 PolarHBondContact O-OG1 3.13Å; L11-T14 VanDerWaalsContact O-OG1 3.07Å; L11-L15 HydrophobicContact CD2-CD1 3.87Å; L11-L15 VanDerWaalsContact O-CD1 3.32Å; L11-L15 WeakPolarHBondContact O-CD1 3.49Å; L11-L15 PolarHBondContact O-N 2.79Å
12	Y	53.9	Low	50.4	Low	186 Å²	186	121.6 Å²	121.6	73%	0.729	64%	0.643	S	S	*	*	H	α-helix	trans	-67.4	-37.3	174.4	-112.6	-87.7	0	0	0	112.5	L8 I9 L10 S16	L8-Y12 PolarHBondContact O-N 3.19Å; I9-Y12 PolarHBondContact O-N 3.36Å; L10-Y12 VanDerWaalsContact C-N 3.34Å; L10-Y12 PolarHBondContact O-N 3.1Å; Y12-S16 WeakPolarHBondContact O-CB 3.28Å; Y12-S16 PolarHBondContact O-N 2.69Å
13	F	54.6	Low	50.2	Low	139 Å²	139	115.1 Å²	115.1	61%	0.61	64%	0.635	S	S	*	*	H	α-helix	trans	-71.4	-33.1	177.6	-92.4	-80.1	0	0	0	113.6	I9 L10 K17	I9-F13 HydrophobicContact CG2-CD2 4.05Å; I9-F13 HydrophobicContact CG2-CE2 4.16Å; I9-F13 WeakPolarHBondContact O-CD2 3.34Å; I9-F13 PolarHBondContact O-N 3.06Å; I9-F13 VanDerWaalsContact O-N 3.12Å; L10-F13 PolarHBondContact O-N 3.11Å; F13-K17 PolarHBondContact O-N 2.79Å
14	T	55	Low	49.3	Very low	76 Å²	76	118.2 Å²	118.2	47%	0.466	64%	0.637	S	S	.	*	H	α-helix	trans	-71.6	-48.7	175.1	53.1	0	0	0	0	111.6	L10 L11 S16 K17 S18	L10-T14 PolarHBondContact O-N 3.39Å; L10-T14 PolarHBondContact O-OG1 3.06Å; L11-T14 PolarHBondContact O-OG1 3.13Å; L11-T14 VanDerWaalsContact O-OG1 3.07Å; T14-S16 VanDerWaalsContact C-N 3.33Å; T14-S16 PolarHBondContact O-N 3.38Å; T14-K17 PolarHBondContact O-N 3.29Å; T14-S18 PolarHBondContact O-N 2.98Å; T14-S18 PolarHBondContact O-OG 2.79Å
15	L	52.3	Low	48.9	Very low	107 Å²	107	124.7 Å²	124.7	56%	0.56	65%	0.646	S	S	*	*	H	α-helix	trans	-60.1	-40.8	175.7	-90.1	107.7	0	0	0	112.7	L11 K17 S18 V19	L11-L15 HydrophobicContact CD2-CD1 3.87Å; L11-L15 VanDerWaalsContact O-CD1 3.32Å; L11-L15 WeakPolarHBondContact O-CD1 3.49Å; L11-L15 PolarHBondContact O-N 2.79Å; L15-K17 VanDerWaalsContact C-N 3.29Å; L15-K17 PolarHBondContact O-N 2.84Å; L15-S18 PolarHBondContact O-N 2.65Å; L15-V19 WeakPolarHBondContact O-CG2 3.31Å; L15-V19 PolarHBondContact O-N 2.96Å
16	S	52.9	Low	48	Very low	63 Å²	63	124.9 Å²	124.9	44%	0.441	66%	0.658	S	S	.	*	H	α-helix	trans	-62.7	-34.2	177.6	-173.5	0	0	0	0	112.9	Y12 T14 K20	Y12-S16 WeakPolarHBondContact O-CB 3.28Å; Y12-S16 PolarHBondContact O-N 2.69Å; T14-S16 VanDerWaalsContact C-N 3.33Å; T14-S16 PolarHBondContact O-N 3.38Å; S16-K20 PolarHBondContact O-N 2.72Å
17	K	48.5	Very low	46.9	Very low	159 Å²	159	124 Å²	124	69%	0.691	66%	0.655	S	S	*	*	H	α-helix	trans	-70.1	-45.6	171.3	-78.6	-174.9	173.4	-175.3	0	112	F13 T14 L15 V19 K20 V21	F13-K17 PolarHBondContact O-N 2.79Å; T14-K17 PolarHBondContact O-N 3.29Å; L15-K17 VanDerWaalsContact C-N 3.29Å; L15-K17 PolarHBondContact O-N 2.84Å; K17-V19 PolarHBondContact O-N 3.08Å; K17-K20 PolarHBondContact O-N 3.49Å; K17-V21 PolarHBondContact O-N 3.07Å
18	S	46.2	Very low	46.6	Very low	81 Å²	81	123.3 Å²	123.3	57%	0.566	66%	0.656	S	S	*	*	H	α-helix	trans	-60.9	-40.8	179.7	-58.9	0	0	0	0	113	T14 L15 K20 V21	T14-S18 PolarHBondContact O-N 2.98Å; T14-S18 PolarHBondContact O-OG 2.79Å; L15-S18 PolarHBondContact O-N 2.65Å; S18-K20 PolarHBondContact O-N 3.48Å; S18-V21 PolarHBondContact O-N 3.43Å
19	V	42.5	Very low	46.4	Very low	99 Å²	99	124.3 Å²	124.3	60%	0.6	66%	0.661	S	S	*	*	H	α-helix	trans	-67.7	-34	177.7	173.5	0	0	0	0	112.1	L15 K17 V21 V22	L15-V19 WeakPolarHBondContact O-CG2 3.31Å; L15-V19 PolarHBondContact O-N 2.96Å; K17-V19 PolarHBondContact O-N 3.08Å; V19-V21 PolarHBondContact O-N 3.39Å; V19-V22 PolarHBondContact O-N 2.88Å
20	K	35.8	Very low	47	Very low	169 Å²	169	122 Å²	122	74%	0.735	67%	0.666	S	S	*	*	H	α-helix	trans	-70.8	-12	177.7	-82.5	-173	172.9	-175.6	0	115	S16 K17 S18	S16-K20 PolarHBondContact O-N 2.72Å; K17-K20 PolarHBondContact O-N 3.49Å; S18-K20 PolarHBondContact O-N 3.48Å
21	V	40.1	Very low	48.4	Very low	122 Å²	122	118.5 Å²	118.5	74%	0.739	65%	0.65	S	S	*	*	H	α-helix	trans	-84.3	-25.5	174.9	177	0	0	0	0	112.1	K17 S18 V19	K17-V21 PolarHBondContact O-N 3.07Å; S18-V21 PolarHBondContact O-N 3.43Å; V19-V21 PolarHBondContact O-N 3.39Å
22	V	42.2	Very low	50.1	Low	122 Å²	122	117.6 Å²	117.6	74%	0.739	65%	0.649	S	S	*	*	H	α-helix	trans	-85.4	-29.1	-177.2	-176.9	0	0	0	0	112.5	V19 K24	V19-V22 PolarHBondContact O-N 2.88Å; V22-K24 PolarHBondContact O-N 3.49Å
23	S	36.4	Very low	51.9	Low	108 Å²	108	112.9 Å²	112.9	76%	0.755	64%	0.636	S	S	*	*			trans	-93.8	64.6	-179.4	-158.4	0	0	0	0	113.3
24	K	34.5	Very low	53.7	Low	185 Å²	185	112.2 Å²	112.2	80%	0.804	63%	0.63	S	S	*	*			trans	-135.6	21.6	167.4	-141.5	-174	-178.9	-168.2	0	114.5	V22 G26	V22-K24 PolarHBondContact O-N 3.49Å; K24-G26 VanDerWaalsContact C-N 3.31Å; K24-G26 PolarHBondContact O-N 3.24Å
25	R	40.4	Very low	55.4	Low	256 Å²	256	112.2 Å²	112.2	97%	0.966	63%	0.633	S	S	*	*	S	Bend	trans	-90.7	38.3	173.6	-87.3	-174.1	171.6	-179.6	-1.4	113.2
26	G	36.6	Very low	57.3	Low	75 Å²	75	110.1 Å²	110.1	77%	0.773	62%	0.624	S	S	*	*			trans	-153.5	33.3	-169.6	0	0	0	0	0	115.6	K24	K24-G26 VanDerWaalsContact C-N 3.31Å; K24-G26 PolarHBondContact O-N 3.24Å
27	S	33.1	Very low	59.2	Low	85 Å²	85	107.6 Å²	107.6	59%	0.594	61%	0.606	S	S	*	*			trans	-117.8	129.8	169.7	-146.4	0	0	0	0	108.2	D29	S27-D29 VanDerWaalsContact C-N 3.29Å; S27-D29 WeakPolarHBondContact CB-OD2 3.23Å; S27-D29 PolarHBondContact O-N 2.73Å; S27-D29 PolarHBondContact OG-OD2 2.87Å
28	V	49.2	Very low	61.3	Low	108 Å²	108	109.6 Å²	109.6	66%	0.655	61%	0.611	S	S	*	*			trans	-96.3	53.6	-171.8	-167.9	0	0	0	0	110.4
29	D	50.9	Low	63.4	Low	141 Å²	141	109 Å²	109	75%	0.754	60%	0.598	S	S	*	*	S	Bend	trans	-114.8	1.3	-175.2	-56.5	-74.3	0	0	0	113.2	S27	S27-D29 VanDerWaalsContact C-N 3.29Å; S27-D29 WeakPolarHBondContact CB-OD2 3.23Å; S27-D29 PolarHBondContact O-N 2.73Å; S27-D29 PolarHBondContact OG-OD2 2.87Å
30	G	71.1	Confident	65.8	Low	64 Å²	64	110.9 Å²	110.9	66%	0.66	60%	0.598	S	S	*	*			trans	-149.6	143.8	178.6	0	0	0	0	0	112.1
31	C	85.3	Confident	68.5	Low	42 Å²	42	103.6 Å²	103.6	28%	0.284	57%	0.566	S	S	.	*			trans	-80.1	150	167.5	-155.3	0	0	0	0	109.4	D33 C128 M129	C31-D33 PolarHBondContact O-N 3.32Å; C31-C128 HydrophobicContact CB-CB 3.91Å; C31-C128 WeakPolarHBondContact CB-SG 3.06Å; C31-C128 WeakPolarHBondContact SG-CB 3.41Å; C31-C128 CovalentContact SG-SG 2.05Å; C31-C128 PolarHBondContact SG-SG 3.25Å; C31-M129 VanDerWaalsContact SG-C 3.5Å; C31-M129 PolarHBondContact SG-N 2.75Å
32	T	91.1	Very high	71.1	Confident	82 Å²	82	102 Å²	102	50%	0.503	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.7	95.9	174.7	-51	0	0	0	0	108.8	C128 M129 K130	T32-C128 WeakPolarHBondContact CB-O 3.32Å; T32-C128 PolarHBondContact N-O 3.48Å; T32-C128 PolarHBondContact OG1-O 2.99Å; T32-C128 VanDerWaalsContact OG1-O 3.09Å; T32-M129 CarbonylContact O-C 3.53Å; T32-M129 VanDerWaalsContact O-CA 3.3Å; T32-M129 WeakPolarHBondContact O-CA 3.1Å; T32-K130 PolarHBondContact O-N 3.35Å
33	D	90.8	Very high	73.6	Confident	87 Å²	87	96.3 Å²	96.3	47%	0.465	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	122.8	-177.2	-164.8	-7.4	0	0	0	111.1	C31 S35 K130	C31-D33 PolarHBondContact O-N 3.32Å; D33-S35 PolarHBondContact OD1-N 3.39Å; D33-K130 HydrophobicContact CB-CG 4.23Å; D33-K130 VanDerWaalsContact OD1-CE 3.27Å; D33-K130 WeakPolarHBondContact OD1-CE 3.37Å; D33-K130 WeakPolarHBondContact OD2-CE 3.39Å; D33-K130 IonicContact OD2-NZ 3.48Å; D33-K130 PolarHBondContact OD2-NZ 3.02Å
34	W	92.1	Very high	76.4	Confident	125 Å²	125	92 Å²	92	47%	0.473	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	5	174.2	-67.7	97.6	0	0	0	113.1	Y59 K130 V131	W34-Y59 HydrophobicContact CB-CD1 4.17Å; W34-Y59 HydrophobicContact CB-CE1 3.71Å; W34-Y59 AromaticContact CD2-CD1 3.42Å; W34-Y59 HydrophobicContact CD2-CD1 3.42Å; W34-Y59 VanDerWaalsContact CD2-CD1 3.42Å; W34-Y59 AromaticContact CD2-CE1 3.61Å; W34-Y59 HydrophobicContact CD2-CE1 3.61Å; W34-Y59 AromaticContact CE2-CD1 3.79Å; W34-Y59 AromaticContact CE3-CD1 3.69Å; W34-Y59 HydrophobicContact CE3-CD1 3.69Å; W34-Y59 AromaticContact CE3-CE1 3.6Å; W34-Y59 HydrophobicContact CE3-CE1 3.6Å; W34-Y59 AromaticContact CG-CD1 3.65Å; W34-Y59 HydrophobicContact CG-CD1 3.65Å; W34-Y59 AromaticContact CG-CE1 3.68Å; W34-Y59 HydrophobicContact CG-CE1 3.68Å; W34-Y59 HydrophobicContact CZ2-CD1 4.33Å; W34-Y59 HydrophobicContact CZ3-CD1 4.24Å; W34-Y59 HydrophobicContact CZ3-CE1 4.39Å; W34-K130 PolarHBondContact N-O 2.69Å; W34-V131 HydrophobicContact CB-CB 4.07Å; W34-V131 HydrophobicContact CB-CG2 3.92Å
35	S	91.1	Very high	79.3	Confident	77 Å²	77	87 Å²	87	54%	0.538	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	62.6	-148.5	-175.1	-165.1	0	0	0	0	112	D33 V131 S132	D33-S35 PolarHBondContact OD1-N 3.39Å; S35-V131 WeakPolarHBondContact O-CG2 3.28Å; S35-S132 PolarHBondContact O-N 2.9Å
36	V	91.9	Very high	81.8	Confident	62 Å²	62	76.7 Å²	76.7	38%	0.376	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	131.4	178.7	-170.4	0	0	0	0	110.5	L117 S132 A134	V36-L117 HydrophobicContact CG1-CD2 4Å; V36-L117 HydrophobicContact CG2-CD1 3.93Å; V36-L117 HydrophobicContact CG2-CD2 3.97Å; V36-S132 CarbonylContact C-O 3.58Å; V36-S132 VanDerWaalsContact CA-O 3.25Å; V36-S132 WeakPolarHBondContact CA-O 3.41Å; V36-S132 WeakPolarHBondContact CG1-O 3.47Å; V36-A134 HydrophobicContact CG1-CB 4.23Å
37	D	94.2	Very high	84.6	Confident	11 Å²	11	73.3 Å²	73.3	6%	0.059	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	154.9	174.4	-177.2	47.7	0	0	0	111.9	K39 A54 Y59 V131 S132 M133	D37-K39 VanDerWaalsContact C-N 3.31Å; D37-K39 PolarHBondContact O-N 3.47Å; D37-K39 VanDerWaalsContact OD2-CB 3.28Å; D37-K39 WeakPolarHBondContact OD2-CB 3.44Å; D37-K39 PolarHBondContact OD2-N 3.19Å; D37-K39 VanDerWaalsContact OD2-N 3.11Å; D37-A54 HydrophobicContact CB-CB 4.03Å; D37-Y59 PolarHBondContact OD1-OH 2.9Å; D37-V131 HydrophobicContact CB-CG2 4.01Å; D37-S132 PolarHBondContact N-O 2.82Å; D37-M133 HydrophobicContact CB-CG 4.4Å
38	Y	91.8	Very high	87.5	Confident	201 Å²	201	69.2 Å²	69.2	79%	0.788	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	-25.4	179.3	70	-81.8	0	0	0	112.6	K40	Y38-K40 PolarHBondContact O-N 3.27Å
39	K	90.9	Very high	89.7	Confident	67 Å²	67	64.2 Å²	64.2	29%	0.291	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	118.5	175.4	-169.8	-177.3	175.6	-173.4	0	110.7	D37 Y41 E168	D37-K39 VanDerWaalsContact C-N 3.31Å; D37-K39 PolarHBondContact O-N 3.47Å; D37-K39 VanDerWaalsContact OD2-CB 3.28Å; D37-K39 WeakPolarHBondContact OD2-CB 3.44Å; D37-K39 PolarHBondContact OD2-N 3.19Å; D37-K39 VanDerWaalsContact OD2-N 3.11Å; K39-Y41 HydrophobicContact CD-CE2 4.24Å; K39-Y41 HydrophobicContact CG-CE2 4.44Å; K39-E168 WeakPolarHBondContact CE-OE1 3.35Å; K39-E168 WeakPolarHBondContact CE-OE2 3.25Å; K39-E168 IonicContact NZ-OE1 3.75Å; K39-E168 IonicContact NZ-OE2 3.24Å; K39-E168 PolarHBondContact NZ-OE2 2.86Å
40	K	92	Very high	91.7	Very high	140 Å²	140	59.4 Å²	59.4	61%	0.609	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.9	172.5	-56.6	-179.3	-176.1	176.3	0	109.1	Y38 A134	Y38-K40 PolarHBondContact O-N 3.27Å; K40-A134 HydrophobicContact CG-CB 4.33Å
41	Y	93.6	Very high	92.9	Very high	16 Å²	16	56.3 Å²	56.3	6%	0.063	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.4	173.4	-66.3	-99.6	0	0	0	108.2	K39 V49 R50 L51 K52 M133 A134 A136	K39-Y41 HydrophobicContact CD-CE2 4.24Å; K39-Y41 HydrophobicContact CG-CE2 4.44Å; Y41-V49 HydrophobicContact CD1-CG2 4.27Å; Y41-R50 VanDerWaalsContact CE1-O 3.29Å; Y41-R50 WeakPolarHBondContact CE1-O 3.28Å; Y41-L51 HydrophobicContact CD1-CD1 4.3Å; Y41-L51 HydrophobicContact CD1-CG 4.49Å; Y41-L51 HydrophobicContact CD2-CG 4.23Å; Y41-L51 HydrophobicContact CG-CD1 4.22Å; Y41-L51 HydrophobicContact CG-CG 4.23Å; Y41-K52 PolarHBondContact OH-N 3.23Å; Y41-M133 HydrophobicContact CD2-CB 4.27Å; Y41-M133 HydrophobicContact CE2-CB 4.05Å; Y41-M133 HydrophobicContact CE2-CG 4.05Å; Y41-A134 PolarHBondContact N-O 3.18Å; Y41-A136 PolarHBondContact O-N 2.87Å
42	Q	93.8	Very high	93.4	Very high	87 Å²	87	56.2 Å²	56.2	41%	0.407	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	122.1	178.5	-65.7	-173.9	-49.3	0	0	108.9	A136 N149 M150	Q42-A136 WeakPolarHBondContact CA-O 3.31Å; Q42-A136 HydrophobicContact CG-CB 4.38Å; Q42-N149 PolarHBondContact NE2-O 3.24Å; Q42-M150 HydrophobicContact CB-CB 4.38Å; Q42-M150 HydrophobicContact CB-CE 4.17Å; Q42-M150 HydrophobicContact CB-CG 4.01Å; Q42-M150 HydrophobicContact CB-SD 4.13Å; Q42-M150 HydrophobicContact CG-CG 4.44Å
43	V	94.6	Very high	93.6	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.024	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	159.3	-179.1	-65.9	0	0	0	0	112	V49 A110 L135 A136 V137 A138	V43-V49 HydrophobicContact CG1-CB 3.91Å; V43-V49 HydrophobicContact CG1-CG2 3.72Å; V43-V49 HydrophobicContact CG2-CB 4.32Å; V43-V49 HydrophobicContact CG2-CG1 4.2Å; V43-A110 HydrophobicContact CG2-CB 4.16Å; V43-L135 HydrophobicContact CG2-CD1 4.15Å; V43-A136 PolarHBondContact N-O 3.46Å; V43-V137 HydrophobicContact CG2-CG2 4.1Å; V43-V137 WeakPolarHBondContact O-CA 3.38Å; V43-A138 PolarHBondContact O-N 3.07Å
44	L	95	Very high	93.8	Very high	16 Å²	16	48.6 Å²	48.6	8%	0.084	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	151.9	172.1	-59.8	172.6	0	0	0	110.6	G46 E47 A138 N140 N147	L44-G46 PolarHBondContact O-N 2.89Å; L44-E47 HydrophobicContact CB-CG 3.94Å; L44-E47 PolarHBondContact N-OE2 3.35Å; L44-E47 WeakPolarHBondContact O-CB 3.38Å; L44-E47 WeakPolarHBondContact O-CG 3.4Å; L44-E47 PolarHBondContact O-N 2.71Å; L44-A138 CarbonylContact C-O 3.52Å; L44-A138 VanDerWaalsContact CA-O 3.3Å; L44-A138 WeakPolarHBondContact CA-O 3.48Å; L44-N140 HydrophobicContact CD2-CB 4.44Å; L44-N147 HydrophobicContact CD2-CB 4.07Å
45	Q	95.5	Very high	93.9	Very high	82 Å²	82	42.6 Å²	42.6	38%	0.383	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	136.6	171.5	-165.5	-165.1	25.8	0	0	110	E47 D111 L112 V137 A138	Q45-E47 VanDerWaalsContact C-N 3.35Å; Q45-D111 PolarHBondContact NE2-OD1 3.21Å; Q45-L112 HydrophobicContact CB-CD2 4.32Å; Q45-L112 HydrophobicContact CB-CG 4.41Å; Q45-L112 HydrophobicContact CG-CD2 4.49Å; Q45-L112 HydrophobicContact CG-CG 4.06Å; Q45-V137 HydrophobicContact CB-CG1 4.18Å; Q45-A138 PolarHBondContact N-O 3.45Å
46	G	92.9	Very high	94	Very high	38 Å²	38	40 Å²	40	39%	0.392	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	-8.7	-178.2	0	0	0	0	0	115.2	L44 P109 A110	L44-G46 PolarHBondContact O-N 2.89Å; G46-P109 VanDerWaalsContact C-CB 3.49Å; G46-P109 VanDerWaalsContact O-CB 3.31Å; G46-P109 WeakPolarHBondContact O-CB 3.48Å; G46-A110 PolarHBondContact N-O 2.82Å
47	E	94.8	Very high	93.9	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.019	20%	0.199	C	C	.	.			trans	-78.2	161.1	172.4	-59.2	-167.2	148.7	0	0	112.3	L44 Q45 P109 A110 R228 R229	L44-E47 HydrophobicContact CB-CG 3.94Å; L44-E47 PolarHBondContact N-OE2 3.35Å; L44-E47 WeakPolarHBondContact O-CB 3.38Å; L44-E47 WeakPolarHBondContact O-CG 3.4Å; L44-E47 PolarHBondContact O-N 2.71Å; Q45-E47 VanDerWaalsContact C-N 3.35Å; E47-P109 CarbonylContact O-C 3.56Å; E47-P109 VanDerWaalsContact O-CA 3.31Å; E47-P109 WeakPolarHBondContact O-CA 3.19Å; E47-P109 WeakPolarHBondContact O-CB 3.22Å; E47-A110 PolarHBondContact O-N 3.36Å; E47-R228 PolarHBondContact OE1-N 3.48Å; E47-R229 IonicContact OE1-NH1 2.77Å; E47-R229 IonicContact OE2-CZ 2.7Å; E47-R229 IonicContact OE2-NH1 3.74Å; E47-R229 PolarHBondContact OE2-NH1 3.29Å; E47-R229 IonicContact OE2-NH2 3.76Å
48	A	94.4	Very high	93.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.227	C	C	.	.			trans	-87.4	143.1	165.5	0	0	0	0	0	110.6	F107 R108 Y172 F222 F225	A48-F107 VanDerWaalsContact CA-O 3.3Å; A48-F107 WeakPolarHBondContact CA-O 3.25Å; A48-R108 HydrophobicContact CB-CG 4.47Å; A48-Y172 HydrophobicContact CB-CE1 4.46Å; A48-Y172 PolarHBondContact O-OH 3.08Å; A48-F222 HydrophobicContact CB-CD1 4.09Å; A48-F222 HydrophobicContact CB-CE1 4.35Å; A48-F225 HydrophobicContact CB-CB 4.24Å; A48-F225 HydrophobicContact CB-CD2 4.19Å; A48-F225 HydrophobicContact CB-CG 4.21Å
49	V	95.2	Very high	93.5	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	145.3	173.9	69.5	0	0	0	0	112.6	Y41 V43 L51 W106 F107 A110 L135	Y41-V49 HydrophobicContact CD1-CG2 4.27Å; V43-V49 HydrophobicContact CG1-CB 3.91Å; V43-V49 HydrophobicContact CG1-CG2 3.72Å; V43-V49 HydrophobicContact CG2-CB 4.32Å; V43-V49 HydrophobicContact CG2-CG1 4.2Å; V49-L51 HydrophobicContact CG1-CD1 3.99Å; V49-L51 HydrophobicContact CG2-CD1 4.08Å; V49-W106 WeakPolarHBondContact O-CA 3.05Å; V49-F107 HydrophobicContact CG1-CB 3.91Å; V49-F107 HydrophobicContact CG1-CD2 3.89Å; V49-F107 HydrophobicContact CG1-CG 4.16Å; V49-F107 PolarHBondContact N-O 2.91Å; V49-F107 PolarHBondContact O-N 2.93Å; V49-A110 HydrophobicContact CG1-CB 4.19Å; V49-L135 HydrophobicContact CG1-CD1 4.43Å
50	R	94.8	Very high	93.4	Very high	39 Å²	39	38.1 Å²	38.1	15%	0.147	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	112	174.6	-173.1	-170.4	178.1	170.9	5	110.8	Y41 K52 E102 D103 A104 I105 W106 D171	Y41-R50 VanDerWaalsContact CE1-O 3.29Å; Y41-R50 WeakPolarHBondContact CE1-O 3.28Å; R50-K52 HydrophobicContact CG-CG 4.43Å; R50-K52 PolarHBondContact O-N 2.9Å; R50-E102 IonicContact NH2-OE2 2.7Å; R50-D103 IonicContact NH2-OD1 3.94Å; R50-D103 PolarHBondContact NH2-OD1 2.8Å; R50-D103 VanDerWaalsContact NH2-OD1 3.16Å; R50-A104 HydrophobicContact CG-CB 3.75Å; R50-I105 CarbonylContact C-O 3.55Å; R50-I105 WeakPolarHBondContact CA-O 3.48Å; R50-W106 HydrophobicContact CB-CD2 3.76Å; R50-W106 HydrophobicContact CB-CE3 3.89Å; R50-W106 HydrophobicContact CB-CG 4.44Å; R50-W106 HydrophobicContact CB-CH2 4.08Å; R50-W106 HydrophobicContact CB-CZ2 3.96Å; R50-W106 HydrophobicContact CB-CZ3 4.04Å; R50-W106 HydrophobicContact CG-CD2 3.98Å; R50-W106 HydrophobicContact CG-CG 4.32Å; R50-W106 HydrophobicContact CG-CZ2 4.09Å; R50-D171 HydrophobicContact CB-CB 4.4Å; R50-D171 WeakPolarHBondContact CD-OD1 3.22Å; R50-D171 IonicContact CZ-OD1 2.83Å; R50-D171 IonicContact NE-OD1 2.66Å; R50-D171 IonicContact NH1-OD1 2.75Å; R50-D171 PolarHBondContact NH1-OD1 2.88Å
51	L	95.1	Very high	93.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	103	171.5	-86.5	64	0	0	0	109.6	Y41 V49 A104 I105 F107 Y118 L135	Y41-L51 HydrophobicContact CD1-CD1 4.3Å; Y41-L51 HydrophobicContact CD1-CG 4.49Å; Y41-L51 HydrophobicContact CD2-CG 4.23Å; Y41-L51 HydrophobicContact CG-CD1 4.22Å; Y41-L51 HydrophobicContact CG-CG 4.23Å; V49-L51 HydrophobicContact CG1-CD1 3.99Å; V49-L51 HydrophobicContact CG2-CD1 4.08Å; L51-A104 CarbonylContact O-C 3.46Å; L51-A104 WeakPolarHBondContact O-CA 3.39Å; L51-A104 VanDerWaalsContact O-CB 3.31Å; L51-A104 WeakPolarHBondContact O-CB 3.34Å; L51-I105 PolarHBondContact N-O 3.4Å; L51-I105 PolarHBondContact O-N 3.35Å; L51-F107 HydrophobicContact CD1-CD2 4.12Å; L51-F107 HydrophobicContact CD1-CE2 3.86Å; L51-F107 HydrophobicContact CD2-CE2 4.07Å; L51-F107 HydrophobicContact CG-CE2 4.41Å; L51-Y118 HydrophobicContact CD2-CD1 4.33Å; L51-Y118 HydrophobicContact CD2-CD2 3.84Å; L51-Y118 HydrophobicContact CD2-CG 3.74Å; L51-L135 HydrophobicContact CD1-CD1 4.24Å; L51-L135 HydrophobicContact CD1-CD2 4.17Å; L51-L135 HydrophobicContact CD2-CB 4.21Å; L51-L135 HydrophobicContact CD2-CD2 4.28Å
52	K	94.9	Very high	93	Very high	39 Å²	39	44.8 Å²	44.8	17%	0.17	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	139.6	172.4	-75.8	163.4	173.6	153.6	0	110.7	Y41 R50 A54 Y57 A104 D171	Y41-K52 PolarHBondContact OH-N 3.23Å; R50-K52 HydrophobicContact CG-CG 4.43Å; R50-K52 PolarHBondContact O-N 2.9Å; K52-A54 PolarHBondContact O-N 3.21Å; K52-A54 VanDerWaalsContact O-N 3.14Å; K52-Y57 HydrophobicContact CB-CD2 4.21Å; K52-Y57 HydrophobicContact CB-CE2 3.72Å; K52-Y57 HydrophobicContact CD-CE2 4.1Å; K52-Y57 HydrophobicContact CG-CE2 4.09Å; K52-A104 HydrophobicContact CG-CB 4.25Å; K52-D171 VanDerWaalsContact CE-OD1 3.28Å; K52-D171 WeakPolarHBondContact CE-OD1 3.46Å; K52-D171 WeakPolarHBondContact CE-OD2 3.44Å; K52-D171 IonicContact NZ-OD1 3.16Å; K52-D171 PolarHBondContact NZ-OD1 3.24Å; K52-D171 IonicContact NZ-OD2 3.67Å; K52-D171 PolarHBondContact NZ-OD2 3.19Å
53	C	95.6	Very high	92.9	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.221	C	C	.	.			trans	-68.7	107.5	174.9	175	0	0	0	0	110.9	L55 F56 W76 D103 C120	C53-L55 PolarHBondContact O-N 2.85Å; C53-F56 HydrophobicContact CB-CD2 3.95Å; C53-F56 HydrophobicContact CB-CE2 4.03Å; C53-F56 PolarHBondContact O-N 2.78Å; C53-W76 HydrophobicContact CB-CH2 4.1Å; C53-W76 HydrophobicContact CB-CZ2 3.78Å; C53-D103 WeakPolarHBondContact CB-O 3.36Å; C53-D103 PolarHBondContact N-O 3.42Å; C53-D103 VanDerWaalsContact N-O 3.1Å; C53-C120 WeakPolarHBondContact CA-SG 3.37Å; C53-C120 HydrophobicContact CB-CB 3.65Å; C53-C120 WeakPolarHBondContact CB-SG 3.36Å; C53-C120 WeakPolarHBondContact SG-CB 3.5Å; C53-C120 CovalentContact SG-SG 2.04Å; C53-C120 PolarHBondContact SG-SG 2.87Å
54	A	95.4	Very high	92.7	Very high	9 Å²	9	46.1 Å²	46.1	7%	0.074	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-21.5	-171.3	0	0	0	0	0	114.2	D37 K52 F56 Y57 G58 Y59 V131 M133	D37-A54 HydrophobicContact CB-CB 4.03Å; K52-A54 PolarHBondContact O-N 3.21Å; K52-A54 VanDerWaalsContact O-N 3.14Å; A54-F56 VanDerWaalsContact C-N 3.28Å; A54-F56 PolarHBondContact O-N 3.04Å; A54-Y57 PolarHBondContact O-N 2.68Å; A54-G58 PolarHBondContact O-N 2.91Å; A54-Y59 HydrophobicContact CB-CE2 4.25Å; A54-V131 HydrophobicContact CB-CG1 4Å; A54-M133 HydrophobicContact CB-CG 4.09Å; A54-M133 HydrophobicContact CB-SD 3.61Å; A54-M133 PolarHBondContact N-SD 3.09Å; A54-M133 VanDerWaalsContact N-SD 3.43Å
55	L	94.4	Very high	92.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.249	C	C	.	.	I	π-helix	trans	-47.3	-50.1	174.4	-59.8	-179.4	0	0	0	112.3	C53 Y57 Y59 I60 L122 M129 V131	C53-L55 PolarHBondContact O-N 2.85Å; L55-Y57 PolarHBondContact O-N 3.11Å; L55-Y59 HydrophobicContact CD2-CD2 4.4Å; L55-Y59 HydrophobicContact CD2-CG 4.39Å; L55-Y59 PolarHBondContact O-N 3.09Å; L55-I60 HydrophobicContact CB-CD1 4.28Å; L55-I60 HydrophobicContact CB-CG1 4.18Å; L55-I60 WeakPolarHBondContact O-CG1 3.44Å; L55-I60 PolarHBondContact O-N 3.28Å; L55-L122 HydrophobicContact CD1-CB 3.8Å; L55-M129 HydrophobicContact CD1-CG 3.79Å; L55-M129 HydrophobicContact CD1-SD 4.04Å; L55-M129 HydrophobicContact CD2-CE 3.71Å; L55-M129 HydrophobicContact CD2-CG 4.26Å; L55-M129 HydrophobicContact CD2-SD 4.23Å; L55-V131 HydrophobicContact CD2-CB 3.79Å; L55-V131 HydrophobicContact CD2-CG1 3.45Å; L55-V131 VanDerWaalsContact CD2-CG1 3.45Å; L55-V131 HydrophobicContact CG-CG1 3.7Å
56	F	94.1	Very high	92.4	Very high	23 Å²	23	49.9 Å²	49.9	10%	0.101	25%	0.254	C	S	.	.	I	π-helix	trans	-73.3	-9.4	-175.9	-56.5	-64.8	0	0	0	114.4	C53 A54 I60 S62 Y64 A67 L74 D103 L122	C53-F56 HydrophobicContact CB-CD2 3.95Å; C53-F56 HydrophobicContact CB-CE2 4.03Å; C53-F56 PolarHBondContact O-N 2.78Å; A54-F56 VanDerWaalsContact C-N 3.28Å; A54-F56 PolarHBondContact O-N 3.04Å; F56-I60 HydrophobicContact CD1-CD1 3.63Å; F56-I60 HydrophobicContact CD1-CG1 4.32Å; F56-I60 HydrophobicContact CE1-CD1 3.7Å; F56-S62 WeakPolarHBondContact CD1-O 3.19Å; F56-Y64 HydrophobicContact CE2-CD2 4.04Å; F56-Y64 AromaticContact CZ-CD2 3.89Å; F56-Y64 HydrophobicContact CZ-CD2 3.89Å; F56-A67 HydrophobicContact CE1-CB 3.91Å; F56-L74 HydrophobicContact CE2-CD1 4.17Å; F56-L74 HydrophobicContact CE2-CD2 4.07Å; F56-L74 HydrophobicContact CZ-CD1 4.39Å; F56-D103 HydrophobicContact CD2-CB 3.94Å; F56-D103 HydrophobicContact CE2-CB 4.03Å; F56-L122 HydrophobicContact CE1-CD2 4.03Å; F56-L122 HydrophobicContact CZ-CD1 4.12Å; F56-L122 HydrophobicContact CZ-CD2 4.18Å
57	Y	89.6	Confident	92.3	Very high	138 Å²	138	48.2 Å²	48.2	54%	0.541	24%	0.237	S	C	.	.	I	π-helix	trans	-117	0.9	-173.7	-62.8	-81	0	0	0	113.9	K52 A54 L55 D103	K52-Y57 HydrophobicContact CB-CD2 4.21Å; K52-Y57 HydrophobicContact CB-CE2 3.72Å; K52-Y57 HydrophobicContact CD-CE2 4.1Å; K52-Y57 HydrophobicContact CG-CE2 4.09Å; A54-Y57 PolarHBondContact O-N 2.68Å; L55-Y57 PolarHBondContact O-N 3.11Å; Y57-D103 WeakPolarHBondContact CE2-OD2 3.36Å; Y57-D103 PolarHBondContact OH-OD2 2.94Å
58	G	86.9	Confident	92.1	Very high	63 Å²	63	53.3 Å²	53.3	65%	0.649	26%	0.261	S	S	*	.	I	π-helix	trans	-160.5	-33.7	176.8	0	0	0	0	0	115.9	A54	A54-G58 PolarHBondContact O-N 2.91Å
59	Y	89.7	Confident	91.9	Very high	67 Å²	67	58.4 Å²	58.4	26%	0.263	30%	0.296	S	S	.	.	I	π-helix	trans	-97.1	-27.1	-169.8	-59.3	-96.2	0	0	0	114.3	W34 D37 A54 L55 V131	W34-Y59 HydrophobicContact CB-CD1 4.17Å; W34-Y59 HydrophobicContact CB-CE1 3.71Å; W34-Y59 AromaticContact CD2-CD1 3.42Å; W34-Y59 HydrophobicContact CD2-CD1 3.42Å; W34-Y59 VanDerWaalsContact CD2-CD1 3.42Å; W34-Y59 AromaticContact CD2-CE1 3.61Å; W34-Y59 HydrophobicContact CD2-CE1 3.61Å; W34-Y59 AromaticContact CE2-CD1 3.79Å; W34-Y59 AromaticContact CE3-CD1 3.69Å; W34-Y59 HydrophobicContact CE3-CD1 3.69Å; W34-Y59 AromaticContact CE3-CE1 3.6Å; W34-Y59 HydrophobicContact CE3-CE1 3.6Å; W34-Y59 AromaticContact CG-CD1 3.65Å; W34-Y59 HydrophobicContact CG-CD1 3.65Å; W34-Y59 AromaticContact CG-CE1 3.68Å; W34-Y59 HydrophobicContact CG-CE1 3.68Å; W34-Y59 HydrophobicContact CZ2-CD1 4.33Å; W34-Y59 HydrophobicContact CZ3-CD1 4.24Å; W34-Y59 HydrophobicContact CZ3-CE1 4.39Å; D37-Y59 PolarHBondContact OD1-OH 2.9Å; A54-Y59 HydrophobicContact CB-CE2 4.25Å; L55-Y59 HydrophobicContact CD2-CD2 4.4Å; L55-Y59 HydrophobicContact CD2-CG 4.39Å; L55-Y59 PolarHBondContact O-N 3.09Å; Y59-V131 HydrophobicContact CE2-CG2 3.97Å
60	I	90.2	Very high	91.6	Very high	33 Å²	33	60.7 Å²	60.7	17%	0.169	32%	0.321	C	S	.	.			trans	-130.6	152.3	175.7	45	166.6	0	0	0	112	L55 F56 L122 M129	L55-I60 HydrophobicContact CB-CD1 4.28Å; L55-I60 HydrophobicContact CB-CG1 4.18Å; L55-I60 WeakPolarHBondContact O-CG1 3.44Å; L55-I60 PolarHBondContact O-N 3.28Å; F56-I60 HydrophobicContact CD1-CD1 3.63Å; F56-I60 HydrophobicContact CD1-CG1 4.32Å; F56-I60 HydrophobicContact CE1-CD1 3.7Å; I60-L122 HydrophobicContact CD1-CD2 3.58Å; I60-M129 HydrophobicContact CD1-SD 4.19Å; I60-M129 HydrophobicContact CG1-SD 4.48Å; I60-M129 HydrophobicContact CG2-CE 3.66Å; I60-M129 HydrophobicContact CG2-SD 3.78Å
61	R	88.3	Confident	91.4	Very high	258 Å²	258	61 Å²	61	97%	0.974	34%	0.336	S	S	*	.	S	Bend	trans	-89.3	-15	-178.1	-66.9	-177.3	177.1	179.5	-1.5	114.4
62	S	88	Confident	91.2	Very high	38 Å²	38	62.7 Å²	62.7	27%	0.266	35%	0.345	S	S	.	.	S	Bend	trans	-84.5	137.7	176.3	53.2	0	0	0	0	110.2	F56	F56-S62 WeakPolarHBondContact CD1-O 3.19Å
63	N	91.3	Very high	91.1	Very high	70 Å²	70	63.6 Å²	63.6	37%	0.374	36%	0.356	S	S	.	.			trans	-76.4	174.7	170.4	76.3	-6	0	0	0	111.7	S65 Q66 A67	N63-S65 PolarHBondContact ND2-OG 3.49Å; N63-S65 PolarHBondContact O-N 3.35Å; N63-S65 PolarHBondContact OD1-N 3.47Å; N63-S65 PolarHBondContact OD1-OG 3.19Å; N63-Q66 PolarHBondContact O-N 3.19Å; N63-Q66 VanDerWaalsContact OD1-CB 3.22Å; N63-Q66 WeakPolarHBondContact OD1-CB 3.19Å; N63-Q66 WeakPolarHBondContact OD1-CG 3.45Å; N63-Q66 PolarHBondContact OD1-N 2.82Å; N63-A67 PolarHBondContact O-N 2.9Å
64	Y	91.5	Very high	91	Very high	49 Å²	49	64.1 Å²	64.1	19%	0.192	36%	0.359	C	S	.	.	H	α-helix	trans	-56.4	-47.9	-179.5	172.3	-106.1	0	0	0	113.9	F56 Q66 A67 Q68 L74 E102 D103	F56-Y64 HydrophobicContact CE2-CD2 4.04Å; F56-Y64 AromaticContact CZ-CD2 3.89Å; F56-Y64 HydrophobicContact CZ-CD2 3.89Å; Y64-Q66 PolarHBondContact O-N 3.25Å; Y64-A67 PolarHBondContact O-N 2.92Å; Y64-Q68 WeakPolarHBondContact O-CB 3.45Å; Y64-Q68 PolarHBondContact O-N 2.94Å; Y64-L74 HydrophobicContact CD2-CD2 3.93Å; Y64-L74 HydrophobicContact CE2-CB 4Å; Y64-L74 HydrophobicContact CE2-CD2 3.75Å; Y64-E102 HydrophobicContact CD1-CB 4.05Å; Y64-E102 HydrophobicContact CE1-CB 4.11Å; Y64-E102 WeakPolarHBondContact CE2-O 3.37Å; Y64-E102 PolarHBondContact OH-O 2.92Å; Y64-D103 HydrophobicContact CD1-CB 4.47Å; Y64-D103 HydrophobicContact CD2-CB 4Å; Y64-D103 HydrophobicContact CG-CB 3.8Å
65	S	91.8	Very high	90.9	Very high	71 Å²	71	66.5 Å²	66.5	50%	0.497	37%	0.369	S	S	.	.	H	α-helix	trans	-67.8	-34.8	-178.3	53.6	0	0	0	0	112.9	N63 S69	N63-S65 PolarHBondContact ND2-OG 3.49Å; N63-S65 PolarHBondContact O-N 3.35Å; N63-S65 PolarHBondContact OD1-N 3.47Å; N63-S65 PolarHBondContact OD1-OG 3.19Å; S65-S69 WeakPolarHBondContact O-CB 3.32Å; S65-S69 PolarHBondContact O-N 3.45Å; S65-S69 PolarHBondContact O-OG 3.37Å
66	Q	92.1	Very high	90.9	Very high	106 Å²	106	67 Å²	67	50%	0.495	37%	0.37	S	S	.	.	H	α-helix	trans	-63.7	-48.8	169.8	-71.5	162.2	12.9	0	0	111.2	N63 Y64 Q68 S69 G70	N63-Q66 PolarHBondContact O-N 3.19Å; N63-Q66 VanDerWaalsContact OD1-CB 3.22Å; N63-Q66 WeakPolarHBondContact OD1-CB 3.19Å; N63-Q66 WeakPolarHBondContact OD1-CG 3.45Å; N63-Q66 PolarHBondContact OD1-N 2.82Å; Y64-Q66 PolarHBondContact O-N 3.25Å; Q66-Q68 VanDerWaalsContact C-N 3.33Å; Q66-Q68 PolarHBondContact O-N 3.45Å; Q66-S69 WeakPolarHBondContact CA-OG 3.5Å; Q66-S69 PolarHBondContact O-N 3.11Å; Q66-S69 PolarHBondContact O-OG 3.28Å; Q66-G70 PolarHBondContact O-N 3.03Å
67	A	90.3	Very high	90.8	Very high	3 Å²	3	68.7 Å²	68.7	3%	0.025	38%	0.377	C	S	.	.	H	α-helix	trans	-58.9	-43.9	178.2	0	0	0	0	0	112.1	F56 N63 Y64 G70 G71 L72 L122	F56-A67 HydrophobicContact CE1-CB 3.91Å; N63-A67 PolarHBondContact O-N 2.9Å; Y64-A67 PolarHBondContact O-N 2.92Å; A67-G70 CarbonylContact O-C 3.53Å; A67-G70 WeakPolarHBondContact O-CA 3.35Å; A67-G70 PolarHBondContact O-N 2.79Å; A67-G70 VanDerWaalsContact O-N 3.14Å; A67-G71 PolarHBondContact O-N 2.95Å; A67-L72 HydrophobicContact CB-CB 4.32Å; A67-L72 HydrophobicContact CB-CD1 4.01Å; A67-L72 WeakPolarHBondContact O-CB 3.49Å; A67-L72 PolarHBondContact O-N 2.92Å; A67-L122 HydrophobicContact CB-CD1 4.41Å; A67-L122 HydrophobicContact CB-CD2 4.28Å
68	Q	90.3	Very high	90.9	Very high	111 Å²	111	65.6 Å²	65.6	52%	0.519	36%	0.364	S	S	.	.	H	α-helix	trans	-61.7	-43.7	175.7	-167.5	179.1	18.2	0	0	111.8	Y64 Q66 G70 G71	Y64-Q68 WeakPolarHBondContact O-CB 3.45Å; Y64-Q68 PolarHBondContact O-N 2.94Å; Q66-Q68 VanDerWaalsContact C-N 3.33Å; Q66-Q68 PolarHBondContact O-N 3.45Å; Q68-G70 VanDerWaalsContact C-N 3.25Å; Q68-G70 PolarHBondContact O-N 2.89Å; Q68-G71 PolarHBondContact O-N 3.25Å
69	S	91.3	Very high	91	Very high	106 Å²	106	63.3 Å²	63.3	74%	0.741	34%	0.338	S	S	*	.	H	α-helix	trans	-64.1	-28.3	174.4	75.1	0	0	0	0	113.3	S65 Q66 G71	S65-S69 WeakPolarHBondContact O-CB 3.32Å; S65-S69 PolarHBondContact O-N 3.45Å; S65-S69 PolarHBondContact O-OG 3.37Å; Q66-S69 WeakPolarHBondContact CA-OG 3.5Å; Q66-S69 PolarHBondContact O-N 3.11Å; Q66-S69 PolarHBondContact O-OG 3.28Å; S69-G71 PolarHBondContact O-N 3.19Å
70	G	88.2	Confident	90.5	Very high	52 Å²	52	63.9 Å²	63.9	54%	0.536	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	6.6	171.6	0	0	0	0	0	115	Q66 A67 Q68 L72	Q66-G70 PolarHBondContact O-N 3.03Å; A67-G70 CarbonylContact O-C 3.53Å; A67-G70 WeakPolarHBondContact O-CA 3.35Å; A67-G70 PolarHBondContact O-N 2.79Å; A67-G70 VanDerWaalsContact O-N 3.14Å; Q68-G70 VanDerWaalsContact C-N 3.25Å; Q68-G70 PolarHBondContact O-N 2.89Å; G70-L72 VanDerWaalsContact C-N 3.35Å
71	G	90.3	Very high	89.4	Confident	45 Å²	45	64.1 Å²	64.1	46%	0.464	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	17.8	179.7	0	0	0	0	0	114.7	A67 Q68 S69 N124	A67-G71 PolarHBondContact O-N 2.95Å; Q68-G71 PolarHBondContact O-N 3.25Å; S69-G71 PolarHBondContact O-N 3.19Å; G71-N124 VanDerWaalsContact O-CG 3.31Å; G71-N124 PolarHBondContact O-ND2 3.18Å
72	L	91.8	Very high	87.8	Confident	36 Å²	36	59.6 Å²	59.6	19%	0.188	35%	0.352	C	S	.	.			trans	-85.1	130.1	172.2	-67.2	154.1	0	0	0	110.2	A67 G70 L122 N124 Y127	A67-L72 HydrophobicContact CB-CB 4.32Å; A67-L72 HydrophobicContact CB-CD1 4.01Å; A67-L72 WeakPolarHBondContact O-CB 3.49Å; A67-L72 PolarHBondContact O-N 2.92Å; G70-L72 VanDerWaalsContact C-N 3.35Å; L72-L122 HydrophobicContact CB-CD1 3.72Å; L72-L122 HydrophobicContact CB-CG 3.98Å; L72-L122 HydrophobicContact CD1-CD2 4.26Å; L72-L122 HydrophobicContact CD1-CG 4.45Å; L72-L122 HydrophobicContact CD2-CG 4.31Å; L72-L122 HydrophobicContact CG-CG 4.49Å; L72-N124 HydrophobicContact CD2-CB 3.82Å; L72-N124 HydrophobicContact CG-CB 4.49Å; L72-Y127 HydrophobicContact CD2-CD1 3.51Å; L72-Y127 HydrophobicContact CD2-CE1 4.19Å; L72-Y127 HydrophobicContact CD2-CG 4.21Å
73	S	91.9	Very high	86	Confident	57 Å²	57	60.1 Å²	60.1	40%	0.399	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	129.8	174.7	62.3	0	0	0	0	110.7	L122 R123	S73-L122 WeakPolarHBondContact O-CA 3.33Å; S73-R123 PolarHBondContact N-O 3.06Å; S73-R123 PolarHBondContact O-N 3.29Å; S73-R123 PolarHBondContact OG-O 3.44Å
74	L	93.8	Very high	83.8	Confident	12 Å²	12	66.7 Å²	66.7	6%	0.063	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	116	173	-177.5	69.6	0	0	0	109.9	F56 Y64 K100 C120 V121 L122	F56-L74 HydrophobicContact CE2-CD1 4.17Å; F56-L74 HydrophobicContact CE2-CD2 4.07Å; F56-L74 HydrophobicContact CZ-CD1 4.39Å; Y64-L74 HydrophobicContact CD2-CD2 3.93Å; Y64-L74 HydrophobicContact CE2-CB 4Å; Y64-L74 HydrophobicContact CE2-CD2 3.75Å; L74-K100 PolarHBondContact O-NZ 3.18Å; L74-C120 HydrophobicContact CD1-CB 4.15Å; L74-V121 WeakPolarHBondContact CA-O 3.42Å; L74-L122 HydrophobicContact CB-CD1 4.22Å; L74-L122 HydrophobicContact CD1-CD1 4.33Å
75	M	92.8	Very high	81.7	Confident	58 Å²	58	69.7 Å²	69.7	29%	0.286	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	161.1	174.5	-65.2	167.8	-72.1	0	0	110.2	Y77 V121 R123	M75-Y77 HydrophobicContact CB-CE2 3.8Å; M75-V121 HydrophobicContact CB-CB 4.41Å; M75-V121 HydrophobicContact CE-CG1 4.22Å; M75-V121 PolarHBondContact N-O 2.98Å; M75-V121 PolarHBondContact O-N 2.71Å; M75-R123 HydrophobicContact CE-CB 3.61Å; M75-R123 HydrophobicContact CE-CG 4.39Å
76	W	94.6	Very high	80.3	Confident	10 Å²	10	68.7 Å²	68.7	4%	0.038	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	134.7	-178.2	-76.6	97.3	0	0	0	110.6	C53 I91 F93 D103 I105 S119 C120 M133	C53-W76 HydrophobicContact CB-CH2 4.1Å; C53-W76 HydrophobicContact CB-CZ2 3.78Å; W76-I91 HydrophobicContact CB-CD1 4.16Å; W76-I91 PolarHBondContact O-N 2.78Å; W76-I91 VanDerWaalsContact O-N 3.16Å; W76-F93 HydrophobicContact CB-CZ 4.05Å; W76-F93 HydrophobicContact CG-CZ 4.41Å; W76-D103 WeakPolarHBondContact CZ2-O 3.49Å; W76-I105 HydrophobicContact CB-CD1 4.09Å; W76-I105 HydrophobicContact CD2-CD1 3.53Å; W76-I105 HydrophobicContact CD2-CG1 3.77Å; W76-I105 HydrophobicContact CE3-CD1 3.46Å; W76-I105 VanDerWaalsContact CE3-CD1 3.46Å; W76-I105 HydrophobicContact CE3-CG1 4.03Å; W76-I105 HydrophobicContact CG-CD1 3.86Å; W76-I105 HydrophobicContact CG-CG1 4.15Å; W76-I105 HydrophobicContact CH2-CD1 4.39Å; W76-I105 HydrophobicContact CH2-CG1 4.21Å; W76-I105 HydrophobicContact CZ2-CD1 4.5Å; W76-I105 HydrophobicContact CZ2-CG1 4.01Å; W76-I105 HydrophobicContact CZ3-CD1 3.9Å; W76-I105 HydrophobicContact CZ3-CG1 4.23Å; W76-S119 WeakPolarHBondContact CA-O 3.41Å; W76-C120 HydrophobicContact CD2-CB 3.84Å; W76-C120 HydrophobicContact CE3-CB 3.76Å; W76-C120 HydrophobicContact CH2-CB 3.95Å; W76-C120 HydrophobicContact CZ2-CB 3.97Å; W76-C120 HydrophobicContact CZ3-CB 3.83Å; W76-M133 HydrophobicContact CE3-CE 4.38Å; W76-M133 HydrophobicContact CH2-CE 3.38Å; W76-M133 HydrophobicContact CZ3-CE 3.26Å
77	Y	92.3	Very high	79.2	Confident	59 Å²	59	72.1 Å²	72.1	23%	0.231	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	156.7	179.5	-58.8	-103.3	0	0	0	109.8	M75 E88 E89 P90 Y118 S119 V121	M75-Y77 HydrophobicContact CB-CE2 3.8Å; Y77-E88 HydrophobicContact CD1-CB 4.41Å; Y77-E88 HydrophobicContact CG-CB 4.49Å; Y77-E89 CarbonylContact C-O 3.42Å; Y77-E89 WeakPolarHBondContact CA-O 3.24Å; Y77-E89 WeakPolarHBondContact CB-O 3.32Å; Y77-P90 HydrophobicContact CD1-CB 4.08Å; Y77-P90 HydrophobicContact CE1-CB 3.99Å; Y77-Y118 CarbonylContact O-C 3.59Å; Y77-Y118 WeakPolarHBondContact O-CA 3.49Å; Y77-S119 PolarHBondContact N-O 2.85Å; Y77-S119 PolarHBondContact O-N 3.43Å; Y77-V121 HydrophobicContact CD2-CB 4.36Å; Y77-V121 HydrophobicContact CD2-CG2 3.52Å; Y77-V121 HydrophobicContact CE2-CB 4.06Å; Y77-V121 HydrophobicContact CE2-CG2 3.6Å
78	R	91.8	Very high	78.8	Confident	73 Å²	73	75.5 Å²	75.5	28%	0.275	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	145.8	175.5	-175.4	177.8	174.8	-173.1	-2.8	110.7	E88 E89 I91 Q113 V115 L117 Y118	R78-E88 WeakPolarHBondContact O-CA 3.29Å; R78-E89 PolarHBondContact N-O 3.21Å; R78-E89 PolarHBondContact O-N 3.25Å; R78-I91 HydrophobicContact CB-CD1 4.12Å; R78-I91 HydrophobicContact CB-CG1 3.98Å; R78-Q113 PolarHBondContact NH1-O 2.81Å; R78-Q113 PolarHBondContact NH2-O 2.83Å; R78-V115 PolarHBondContact NH2-O 3.45Å; R78-L117 CarbonylContact C-O 3.51Å; R78-L117 WeakPolarHBondContact CA-O 3.46Å; R78-Y118 HydrophobicContact CB-CE1 4.46Å; R78-Y118 HydrophobicContact CG-CE1 4.26Å; R78-Y118 PolarHBondContact NE-OH 2.91Å
79	S	89.2	Confident	78.6	Confident	15 Å²	15	76.9 Å²	76.9	11%	0.105	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148.3	167.1	172	0	0	0	0	109.4	G81 D86 L117	S79-G81 VanDerWaalsContact C-N 3.25Å; S79-G81 PolarHBondContact O-N 3.23Å; S79-G81 PolarHBondContact OG-N 3.16Å; S79-D86 VanDerWaalsContact OG-CB 3.31Å; S79-D86 WeakPolarHBondContact OG-CB 3.37Å; S79-L117 PolarHBondContact N-O 2.78Å; S79-L117 PolarHBondContact O-N 3.07Å
80	S	78.5	Confident	78.5	Confident	80 Å²	80	76.5 Å²	76.5	56%	0.559	43%	0.434	S	S	*	.			trans	-75.2	-14	179	-56.7	0	0	0	0	113.1	D86	S80-D86 WeakPolarHBondContact CB-OD2 3.41Å
81	G	67.1	Low	78.6	Confident	37 Å²	37	75.3 Å²	75.3	38%	0.381	42%	0.416	S	S	.	.			trans	77.3	17.9	174	0	0	0	0	0	115.1	S79 G83 D86	S79-G81 VanDerWaalsContact C-N 3.25Å; S79-G81 PolarHBondContact O-N 3.23Å; S79-G81 PolarHBondContact OG-N 3.16Å; G81-G83 VanDerWaalsContact C-N 3.34Å; G81-G83 PolarHBondContact O-N 3.4Å; G81-D86 PolarHBondContact N-OD2 2.88Å
82	H	55.4	Low	78.5	Confident	163 Å²	163	78.7 Å²	78.7	76%	0.755	43%	0.432	S	S	*	.	S	Bend	trans	-97.3	47.6	178.6	-76.7	16.9	0	0	0	112.6	D86	H82-D86 PolarHBondContact N-OD2 3.39Å
83	G	49.5	Very low	78.5	Confident	50 Å²	50	80.1 Å²	80.1	52%	0.515	44%	0.437	S	S	.	.	S	Bend	trans	92.5	-169.7	168.2	0	0	0	0	0	115.3	G81 T85 D86	G81-G83 VanDerWaalsContact C-N 3.34Å; G81-G83 PolarHBondContact O-N 3.4Å; G83-T85 PolarHBondContact O-N 3.26Å; G83-D86 PolarHBondContact O-N 2.95Å
84	H	46.4	Very low	78.2	Confident	207 Å²	207	81.8 Å²	81.8	96%	0.958	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	9.9	-169	-59.2	-61.6	0	0	0	115.6
85	T	47.1	Very low	77.8	Confident	112 Å²	112	83.9 Å²	83.9	69%	0.687	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-9.7	179.8	42.6	0	0	0	0	113.9	G83 F87	G83-T85 PolarHBondContact O-N 3.26Å; T85-F87 PolarHBondContact O-N 3.26Å
86	D	61.3	Low	77.5	Confident	50 Å²	50	87 Å²	87	27%	0.267	49%	0.488	S	S	.	.			trans	-79	118.8	179.1	-71.6	2	0	0	0	110.8	S79 S80 G81 H82 G83	S79-D86 VanDerWaalsContact OG-CB 3.31Å; S79-D86 WeakPolarHBondContact OG-CB 3.37Å; S80-D86 WeakPolarHBondContact CB-OD2 3.41Å; G81-D86 PolarHBondContact N-OD2 2.88Å; H82-D86 PolarHBondContact N-OD2 3.39Å; G83-D86 PolarHBondContact O-N 2.95Å
87	F	70.3	Confident	77.4	Confident	179 Å²	179	89.7 Å²	89.7	79%	0.785	50%	0.498	S	S	*	.			trans	-73.8	143.7	173.6	-68	-88.8	0	0	0	111.2	T85 E89	T85-F87 PolarHBondContact O-N 3.26Å; F87-E89 PolarHBondContact O-N 3.37Å
88	E	81.2	Confident	77.4	Confident	74 Å²	74	87.8 Å²	87.8	35%	0.346	49%	0.491	S	S	.	.			trans	-81	106.1	173.9	-71.5	-175.8	127.4	0	0	110.5	Y77 R78 S119 K130	Y77-E88 HydrophobicContact CD1-CB 4.41Å; Y77-E88 HydrophobicContact CG-CB 4.49Å; R78-E88 WeakPolarHBondContact O-CA 3.29Å; E88-S119 WeakPolarHBondContact OE1-CB 3.47Å; E88-S119 PolarHBondContact OE1-OG 3.18Å; E88-K130 IonicContact OE1-NZ 3.32Å; E88-K130 PolarHBondContact OE1-NZ 3.33Å; E88-K130 IonicContact OE2-NZ 2.7Å; E88-K130 PolarHBondContact OE2-NZ 3.27Å
89	E	86.1	Confident	77.6	Confident	140 Å²	140	84.8 Å²	84.8	65%	0.654	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	138.3	179	-64.8	-165	159	0	0	111.7	Y77 R78 F87	Y77-E89 CarbonylContact C-O 3.42Å; Y77-E89 WeakPolarHBondContact CA-O 3.24Å; Y77-E89 WeakPolarHBondContact CB-O 3.32Å; R78-E89 PolarHBondContact N-O 3.21Å; R78-E89 PolarHBondContact O-N 3.25Å; F87-E89 PolarHBondContact O-N 3.37Å
90	P	89.8	Confident	77.8	Confident	97 Å²	97	88.1 Å²	88.1	63%	0.63	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	133	178.4	29.5	-34.2	0	0	0	111	Y77 S92	Y77-P90 HydrophobicContact CD1-CB 4.08Å; Y77-P90 HydrophobicContact CE1-CB 3.99Å; P90-S92 PolarHBondContact O-N 2.75Å
91	I	90.4	Very high	78.4	Confident	28 Å²	28	87.5 Å²	87.5	14%	0.144	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-75	126.4	-174.7	-60.1	179.6	0	0	0	111.1	W76 R78 F93 M98 I105 Y118	W76-I91 HydrophobicContact CB-CD1 4.16Å; W76-I91 PolarHBondContact O-N 2.78Å; W76-I91 VanDerWaalsContact O-N 3.16Å; R78-I91 HydrophobicContact CB-CD1 4.12Å; R78-I91 HydrophobicContact CB-CG1 3.98Å; I91-F93 HydrophobicContact CB-CE1 4.36Å; I91-F93 HydrophobicContact CB-CE2 4.07Å; I91-F93 HydrophobicContact CB-CZ 3.85Å; I91-F93 HydrophobicContact CG2-CD1 4Å; I91-F93 HydrophobicContact CG2-CD2 4.36Å; I91-F93 HydrophobicContact CG2-CE1 3.59Å; I91-F93 HydrophobicContact CG2-CE2 3.99Å; I91-F93 HydrophobicContact CG2-CG 4.36Å; I91-F93 HydrophobicContact CG2-CZ 3.59Å; I91-M98 HydrophobicContact CG2-SD 3.61Å; I91-I105 HydrophobicContact CD1-CD1 3.71Å; I91-Y118 HydrophobicContact CD1-CD1 3.49Å; I91-Y118 VanDerWaalsContact CD1-CD1 3.49Å; I91-Y118 HydrophobicContact CD1-CE1 3.69Å
92	S	87.4	Confident	79.6	Confident	115 Å²	115	92.1 Å²	92.1	80%	0.804	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-88.9	117.6	166.8	-163	0	0	0	0	109.5	P90	P90-S92 PolarHBondContact O-N 2.75Å
93	F	91.1	Very high	81.4	Confident	66 Å²	66	84.7 Å²	84.7	29%	0.289	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-92.2	124.8	-179.7	-62.9	-78.1	0	0	0	110.1	W76 I91 M98 K100 I105	W76-F93 HydrophobicContact CB-CZ 4.05Å; W76-F93 HydrophobicContact CG-CZ 4.41Å; I91-F93 HydrophobicContact CB-CE1 4.36Å; I91-F93 HydrophobicContact CB-CE2 4.07Å; I91-F93 HydrophobicContact CB-CZ 3.85Å; I91-F93 HydrophobicContact CG2-CD1 4Å; I91-F93 HydrophobicContact CG2-CD2 4.36Å; I91-F93 HydrophobicContact CG2-CE1 3.59Å; I91-F93 HydrophobicContact CG2-CE2 3.99Å; I91-F93 HydrophobicContact CG2-CG 4.36Å; I91-F93 HydrophobicContact CG2-CZ 3.59Å; F93-M98 HydrophobicContact CD1-CG 4.1Å; F93-M98 HydrophobicContact CD1-SD 4.33Å; F93-M98 HydrophobicContact CE1-CG 4.38Å; F93-M98 HydrophobicContact CE1-SD 4.34Å; F93-K100 HydrophobicContact CD1-CB 3.97Å; F93-K100 HydrophobicContact CD2-CB 4.11Å; F93-K100 HydrophobicContact CE1-CB 3.91Å; F93-K100 HydrophobicContact CE2-CB 4.04Å; F93-K100 HydrophobicContact CE2-CD 4.24Å; F93-K100 HydrophobicContact CG-CB 4.08Å; F93-K100 HydrophobicContact CZ-CB 3.94Å; F93-K100 HydrophobicContact CZ-CD 4.48Å; F93-K100 HydrophobicContact CZ-CG 4.43Å; F93-I105 HydrophobicContact CE1-CB 4.43Å; F93-I105 HydrophobicContact CE1-CD1 3.81Å; F93-I105 HydrophobicContact CE1-CG1 3.76Å; F93-I105 HydrophobicContact CE1-CG2 3.93Å; F93-I105 HydrophobicContact CZ-CD1 3.91Å; F93-I105 HydrophobicContact CZ-CG1 4.04Å
94	D	86.8	Confident	83.6	Confident	92 Å²	92	82.3 Å²	82.3	49%	0.492	44%	0.435	S	S	.	.			trans	-79.3	-19.5	176.6	64.3	29.5	0	0	0	112.9	V96 R97 M98	D94-V96 PolarHBondContact O-N 3.15Å; D94-V96 PolarHBondContact OD1-N 3.08Å; D94-R97 PolarHBondContact OD1-N 3.05Å; D94-M98 PolarHBondContact N-O 3.32Å; D94-M98 PolarHBondContact OD1-N 3.02Å
95	G	84.6	Confident	85.9	Confident	56 Å²	56	72.4 Å²	72.4	58%	0.577	39%	0.39	S	S	*	.	S	Bend	trans	73	6.4	-179.3	0	0	0	0	0	115	M98	G95-M98 PolarHBondContact N-O 2.73Å
96	V	86.1	Confident	88.2	Confident	123 Å²	123	67.8 Å²	67.8	75%	0.745	36%	0.359	S	S	*	.	S	Bend	trans	-120.5	-55.8	-178.1	-179.1	0	0	0	0	110.8	D94	D94-V96 PolarHBondContact O-N 3.15Å; D94-V96 PolarHBondContact OD1-N 3.08Å
97	R	92.1	Very high	89.8	Confident	68 Å²	68	65.4 Å²	65.4	26%	0.257	35%	0.347	S	S	.	.	S	Bend	trans	-101.1	-40.8	177.2	-167.6	-166.2	74.3	87.2	-8.5	111.1	D94 F107 R108 P109 D114	D94-R97 PolarHBondContact OD1-N 3.05Å; R97-F107 CarbonylContact O-C 3.54Å; R97-F107 VanDerWaalsContact O-CA 3.32Å; R97-F107 WeakPolarHBondContact O-CA 3.09Å; R97-R108 PolarHBondContact O-N 3.39Å; R97-P109 WeakPolarHBondContact CG-O 2.89Å; R97-P109 PolarHBondContact NH1-O 3.45Å; R97-D114 IonicContact CZ-OD1 3.36Å; R97-D114 IonicContact CZ-OD2 3.41Å; R97-D114 IonicContact NH1-OD1 2.68Å; R97-D114 IonicContact NH1-OD2 3.77Å; R97-D114 PolarHBondContact NH1-OD2 2.98Å; R97-D114 IonicContact NH2-OD1 3.46Å; R97-D114 PolarHBondContact NH2-OD1 2.82Å; R97-D114 IonicContact NH2-OD2 2.8Å; R97-D114 PolarHBondContact NH2-OD2 2.92Å
98	M	93.8	Very high	91	Very high	19 Å²	19	59.9 Å²	59.9	9%	0.094	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	101.3	176	-161.5	-171.1	-54.3	0	0	110.3	I91 F93 D94 G95 I105 W106 F107	I91-M98 HydrophobicContact CG2-SD 3.61Å; F93-M98 HydrophobicContact CD1-CG 4.1Å; F93-M98 HydrophobicContact CD1-SD 4.33Å; F93-M98 HydrophobicContact CE1-CG 4.38Å; F93-M98 HydrophobicContact CE1-SD 4.34Å; D94-M98 PolarHBondContact N-O 3.32Å; D94-M98 PolarHBondContact OD1-N 3.02Å; G95-M98 PolarHBondContact N-O 2.73Å; M98-I105 HydrophobicContact CG-CG2 3.72Å; M98-I105 HydrophobicContact SD-CG2 4.33Å; M98-W106 WeakPolarHBondContact CA-O 3.23Å; M98-F107 HydrophobicContact CE-CD1 4.25Å; M98-F107 HydrophobicContact CE-CE1 3.66Å; M98-F107 HydrophobicContact CE-CZ 4.41Å; M98-F107 HydrophobicContact CG-CD1 4.38Å; M98-F107 HydrophobicContact CG-CE1 4.19Å; M98-F107 HydrophobicContact CG-CZ 4.46Å; M98-F107 HydrophobicContact SD-CE1 4.13Å; M98-F107 HydrophobicContact SD-CZ 4.35Å
99	S	94.6	Very high	91.6	Very high	10 Å²	10	58.4 Å²	58.4	7%	0.07	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	142.3	178.8	55.9	0	0	0	0	111.5	E101 I105 W106 R108	S99-E101 WeakPolarHBondContact CB-OE1 3.34Å; S99-E101 PolarHBondContact OG-OE1 3.26Å; S99-I105 WeakPolarHBondContact O-CA 3.49Å; S99-W106 PolarHBondContact N-O 2.89Å; S99-W106 PolarHBondContact O-N 2.95Å; S99-R108 PolarHBondContact OG-NH1 2.97Å
100	K	93.8	Very high	92	Very high	85 Å²	85	51.8 Å²	51.8	37%	0.37	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	117.1	167.1	-177.7	-171.7	175.7	-173.5	0	108.6	L74 F93	L74-K100 PolarHBondContact O-NZ 3.18Å; F93-K100 HydrophobicContact CD1-CB 3.97Å; F93-K100 HydrophobicContact CD2-CB 4.11Å; F93-K100 HydrophobicContact CE1-CB 3.91Å; F93-K100 HydrophobicContact CE2-CB 4.04Å; F93-K100 HydrophobicContact CE2-CD 4.24Å; F93-K100 HydrophobicContact CG-CB 4.08Å; F93-K100 HydrophobicContact CZ-CB 3.94Å; F93-K100 HydrophobicContact CZ-CD 4.48Å; F93-K100 HydrophobicContact CZ-CG 4.43Å
101	E	92.3	Very high	92.2	Very high	66 Å²	66	49.3 Å²	49.3	31%	0.308	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	118.6	-178.9	-71.3	164.3	-146.8	0	0	108.8	S99 D103 A104 W106 R108	S99-E101 WeakPolarHBondContact CB-OE1 3.34Å; S99-E101 PolarHBondContact OG-OE1 3.26Å; E101-D103 PolarHBondContact O-N 2.92Å; E101-A104 PolarHBondContact N-O 2.95Å; E101-A104 PolarHBondContact O-N 3.19Å; E101-W106 VanDerWaalsContact CD-CD1 3.47Å; E101-W106 PolarHBondContact OE2-NE1 3.34Å; E101-W106 VanDerWaalsContact OE2-NE1 3.13Å; E101-R108 IonicContact OE1-CZ 2.81Å; E101-R108 IonicContact OE1-NH1 3.29Å; E101-R108 PolarHBondContact OE1-NH1 2.99Å; E101-R108 IonicContact OE1-NH2 2.98Å; E101-R108 PolarHBondContact OE1-NH2 2.99Å; E101-R108 IonicContact OE2-CZ 3.99Å; E101-R108 IonicContact OE2-NH1 2.69Å; E101-R108 IonicContact OE2-NH2 3.27Å; E101-R108 PolarHBondContact OE2-NH2 3.2Å
102	E	91.6	Very high	92.4	Very high	135 Å²	135	51 Å²	51	63%	0.631	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	-106.3	-174	-55.3	-174.4	131.9	0	0	112.9	R50 Y64	R50-E102 IonicContact NH2-OE2 2.7Å; Y64-E102 HydrophobicContact CD1-CB 4.05Å; Y64-E102 HydrophobicContact CE1-CB 4.11Å; Y64-E102 WeakPolarHBondContact CE2-O 3.37Å; Y64-E102 PolarHBondContact OH-O 2.92Å
103	D	93.6	Very high	92.6	Very high	6 Å²	6	52.9 Å²	52.9	3%	0.032	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	4.1	-173.4	77.2	-39.4	0	0	0	113.4	R50 C53 F56 Y57 Y64 W76 E101	R50-D103 IonicContact NH2-OD1 3.94Å; R50-D103 PolarHBondContact NH2-OD1 2.8Å; R50-D103 VanDerWaalsContact NH2-OD1 3.16Å; C53-D103 WeakPolarHBondContact CB-O 3.36Å; C53-D103 PolarHBondContact N-O 3.42Å; C53-D103 VanDerWaalsContact N-O 3.1Å; F56-D103 HydrophobicContact CD2-CB 3.94Å; F56-D103 HydrophobicContact CE2-CB 4.03Å; Y57-D103 WeakPolarHBondContact CE2-OD2 3.36Å; Y57-D103 PolarHBondContact OH-OD2 2.94Å; Y64-D103 HydrophobicContact CD1-CB 4.47Å; Y64-D103 HydrophobicContact CD2-CB 4Å; Y64-D103 HydrophobicContact CG-CB 3.8Å; W76-D103 WeakPolarHBondContact CZ2-O 3.49Å; E101-D103 PolarHBondContact O-N 2.92Å
104	A	95	Very high	92.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	163.3	-166.4	0	0	0	0	0	113.2	R50 L51 K52 E101	R50-A104 HydrophobicContact CG-CB 3.75Å; L51-A104 CarbonylContact O-C 3.46Å; L51-A104 WeakPolarHBondContact O-CA 3.39Å; L51-A104 VanDerWaalsContact O-CB 3.31Å; L51-A104 WeakPolarHBondContact O-CB 3.34Å; K52-A104 HydrophobicContact CG-CB 4.25Å; E101-A104 PolarHBondContact N-O 2.95Å; E101-A104 PolarHBondContact O-N 3.19Å
105	I	95.4	Very high	93	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.2	162.9	-56.3	176.9	0	0	0	108.2	R50 L51 W76 I91 F93 M98 S99 F107 Y118	R50-I105 CarbonylContact C-O 3.55Å; R50-I105 WeakPolarHBondContact CA-O 3.48Å; L51-I105 PolarHBondContact N-O 3.4Å; L51-I105 PolarHBondContact O-N 3.35Å; W76-I105 HydrophobicContact CB-CD1 4.09Å; W76-I105 HydrophobicContact CD2-CD1 3.53Å; W76-I105 HydrophobicContact CD2-CG1 3.77Å; W76-I105 HydrophobicContact CE3-CD1 3.46Å; W76-I105 VanDerWaalsContact CE3-CD1 3.46Å; W76-I105 HydrophobicContact CE3-CG1 4.03Å; W76-I105 HydrophobicContact CG-CD1 3.86Å; W76-I105 HydrophobicContact CG-CG1 4.15Å; W76-I105 HydrophobicContact CH2-CD1 4.39Å; W76-I105 HydrophobicContact CH2-CG1 4.21Å; W76-I105 HydrophobicContact CZ2-CD1 4.5Å; W76-I105 HydrophobicContact CZ2-CG1 4.01Å; W76-I105 HydrophobicContact CZ3-CD1 3.9Å; W76-I105 HydrophobicContact CZ3-CG1 4.23Å; I91-I105 HydrophobicContact CD1-CD1 3.71Å; F93-I105 HydrophobicContact CE1-CB 4.43Å; F93-I105 HydrophobicContact CE1-CD1 3.81Å; F93-I105 HydrophobicContact CE1-CG1 3.76Å; F93-I105 HydrophobicContact CE1-CG2 3.93Å; F93-I105 HydrophobicContact CZ-CD1 3.91Å; F93-I105 HydrophobicContact CZ-CG1 4.04Å; M98-I105 HydrophobicContact CG-CG2 3.72Å; M98-I105 HydrophobicContact SD-CG2 4.33Å; S99-I105 WeakPolarHBondContact O-CA 3.49Å; I105-F107 HydrophobicContact CB-CE2 4.1Å; I105-F107 HydrophobicContact CG2-CD2 4.06Å; I105-F107 HydrophobicContact CG2-CE2 3.49Å; I105-F107 VanDerWaalsContact CG2-CE2 3.49Å; I105-F107 HydrophobicContact CG2-CZ 3.91Å; I105-Y118 HydrophobicContact CD1-CD1 4Å
106	W	95.1	Very high	93.4	Very high	14 Å²	14	46.3 Å²	46.3	5%	0.053	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	143.6	167	-80.3	95.8	0	0	0	111.5	V49 R50 M98 S99 E101 R108 D171 Y172 F222	V49-W106 WeakPolarHBondContact O-CA 3.05Å; R50-W106 HydrophobicContact CB-CD2 3.76Å; R50-W106 HydrophobicContact CB-CE3 3.89Å; R50-W106 HydrophobicContact CB-CG 4.44Å; R50-W106 HydrophobicContact CB-CH2 4.08Å; R50-W106 HydrophobicContact CB-CZ2 3.96Å; R50-W106 HydrophobicContact CB-CZ3 4.04Å; R50-W106 HydrophobicContact CG-CD2 3.98Å; R50-W106 HydrophobicContact CG-CG 4.32Å; R50-W106 HydrophobicContact CG-CZ2 4.09Å; M98-W106 WeakPolarHBondContact CA-O 3.23Å; S99-W106 PolarHBondContact N-O 2.89Å; S99-W106 PolarHBondContact O-N 2.95Å; E101-W106 VanDerWaalsContact CD-CD1 3.47Å; E101-W106 PolarHBondContact OE2-NE1 3.34Å; E101-W106 VanDerWaalsContact OE2-NE1 3.13Å; W106-R108 HydrophobicContact CB-CG 4.41Å; W106-R108 VanDerWaalsContact CD1-NH2 3.32Å; W106-R108 HydrophobicContact CE3-CG 4.31Å; W106-D171 HydrophobicContact CH2-CB 4.14Å; W106-D171 WeakPolarHBondContact CH2-O 3.05Å; W106-D171 HydrophobicContact CZ2-CB 4.49Å; W106-Y172 HydrophobicContact CH2-CE1 4.45Å; W106-Y172 HydrophobicContact CZ3-CD1 4.44Å; W106-Y172 HydrophobicContact CZ3-CE1 4.06Å; W106-F222 AromaticContact CH2-CE1 3.97Å; W106-F222 HydrophobicContact CH2-CE1 3.97Å; W106-F222 AromaticContact CH2-CZ 3.73Å; W106-F222 HydrophobicContact CH2-CZ 3.73Å; W106-F222 AromaticContact CZ3-CE1 3.77Å; W106-F222 HydrophobicContact CZ3-CE1 3.77Å; W106-F222 HydrophobicContact CZ3-CZ 4.02Å
107	F	95.3	Very high	93.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	123.2	169	-59.5	-107.4	0	0	0	107.6	A48 V49 L51 R97 M98 I105 A110 D114 Y118 L135	A48-F107 VanDerWaalsContact CA-O 3.3Å; A48-F107 WeakPolarHBondContact CA-O 3.25Å; V49-F107 HydrophobicContact CG1-CB 3.91Å; V49-F107 HydrophobicContact CG1-CD2 3.89Å; V49-F107 HydrophobicContact CG1-CG 4.16Å; V49-F107 PolarHBondContact N-O 2.91Å; V49-F107 PolarHBondContact O-N 2.93Å; L51-F107 HydrophobicContact CD1-CD2 4.12Å; L51-F107 HydrophobicContact CD1-CE2 3.86Å; L51-F107 HydrophobicContact CD2-CE2 4.07Å; L51-F107 HydrophobicContact CG-CE2 4.41Å; R97-F107 CarbonylContact O-C 3.54Å; R97-F107 VanDerWaalsContact O-CA 3.32Å; R97-F107 WeakPolarHBondContact O-CA 3.09Å; M98-F107 HydrophobicContact CE-CD1 4.25Å; M98-F107 HydrophobicContact CE-CE1 3.66Å; M98-F107 HydrophobicContact CE-CZ 4.41Å; M98-F107 HydrophobicContact CG-CD1 4.38Å; M98-F107 HydrophobicContact CG-CE1 4.19Å; M98-F107 HydrophobicContact CG-CZ 4.46Å; M98-F107 HydrophobicContact SD-CE1 4.13Å; M98-F107 HydrophobicContact SD-CZ 4.35Å; I105-F107 HydrophobicContact CB-CE2 4.1Å; I105-F107 HydrophobicContact CG2-CD2 4.06Å; I105-F107 HydrophobicContact CG2-CE2 3.49Å; I105-F107 VanDerWaalsContact CG2-CE2 3.49Å; I105-F107 HydrophobicContact CG2-CZ 3.91Å; F107-A110 HydrophobicContact CB-CB 4.08Å; F107-D114 HydrophobicContact CD1-CB 4.04Å; F107-D114 WeakPolarHBondContact CD1-OD2 3.45Å; F107-D114 HydrophobicContact CE1-CB 3.77Å; F107-Y118 HydrophobicContact CE1-CE1 4.31Å; F107-Y118 HydrophobicContact CZ-CD1 4.32Å; F107-Y118 AromaticContact CZ-CE1 3.61Å; F107-Y118 HydrophobicContact CZ-CE1 3.61Å; F107-Y118 HydrophobicContact CZ-CE2 4.42Å; F107-Y118 AromaticContact CZ-CZ 3.68Å; F107-L135 HydrophobicContact CD2-CD2 4.5Å; F107-L135 HydrophobicContact CE1-CD2 4.17Å; F107-L135 HydrophobicContact CE2-CD2 4.1Å; F107-L135 HydrophobicContact CZ-CD2 3.92Å
108	R	94.1	Very high	93.8	Very high	63 Å²	63	39 Å²	39	24%	0.238	19%	0.194	C	C	.	.	S	Bend	trans	-141.1	77.3	-173.6	-60.9	-171.3	-169	119	-7	110.7	A48 R97 S99 E101 W106 F225	A48-R108 HydrophobicContact CB-CG 4.47Å; R97-R108 PolarHBondContact O-N 3.39Å; S99-R108 PolarHBondContact OG-NH1 2.97Å; E101-R108 IonicContact OE1-CZ 2.81Å; E101-R108 IonicContact OE1-NH1 3.29Å; E101-R108 PolarHBondContact OE1-NH1 2.99Å; E101-R108 IonicContact OE1-NH2 2.98Å; E101-R108 PolarHBondContact OE1-NH2 2.99Å; E101-R108 IonicContact OE2-CZ 3.99Å; E101-R108 IonicContact OE2-NH1 2.69Å; E101-R108 IonicContact OE2-NH2 3.27Å; E101-R108 PolarHBondContact OE2-NH2 3.2Å; W106-R108 HydrophobicContact CB-CG 4.41Å; W106-R108 VanDerWaalsContact CD1-NH2 3.32Å; W106-R108 HydrophobicContact CE3-CG 4.31Å; R108-F225 HydrophobicContact CB-CE2 3.91Å; R108-F225 HydrophobicContact CB-CZ 3.91Å
109	P	94.5	Very high	93.9	Very high	43 Å²	43	38.2 Å²	38.2	28%	0.279	19%	0.19	S	C	.	.	S	Bend	cis	-93	173.2	-0.5	37	-33.2	0	0	0	113.3	G46 E47 R97 F225	G46-P109 VanDerWaalsContact C-CB 3.49Å; G46-P109 VanDerWaalsContact O-CB 3.31Å; G46-P109 WeakPolarHBondContact O-CB 3.48Å; E47-P109 CarbonylContact O-C 3.56Å; E47-P109 VanDerWaalsContact O-CA 3.31Å; E47-P109 WeakPolarHBondContact O-CA 3.19Å; E47-P109 WeakPolarHBondContact O-CB 3.22Å; R97-P109 WeakPolarHBondContact CG-O 2.89Å; R97-P109 PolarHBondContact NH1-O 3.45Å; P109-F225 HydrophobicContact CB-CD1 4.04Å; P109-F225 HydrophobicContact CB-CE1 3.82Å; P109-F225 HydrophobicContact CG-CE1 4.1Å
110	A	94.7	Very high	93.8	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.008	19%	0.187	C	C	.	.			trans	-75	143.4	164.1	0	0	0	0	0	111.8	V43 G46 E47 V49 F107 V137	V43-A110 HydrophobicContact CG2-CB 4.16Å; G46-A110 PolarHBondContact N-O 2.82Å; E47-A110 PolarHBondContact O-N 3.36Å; V49-A110 HydrophobicContact CG1-CB 4.19Å; F107-A110 HydrophobicContact CB-CB 4.08Å; A110-V137 HydrophobicContact CB-CG1 4.31Å; A110-V137 HydrophobicContact CB-CG2 4.13Å
111	D	94.6	Very high	93.9	Very high	46 Å²	46	34.1 Å²	34.1	25%	0.246	17%	0.172	C	C	.	.			trans	-121.8	160.9	176.3	-176.6	36.8	0	0	0	111.2	Q45 Q113 D114	Q45-D111 PolarHBondContact NE2-OD1 3.21Å; D111-Q113 PolarHBondContact O-N 2.97Å; D111-Q113 VanDerWaalsContact O-N 3.16Å; D111-Q113 WeakPolarHBondContact OD2-CB 3.22Å; D111-Q113 WeakPolarHBondContact OD2-CG 3.4Å; D111-Q113 PolarHBondContact OD2-N 3.35Å; D111-D114 PolarHBondContact N-OD2 3.21Å; D111-D114 WeakPolarHBondContact O-CB 3.26Å; D111-D114 PolarHBondContact O-N 3.2Å
112	L	93.7	Very high	93.9	Very high	64 Å²	64	31.1 Å²	31.1	34%	0.335	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-57.9	-28.1	175.4	-61.6	172	0	0	0	111.8	Q45 D114 V115 V137 E139	Q45-L112 HydrophobicContact CB-CD2 4.32Å; Q45-L112 HydrophobicContact CB-CG 4.41Å; Q45-L112 HydrophobicContact CG-CD2 4.49Å; Q45-L112 HydrophobicContact CG-CG 4.06Å; L112-D114 PolarHBondContact O-N 3.05Å; L112-V115 WeakPolarHBondContact O-CG2 3.33Å; L112-V115 PolarHBondContact O-N 3.31Å; L112-V137 HydrophobicContact CD2-CG1 4.39Å; L112-E139 HydrophobicContact CD1-CG 4.05Å; L112-E139 HydrophobicContact CD2-CG 4.32Å
113	Q	91.4	Very high	94	Very high	153 Å²	153	30.5 Å²	30.5	72%	0.715	15%	0.15	S	C	*	.	G	3₁₀ helix	trans	-71.5	-3.2	173.6	-61.5	-172.7	36.2	0	0	114.4	R78 D111	R78-Q113 PolarHBondContact NH1-O 2.81Å; R78-Q113 PolarHBondContact NH2-O 2.83Å; D111-Q113 PolarHBondContact O-N 2.97Å; D111-Q113 VanDerWaalsContact O-N 3.16Å; D111-Q113 WeakPolarHBondContact OD2-CB 3.22Å; D111-Q113 WeakPolarHBondContact OD2-CG 3.4Å; D111-Q113 PolarHBondContact OD2-N 3.35Å
114	D	92.8	Very high	93.7	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.011	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-93.4	-0.9	175	-60.9	-50.7	0	0	0	113.7	R97 F107 D111 L112 G116 Y118 L135 V137	R97-D114 IonicContact CZ-OD1 3.36Å; R97-D114 IonicContact CZ-OD2 3.41Å; R97-D114 IonicContact NH1-OD1 2.68Å; R97-D114 IonicContact NH1-OD2 3.77Å; R97-D114 PolarHBondContact NH1-OD2 2.98Å; R97-D114 IonicContact NH2-OD1 3.46Å; R97-D114 PolarHBondContact NH2-OD1 2.82Å; R97-D114 IonicContact NH2-OD2 2.8Å; R97-D114 PolarHBondContact NH2-OD2 2.92Å; F107-D114 HydrophobicContact CD1-CB 4.04Å; F107-D114 WeakPolarHBondContact CD1-OD2 3.45Å; F107-D114 HydrophobicContact CE1-CB 3.77Å; D111-D114 PolarHBondContact N-OD2 3.21Å; D111-D114 WeakPolarHBondContact O-CB 3.26Å; D111-D114 PolarHBondContact O-N 3.2Å; L112-D114 PolarHBondContact O-N 3.05Å; D114-G116 PolarHBondContact O-N 2.75Å; D114-Y118 VanDerWaalsContact O-CE2 3.31Å; D114-Y118 WeakPolarHBondContact O-CE2 3.38Å; D114-Y118 PolarHBondContact O-OH 3.3Å; D114-L135 HydrophobicContact CB-CD2 4.05Å; D114-V137 HydrophobicContact CB-CG2 4.38Å
115	V	93.7	Very high	93.3	Very high	66 Å²	66	37.9 Å²	37.9	40%	0.4	20%	0.197	S	C	.	.			trans	-59.5	131.7	177.3	174.4	0	0	0	0	111.3	R78 L112 V137	R78-V115 PolarHBondContact NH2-O 3.45Å; L112-V115 WeakPolarHBondContact O-CG2 3.33Å; L112-V115 PolarHBondContact O-N 3.31Å; V115-V137 HydrophobicContact CG2-CB 4.1Å; V115-V137 HydrophobicContact CG2-CG2 4.49Å; V115-V137 WeakPolarHBondContact CG2-O 3.29Å
116	G	92.6	Very high	92.9	Very high	8 Å²	8	43.7 Å²	43.7	8%	0.082	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.5	-163	175.4	0	0	0	0	0	114.9	D114 L135	D114-G116 PolarHBondContact O-N 2.75Å; G116-L135 PolarHBondContact N-O 3.46Å; G116-L135 PolarHBondContact O-N 2.78Å
117	L	93.7	Very high	92.6	Very high	39 Å²	39	47.8 Å²	47.8	20%	0.204	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	130.5	176.6	-61.7	179.3	0	0	0	110.1	V36 R78 S79 A134	V36-L117 HydrophobicContact CG1-CD2 4Å; V36-L117 HydrophobicContact CG2-CD1 3.93Å; V36-L117 HydrophobicContact CG2-CD2 3.97Å; R78-L117 CarbonylContact C-O 3.51Å; R78-L117 WeakPolarHBondContact CA-O 3.46Å; S79-L117 PolarHBondContact N-O 2.78Å; S79-L117 PolarHBondContact O-N 3.07Å; L117-A134 HydrophobicContact CD2-CB 3.82Å
118	Y	94.5	Very high	92.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	100.2	-178.4	-73.8	-97.7	0	0	0	109.7	L51 Y77 R78 I91 I105 F107 D114 C120 S132 M133 L135	L51-Y118 HydrophobicContact CD2-CD1 4.33Å; L51-Y118 HydrophobicContact CD2-CD2 3.84Å; L51-Y118 HydrophobicContact CD2-CG 3.74Å; Y77-Y118 CarbonylContact O-C 3.59Å; Y77-Y118 WeakPolarHBondContact O-CA 3.49Å; R78-Y118 HydrophobicContact CB-CE1 4.46Å; R78-Y118 HydrophobicContact CG-CE1 4.26Å; R78-Y118 PolarHBondContact NE-OH 2.91Å; I91-Y118 HydrophobicContact CD1-CD1 3.49Å; I91-Y118 VanDerWaalsContact CD1-CD1 3.49Å; I91-Y118 HydrophobicContact CD1-CE1 3.69Å; I105-Y118 HydrophobicContact CD1-CD1 4Å; F107-Y118 HydrophobicContact CE1-CE1 4.31Å; F107-Y118 HydrophobicContact CZ-CD1 4.32Å; F107-Y118 AromaticContact CZ-CE1 3.61Å; F107-Y118 HydrophobicContact CZ-CE1 3.61Å; F107-Y118 HydrophobicContact CZ-CE2 4.42Å; F107-Y118 AromaticContact CZ-CZ 3.68Å; D114-Y118 VanDerWaalsContact O-CE2 3.31Å; D114-Y118 WeakPolarHBondContact O-CE2 3.38Å; D114-Y118 PolarHBondContact O-OH 3.3Å; Y118-C120 PolarHBondContact O-N 3.28Å; Y118-S132 WeakPolarHBondContact O-CA 3.26Å; Y118-M133 PolarHBondContact N-O 3.24Å; Y118-M133 WeakPolarHBondContact O-CE 3.26Å; Y118-M133 PolarHBondContact O-N 2.98Å; Y118-L135 HydrophobicContact CD2-CB 4.03Å; Y118-L135 HydrophobicContact CE2-CB 3.96Å; Y118-L135 HydrophobicContact CE2-CD2 3.96Å
119	S	94	Very high	92.4	Very high	1 Å²	1	46 Å²	46	1%	0.007	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	110.9	-177.3	-55.8	0	0	0	0	110.9	W76 Y77 E88 V131 S132	W76-S119 WeakPolarHBondContact CA-O 3.41Å; Y77-S119 PolarHBondContact N-O 2.85Å; Y77-S119 PolarHBondContact O-N 3.43Å; E88-S119 WeakPolarHBondContact OE1-CB 3.47Å; E88-S119 PolarHBondContact OE1-OG 3.18Å; S119-V131 CarbonylContact C-O 3.59Å; S119-V131 WeakPolarHBondContact CA-O 3.44Å; S119-S132 PolarHBondContact OG-OG 3.13Å
120	C	94.6	Very high	92.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	127.4	167.9	72.4	0	0	0	0	110.3	C53 L74 W76 Y118 K130 V131 M133	C53-C120 WeakPolarHBondContact CA-SG 3.37Å; C53-C120 HydrophobicContact CB-CB 3.65Å; C53-C120 WeakPolarHBondContact CB-SG 3.36Å; C53-C120 WeakPolarHBondContact SG-CB 3.5Å; C53-C120 CovalentContact SG-SG 2.04Å; C53-C120 PolarHBondContact SG-SG 2.87Å; L74-C120 HydrophobicContact CD1-CB 4.15Å; W76-C120 HydrophobicContact CD2-CB 3.84Å; W76-C120 HydrophobicContact CE3-CB 3.76Å; W76-C120 HydrophobicContact CH2-CB 3.95Å; W76-C120 HydrophobicContact CZ2-CB 3.97Å; W76-C120 HydrophobicContact CZ3-CB 3.83Å; Y118-C120 PolarHBondContact O-N 3.28Å; C120-K130 VanDerWaalsContact O-CA 3.25Å; C120-K130 WeakPolarHBondContact O-CA 3.42Å; C120-K130 WeakPolarHBondContact O-CB 3.44Å; C120-V131 PolarHBondContact N-O 3.31Å; C120-V131 PolarHBondContact O-N 3.34Å; C120-M133 HydrophobicContact CB-CE 4.05Å
121	V	93.9	Very high	92.3	Very high	10 Å²	10	45 Å²	45	6%	0.061	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	118.8	-173.1	-176.5	0	0	0	0	108.9	L74 M75 Y77 M129 K130	L74-V121 WeakPolarHBondContact CA-O 3.42Å; M75-V121 HydrophobicContact CB-CB 4.41Å; M75-V121 HydrophobicContact CE-CG1 4.22Å; M75-V121 PolarHBondContact N-O 2.98Å; M75-V121 PolarHBondContact O-N 2.71Å; Y77-V121 HydrophobicContact CD2-CB 4.36Å; Y77-V121 HydrophobicContact CD2-CG2 3.52Å; Y77-V121 HydrophobicContact CE2-CB 4.06Å; Y77-V121 HydrophobicContact CE2-CG2 3.6Å; V121-M129 WeakPolarHBondContact CA-O 3.39Å; V121-K130 HydrophobicContact CB-CB 4.24Å; V121-K130 HydrophobicContact CG1-CB 4.35Å; V121-K130 HydrophobicContact CG2-CB 3.73Å; V121-K130 HydrophobicContact CG2-CD 4.28Å
122	L	93.8	Very high	92.2	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	111.9	179.1	-171.2	67.8	0	0	0	109.6	L55 F56 I60 A67 L72 S73 L74 C128 M129	L55-L122 HydrophobicContact CD1-CB 3.8Å; F56-L122 HydrophobicContact CE1-CD2 4.03Å; F56-L122 HydrophobicContact CZ-CD1 4.12Å; F56-L122 HydrophobicContact CZ-CD2 4.18Å; I60-L122 HydrophobicContact CD1-CD2 3.58Å; A67-L122 HydrophobicContact CB-CD1 4.41Å; A67-L122 HydrophobicContact CB-CD2 4.28Å; L72-L122 HydrophobicContact CB-CD1 3.72Å; L72-L122 HydrophobicContact CB-CG 3.98Å; L72-L122 HydrophobicContact CD1-CD2 4.26Å; L72-L122 HydrophobicContact CD1-CG 4.45Å; L72-L122 HydrophobicContact CD2-CG 4.31Å; L72-L122 HydrophobicContact CG-CG 4.49Å; S73-L122 WeakPolarHBondContact O-CA 3.33Å; L74-L122 HydrophobicContact CB-CD1 4.22Å; L74-L122 HydrophobicContact CD1-CD1 4.33Å; L122-C128 WeakPolarHBondContact O-CA 3.36Å; L122-M129 HydrophobicContact CB-CG 3.93Å; L122-M129 HydrophobicContact CB-SD 4.43Å; L122-M129 HydrophobicContact CD2-SD 4.11Å; L122-M129 PolarHBondContact N-O 3.12Å; L122-M129 PolarHBondContact O-N 2.85Å
123	R	92.4	Very high	92.3	Very high	122 Å²	122	40.2 Å²	40.2	46%	0.46	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	140.8	-166.5	-169	175.3	-175.4	171.1	2.4	114.5	S73 M75 Y127 C128	S73-R123 PolarHBondContact N-O 3.06Å; S73-R123 PolarHBondContact O-N 3.29Å; S73-R123 PolarHBondContact OG-O 3.44Å; M75-R123 HydrophobicContact CE-CB 3.61Å; M75-R123 HydrophobicContact CE-CG 4.39Å; R123-Y127 CarbonylContact C-O 3.56Å; R123-Y127 VanDerWaalsContact CA-O 3.31Å; R123-Y127 WeakPolarHBondContact CA-O 3.34Å; R123-C128 HydrophobicContact CG-CB 4.06Å
124	N	88.8	Confident	92.4	Very high	66 Å²	66	33.9 Å²	33.9	35%	0.353	19%	0.185	S	C	.	.			trans	-132.9	-177.3	164	-167	-10.6	0	0	0	107.7	G71 L72 T126 Y127	G71-N124 VanDerWaalsContact O-CG 3.31Å; G71-N124 PolarHBondContact O-ND2 3.18Å; L72-N124 HydrophobicContact CD2-CB 3.82Å; L72-N124 HydrophobicContact CG-CB 4.49Å; N124-T126 VanDerWaalsContact C-N 3.27Å; N124-T126 PolarHBondContact O-N 2.75Å; N124-Y127 PolarHBondContact N-O 3.17Å; N124-Y127 PolarHBondContact O-N 3.23Å
125	S	86.3	Confident	92.5	Very high	95 Å²	95	34 Å²	34	66%	0.664	19%	0.186	S	C	*	.	S	Bend	trans	-58.1	-32.9	-176.4	57.9	0	0	0	0	114.7
126	T	86.9	Confident	92.6	Very high	123 Å²	123	32.5 Å²	32.5	76%	0.755	18%	0.181	S	C	*	.	S	Bend	trans	-116.6	-0.8	-177.2	54.8	0	0	0	0	114.1	N124	N124-T126 VanDerWaalsContact C-N 3.27Å; N124-T126 PolarHBondContact O-N 2.75Å
127	Y	88.1	Confident	92.7	Very high	99 Å²	99	32.6 Å²	32.6	39%	0.388	18%	0.179	S	C	.	.			trans	-134.7	133.3	-173.6	-173.6	-90.2	0	0	0	110.7	L72 R123 N124 M129	L72-Y127 HydrophobicContact CD2-CD1 3.51Å; L72-Y127 HydrophobicContact CD2-CE1 4.19Å; L72-Y127 HydrophobicContact CD2-CG 4.21Å; R123-Y127 CarbonylContact C-O 3.56Å; R123-Y127 VanDerWaalsContact CA-O 3.31Å; R123-Y127 WeakPolarHBondContact CA-O 3.34Å; N124-Y127 PolarHBondContact N-O 3.17Å; N124-Y127 PolarHBondContact O-N 3.23Å; Y127-M129 HydrophobicContact CE1-CB 4.16Å; Y127-M129 HydrophobicContact CE1-CG 3.88Å; Y127-M129 HydrophobicContact CE1-SD 3.84Å; Y127-M129 PolarHBondContact OH-SD 3.23Å
128	C	92.3	Very high	92.8	Very high	22 Å²	22	31.7 Å²	31.7	15%	0.149	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	127.3	171.9	-166.9	0	0	0	0	109.6	C31 T32 L122 R123	C31-C128 HydrophobicContact CB-CB 3.91Å; C31-C128 WeakPolarHBondContact CB-SG 3.06Å; C31-C128 WeakPolarHBondContact SG-CB 3.41Å; C31-C128 CovalentContact SG-SG 2.05Å; C31-C128 PolarHBondContact SG-SG 3.25Å; T32-C128 WeakPolarHBondContact CB-O 3.32Å; T32-C128 PolarHBondContact N-O 3.48Å; T32-C128 PolarHBondContact OG1-O 2.99Å; T32-C128 VanDerWaalsContact OG1-O 3.09Å; L122-C128 WeakPolarHBondContact O-CA 3.36Å; R123-C128 HydrophobicContact CG-CB 4.06Å
129	M	92.9	Very high	92.8	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.02	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	150.4	167.8	73.4	-174.3	-45.8	0	0	110	C31 T32 L55 I60 V121 L122 Y127	C31-M129 VanDerWaalsContact SG-C 3.5Å; C31-M129 PolarHBondContact SG-N 2.75Å; T32-M129 CarbonylContact O-C 3.53Å; T32-M129 VanDerWaalsContact O-CA 3.3Å; T32-M129 WeakPolarHBondContact O-CA 3.1Å; L55-M129 HydrophobicContact CD1-CG 3.79Å; L55-M129 HydrophobicContact CD1-SD 4.04Å; L55-M129 HydrophobicContact CD2-CE 3.71Å; L55-M129 HydrophobicContact CD2-CG 4.26Å; L55-M129 HydrophobicContact CD2-SD 4.23Å; I60-M129 HydrophobicContact CD1-SD 4.19Å; I60-M129 HydrophobicContact CG1-SD 4.48Å; I60-M129 HydrophobicContact CG2-CE 3.66Å; I60-M129 HydrophobicContact CG2-SD 3.78Å; V121-M129 WeakPolarHBondContact CA-O 3.39Å; L122-M129 HydrophobicContact CB-CG 3.93Å; L122-M129 HydrophobicContact CB-SD 4.43Å; L122-M129 HydrophobicContact CD2-SD 4.11Å; L122-M129 PolarHBondContact N-O 3.12Å; L122-M129 PolarHBondContact O-N 2.85Å; Y127-M129 HydrophobicContact CE1-CB 4.16Å; Y127-M129 HydrophobicContact CE1-CG 3.88Å; Y127-M129 HydrophobicContact CE1-SD 3.84Å; Y127-M129 PolarHBondContact OH-SD 3.23Å
130	K	92.5	Very high	92.8	Very high	24 Å²	24	41.3 Å²	41.3	10%	0.104	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	156.6	170.3	74.2	165.3	-167.3	165.7	0	112.7	T32 D33 W34 E88 C120 V121	T32-K130 PolarHBondContact O-N 3.35Å; D33-K130 HydrophobicContact CB-CG 4.23Å; D33-K130 VanDerWaalsContact OD1-CE 3.27Å; D33-K130 WeakPolarHBondContact OD1-CE 3.37Å; D33-K130 WeakPolarHBondContact OD2-CE 3.39Å; D33-K130 IonicContact OD2-NZ 3.48Å; D33-K130 PolarHBondContact OD2-NZ 3.02Å; W34-K130 PolarHBondContact N-O 2.69Å; E88-K130 IonicContact OE1-NZ 3.32Å; E88-K130 PolarHBondContact OE1-NZ 3.33Å; E88-K130 IonicContact OE2-NZ 2.7Å; E88-K130 PolarHBondContact OE2-NZ 3.27Å; C120-K130 VanDerWaalsContact O-CA 3.25Å; C120-K130 WeakPolarHBondContact O-CA 3.42Å; C120-K130 WeakPolarHBondContact O-CB 3.44Å; V121-K130 HydrophobicContact CB-CB 4.24Å; V121-K130 HydrophobicContact CG1-CB 4.35Å; V121-K130 HydrophobicContact CG2-CB 3.73Å; V121-K130 HydrophobicContact CG2-CD 4.28Å
131	V	94.3	Very high	92.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	151.1	168.6	71.9	0	0	0	0	108.5	W34 S35 D37 A54 L55 Y59 S119 C120 M133	W34-V131 HydrophobicContact CB-CB 4.07Å; W34-V131 HydrophobicContact CB-CG2 3.92Å; S35-V131 WeakPolarHBondContact O-CG2 3.28Å; D37-V131 HydrophobicContact CB-CG2 4.01Å; A54-V131 HydrophobicContact CB-CG1 4Å; L55-V131 HydrophobicContact CD2-CB 3.79Å; L55-V131 HydrophobicContact CD2-CG1 3.45Å; L55-V131 VanDerWaalsContact CD2-CG1 3.45Å; L55-V131 HydrophobicContact CG-CG1 3.7Å; Y59-V131 HydrophobicContact CE2-CG2 3.97Å; S119-V131 CarbonylContact C-O 3.59Å; S119-V131 WeakPolarHBondContact CA-O 3.44Å; C120-V131 PolarHBondContact N-O 3.31Å; C120-V131 PolarHBondContact O-N 3.34Å; V131-M133 HydrophobicContact CG1-SD 3.86Å
132	S	93.8	Very high	92.7	Very high	9 Å²	9	49 Å²	49	6%	0.063	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.8	-177.6	-40.8	0	0	0	0	110.7	S35 V36 D37 Y118 S119	S35-S132 PolarHBondContact O-N 2.9Å; V36-S132 CarbonylContact C-O 3.58Å; V36-S132 VanDerWaalsContact CA-O 3.25Å; V36-S132 WeakPolarHBondContact CA-O 3.41Å; V36-S132 WeakPolarHBondContact CG1-O 3.47Å; D37-S132 PolarHBondContact N-O 2.82Å; Y118-S132 WeakPolarHBondContact O-CA 3.26Å; S119-S132 PolarHBondContact OG-OG 3.13Å
133	M	94.7	Very high	92.4	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	136.2	171.2	-68.8	69.1	58.2	0	0	109.3	D37 Y41 A54 W76 Y118 C120 V131	D37-M133 HydrophobicContact CB-CG 4.4Å; Y41-M133 HydrophobicContact CD2-CB 4.27Å; Y41-M133 HydrophobicContact CE2-CB 4.05Å; Y41-M133 HydrophobicContact CE2-CG 4.05Å; A54-M133 HydrophobicContact CB-CG 4.09Å; A54-M133 HydrophobicContact CB-SD 3.61Å; A54-M133 PolarHBondContact N-SD 3.09Å; A54-M133 VanDerWaalsContact N-SD 3.43Å; W76-M133 HydrophobicContact CE3-CE 4.38Å; W76-M133 HydrophobicContact CH2-CE 3.38Å; W76-M133 HydrophobicContact CZ3-CE 3.26Å; Y118-M133 PolarHBondContact N-O 3.24Å; Y118-M133 WeakPolarHBondContact O-CE 3.26Å; Y118-M133 PolarHBondContact O-N 2.98Å; C120-M133 HydrophobicContact CB-CE 4.05Å; V131-M133 HydrophobicContact CG1-SD 3.86Å
134	A	94.8	Very high	92.5	Very high	19 Å²	19	54 Å²	54	16%	0.157	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	131.5	176.9	0	0	0	0	0	111.1	V36 K40 Y41 L117	V36-A134 HydrophobicContact CG1-CB 4.23Å; K40-A134 HydrophobicContact CG-CB 4.33Å; Y41-A134 PolarHBondContact N-O 3.18Å; L117-A134 HydrophobicContact CD2-CB 3.82Å
135	L	94.8	Very high	92.7	Very high	5 Å²	5	52 Å²	52	3%	0.026	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	122.3	170.7	177.4	55.2	0	0	0	110	V43 V49 L51 F107 D114 G116 Y118 V137	V43-L135 HydrophobicContact CG2-CD1 4.15Å; V49-L135 HydrophobicContact CG1-CD1 4.43Å; L51-L135 HydrophobicContact CD1-CD1 4.24Å; L51-L135 HydrophobicContact CD1-CD2 4.17Å; L51-L135 HydrophobicContact CD2-CB 4.21Å; L51-L135 HydrophobicContact CD2-CD2 4.28Å; F107-L135 HydrophobicContact CD2-CD2 4.5Å; F107-L135 HydrophobicContact CE1-CD2 4.17Å; F107-L135 HydrophobicContact CE2-CD2 4.1Å; F107-L135 HydrophobicContact CZ-CD2 3.92Å; D114-L135 HydrophobicContact CB-CD2 4.05Å; G116-L135 PolarHBondContact N-O 3.46Å; G116-L135 PolarHBondContact O-N 2.78Å; Y118-L135 HydrophobicContact CD2-CB 4.03Å; Y118-L135 HydrophobicContact CE2-CB 3.96Å; Y118-L135 HydrophobicContact CE2-CD2 3.96Å; L135-V137 HydrophobicContact CD1-CG2 4.02Å; L135-V137 HydrophobicContact CD2-CG2 4.3Å; L135-V137 HydrophobicContact CG-CG2 3.97Å
136	A	94.8	Very high	93.1	Very high	35 Å²	35	48.2 Å²	48.2	29%	0.289	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	126.7	167	0	0	0	0	0	109.3	Y41 Q42 V43 M150	Y41-A136 PolarHBondContact O-N 2.87Å; Q42-A136 WeakPolarHBondContact CA-O 3.31Å; Q42-A136 HydrophobicContact CG-CB 4.38Å; V43-A136 PolarHBondContact N-O 3.46Å; A136-M150 HydrophobicContact CB-CE 3.97Å
137	V	95.4	Very high	93.5	Very high	9 Å²	9	43.3 Å²	43.3	6%	0.055	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	132.6	173.1	-169.7	0	0	0	0	106.7	V43 Q45 A110 L112 D114 V115 L135	V43-V137 HydrophobicContact CG2-CG2 4.1Å; V43-V137 WeakPolarHBondContact O-CA 3.38Å; Q45-V137 HydrophobicContact CB-CG1 4.18Å; A110-V137 HydrophobicContact CB-CG1 4.31Å; A110-V137 HydrophobicContact CB-CG2 4.13Å; L112-V137 HydrophobicContact CD2-CG1 4.39Å; D114-V137 HydrophobicContact CB-CG2 4.38Å; V115-V137 HydrophobicContact CG2-CB 4.1Å; V115-V137 HydrophobicContact CG2-CG2 4.49Å; V115-V137 WeakPolarHBondContact CG2-O 3.29Å; L135-V137 HydrophobicContact CD1-CG2 4.02Å; L135-V137 HydrophobicContact CD2-CG2 4.3Å; L135-V137 HydrophobicContact CG-CG2 3.97Å
138	A	95.1	Very high	93.8	Very high	20 Å²	20	40.8 Å²	40.8	17%	0.165	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	158.7	179.6	0	0	0	0	0	111.6	V43 L44 Q45 N147 M150	V43-A138 PolarHBondContact O-N 3.07Å; L44-A138 CarbonylContact C-O 3.52Å; L44-A138 VanDerWaalsContact CA-O 3.3Å; L44-A138 WeakPolarHBondContact CA-O 3.48Å; Q45-A138 PolarHBondContact N-O 3.45Å; A138-N147 HydrophobicContact CB-CB 4.49Å; A138-M150 HydrophobicContact CB-CE 3.54Å; A138-M150 HydrophobicContact CB-SD 4.1Å
139	E	95.3	Very high	93.8	Very high	114 Å²	114	46.1 Å²	46.1	53%	0.533	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-72	156.8	164.4	-63.7	177.9	168.3	0	0	109.9	L112 N147	L112-E139 HydrophobicContact CD1-CG 4.05Å; L112-E139 HydrophobicContact CD2-CG 4.32Å; E139-N147 PolarHBondContact O-ND2 3.01Å
140	N	94.4	Very high	93.7	Very high	89 Å²	89	47.7 Å²	47.7	48%	0.476	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-69.2	149.9	166.9	55.7	-63.9	0	0	0	110.6	L44 L144	L44-N140 HydrophobicContact CD2-CB 4.44Å; N140-L144 PolarHBondContact ND2-O 2.69Å
141	D	94.3	Very high	93.6	Very high	41 Å²	41	50.4 Å²	50.4	22%	0.219	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-66.7	155.6	177.3	-60.2	-22.5	0	0	0	110.6	D143 L144 Y146 N147 S148	D141-D143 PolarHBondContact O-N 3.18Å; D141-L144 HydrophobicContact CB-CB 4.19Å; D141-L144 HydrophobicContact CB-CD1 3.96Å; D141-L144 PolarHBondContact O-N 3.29Å; D141-Y146 PolarHBondContact N-O 2.68Å; D141-N147 PolarHBondContact OD1-ND2 3.08Å; D141-S148 WeakPolarHBondContact OD2-CB 3.38Å; D141-S148 PolarHBondContact OD2-N 2.85Å; D141-S148 PolarHBondContact OD2-OG 3.28Å
142	T	91.1	Very high	93.6	Very high	131 Å²	131	54 Å²	54	80%	0.804	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	130	-178.1	52.4	0	0	0	0	112.2	L144	T142-L144 PolarHBondContact O-N 3.33Å
143	D	87.8	Confident	93.6	Very high	173 Å²	173	58 Å²	58	93%	0.925	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	11.8	-174.8	-63.6	-38.5	0	0	0	116	D141	D141-D143 PolarHBondContact O-N 3.18Å
144	L	94.6	Very high	93.6	Very high	57 Å²	57	60.6 Å²	60.6	30%	0.298	33%	0.334	S	S	.	.			trans	-116.5	166.3	176.9	-62.7	175.4	0	0	0	111.9	N140 D141 T142 Y146	N140-L144 PolarHBondContact ND2-O 2.69Å; D141-L144 HydrophobicContact CB-CB 4.19Å; D141-L144 HydrophobicContact CB-CD1 3.96Å; D141-L144 PolarHBondContact O-N 3.29Å; T142-L144 PolarHBondContact O-N 3.33Å; L144-Y146 HydrophobicContact CD1-CE2 3.93Å; L144-Y146 HydrophobicContact CD2-CE1 4.32Å
145	C	93.6	Very high	93.6	Very high	23 Å²	23	64.2 Å²	64.2	16%	0.155	35%	0.346	C	S	.	.	S	Bend	trans	-108.5	11	-177.5	67.6	0	0	0	0	113.1	C187 T217	C145-C187 VanDerWaalsContact CA-SG 3.55Å; C145-C187 HydrophobicContact CB-CB 3.66Å; C145-C187 WeakPolarHBondContact CB-SG 3.44Å; C145-C187 PolarHBondContact N-SG 3.46Å; C145-C187 WeakPolarHBondContact SG-CA 3.43Å; C145-C187 WeakPolarHBondContact SG-CB 3.3Å; C145-C187 CovalentContact SG-SG 2.04Å; C145-C187 PolarHBondContact SG-SG 3.24Å; C145-T217 PolarHBondContact SG-OG1 3.44Å
146	Y	94.6	Very high	93.6	Very high	16 Å²	16	64 Å²	64	6%	0.063	35%	0.345	C	S	.	.	S	Bend	trans	-146.8	168.4	-177.9	58.7	-102.2	0	0	0	109.8	D141 L144 C187 N215 T230	D141-Y146 PolarHBondContact N-O 2.68Å; L144-Y146 HydrophobicContact CD1-CE2 3.93Å; L144-Y146 HydrophobicContact CD2-CE1 4.32Å; Y146-C187 WeakPolarHBondContact CD1-SG 3.29Å; Y146-C187 VanDerWaalsContact CE1-SG 3.51Å; Y146-N215 HydrophobicContact CE1-CB 3.83Å; Y146-N215 VanDerWaalsContact OH-CG 3.29Å; Y146-N215 PolarHBondContact OH-ND2 2.91Å; Y146-T230 WeakPolarHBondContact CB-OG1 3.4Å; Y146-T230 HydrophobicContact CD1-CG2 3.7Å; Y146-T230 HydrophobicContact CE1-CG2 4.15Å; Y146-T230 HydrophobicContact CG-CG2 3.94Å
147	N	95.4	Very high	93.7	Very high	20 Å²	20	64.1 Å²	64.1	11%	0.107	34%	0.339	C	S	.	.			trans	-104	130.6	167.9	-170.1	-74.1	0	0	0	109.4	L44 A138 E139 D141 N149 M150 R151	L44-N147 HydrophobicContact CD2-CB 4.07Å; A138-N147 HydrophobicContact CB-CB 4.49Å; E139-N147 PolarHBondContact O-ND2 3.01Å; D141-N147 PolarHBondContact OD1-ND2 3.08Å; N147-N149 PolarHBondContact O-N 3.43Å; N147-N149 VanDerWaalsContact O-N 3.15Å; N147-N149 WeakPolarHBondContact OD1-CB 3.37Å; N147-N149 PolarHBondContact OD1-N 2.95Å; N147-N149 PolarHBondContact OD1-ND2 2.83Å; N147-M150 HydrophobicContact CB-CB 4.32Å; N147-M150 HydrophobicContact CB-CG 4.18Å; N147-M150 HydrophobicContact CB-SD 4.19Å; N147-M150 PolarHBondContact O-N 3.09Å; N147-R151 PolarHBondContact O-N 3.25Å
148	S	93.4	Very high	93.6	Very high	45 Å²	45	65.9 Å²	65.9	32%	0.315	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.2	-174.2	-63.2	0	0	0	0	113.9	D141 M150 R151	D141-S148 WeakPolarHBondContact OD2-CB 3.38Å; D141-S148 PolarHBondContact OD2-N 2.85Å; D141-S148 PolarHBondContact OD2-OG 3.28Å; S148-M150 VanDerWaalsContact C-N 3.34Å; S148-R151 WeakPolarHBondContact O-CD 3.31Å; S148-R151 WeakPolarHBondContact O-CG 3.18Å; S148-R151 PolarHBondContact O-NE 3.43Å
149	N	91.6	Very high	93.6	Very high	135 Å²	135	68.9 Å²	68.9	72%	0.722	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-2.7	174.8	-52.5	-76.7	0	0	0	113.6	Q42 N147	Q42-N149 PolarHBondContact NE2-O 3.24Å; N147-N149 PolarHBondContact O-N 3.43Å; N147-N149 VanDerWaalsContact O-N 3.15Å; N147-N149 WeakPolarHBondContact OD1-CB 3.37Å; N147-N149 PolarHBondContact OD1-N 2.95Å; N147-N149 PolarHBondContact OD1-ND2 2.83Å
150	M	90.8	Very high	93.5	Very high	36 Å²	36	68 Å²	68	18%	0.177	36%	0.362	C	S	.	.	S	Bend	trans	-119.4	6.2	-178.7	-62.1	-176.4	164.9	0	0	112.9	Q42 A136 A138 N147 S148	Q42-M150 HydrophobicContact CB-CB 4.38Å; Q42-M150 HydrophobicContact CB-CE 4.17Å; Q42-M150 HydrophobicContact CB-CG 4.01Å; Q42-M150 HydrophobicContact CB-SD 4.13Å; Q42-M150 HydrophobicContact CG-CG 4.44Å; A136-M150 HydrophobicContact CB-CE 3.97Å; A138-M150 HydrophobicContact CB-CE 3.54Å; A138-M150 HydrophobicContact CB-SD 4.1Å; N147-M150 HydrophobicContact CB-CB 4.32Å; N147-M150 HydrophobicContact CB-CG 4.18Å; N147-M150 HydrophobicContact CB-SD 4.19Å; N147-M150 PolarHBondContact O-N 3.09Å; S148-M150 VanDerWaalsContact C-N 3.34Å
151	R	92.1	Very high	93.6	Very high	81 Å²	81	73.4 Å²	73.4	31%	0.306	38%	0.376	S	S	.	.			trans	-80.6	141.4	176.7	72.8	-164.6	-176.9	143.8	15.4	111	N147 S148 N215 T230 E232	N147-R151 PolarHBondContact O-N 3.25Å; S148-R151 WeakPolarHBondContact O-CD 3.31Å; S148-R151 WeakPolarHBondContact O-CG 3.18Å; S148-R151 PolarHBondContact O-NE 3.43Å; R151-N215 PolarHBondContact NH1-OD1 3.29Å; R151-T230 WeakPolarHBondContact CA-O 3.49Å; R151-E232 IonicContact CZ-OE1 3.81Å; R151-E232 IonicContact CZ-OE2 2.63Å; R151-E232 IonicContact NE-OE2 2.63Å; R151-E232 IonicContact NH1-OE1 3.72Å; R151-E232 PolarHBondContact NH1-OE1 3.27Å; R151-E232 IonicContact NH1-OE2 2.69Å; R151-E232 IonicContact NH2-OE1 2.71Å; R151-E232 PolarHBondContact NH2-OE1 2.89Å; R151-E232 IonicContact NH2-OE2 3.93Å; R151-E232 PolarHBondContact NH2-OE2 3.33Å
152	I	93	Very high	93.7	Very high	76 Å²	76	73.6 Å²	73.6	39%	0.39	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	139.5	173.7	-70.8	156.6	0	0	0	108.5	P167 T230 T231 E232	I152-P167 HydrophobicContact CD1-CB 4.11Å; I152-P167 HydrophobicContact CD1-CG 3.61Å; I152-T230 PolarHBondContact N-O 2.84Å; I152-T231 CarbonylContact O-C 3.54Å; I152-T231 VanDerWaalsContact O-CA 3.23Å; I152-T231 WeakPolarHBondContact O-CA 3.22Å; I152-E232 PolarHBondContact O-N 3.05Å
153	T	94.7	Very high	94	Very high	94 Å²	94	70.9 Å²	70.9	58%	0.577	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	123.9	-179.3	56.6	0	0	0	0	111.1	E232	T153-E232 HydrophobicContact CG2-CB 4.46Å
154	E	95.1	Very high	94.4	Very high	53 Å²	53	62.7 Å²	62.7	25%	0.248	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	143.9	174.1	-71.7	-172.3	153.3	0	0	111.5	F162 T231 E232 L233 T234	E154-F162 HydrophobicContact CB-CZ 4.07Å; E154-F162 WeakPolarHBondContact OE2-CE1 3.34Å; E154-F162 WeakPolarHBondContact OE2-CZ 3.25Å; E154-T231 HydrophobicContact CB-CG2 3.91Å; E154-T231 HydrophobicContact CG-CG2 3.64Å; E154-E232 PolarHBondContact N-O 3.03Å; E154-L233 HydrophobicContact CB-CD1 4.42Å; E154-T234 PolarHBondContact O-N 2.85Å; E154-T234 PolarHBondContact O-OG1 2.91Å
155	K	94.3	Very high	94.5	Very high	95 Å²	95	63.1 Å²	63.1	41%	0.413	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	123.3	174.3	-61.9	-179.1	-178.6	176.6	0	109.4	T236 Y275 R277 D278	K155-T236 HydrophobicContact CB-CG2 4.41Å; K155-Y275 WeakPolarHBondContact CD-OH 3.26Å; K155-R277 PolarHBondContact NZ-O 3.39Å; K155-D278 IonicContact NZ-OD1 3.65Å; K155-D278 PolarHBondContact NZ-OD1 2.95Å
156	A	95.4	Very high	94.5	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.008	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	134.4	176.9	0	0	0	0	0	112.5	F162 V208 L233 T234 V235 T236	A156-F162 HydrophobicContact CB-CB 4.15Å; A156-F162 HydrophobicContact CB-CD1 3.86Å; A156-F162 HydrophobicContact CB-CD2 3.63Å; A156-F162 HydrophobicContact CB-CE1 4.19Å; A156-F162 HydrophobicContact CB-CE2 3.97Å; A156-F162 HydrophobicContact CB-CG 3.58Å; A156-F162 HydrophobicContact CB-CZ 4.25Å; A156-V208 HydrophobicContact CB-CG1 4.26Å; A156-V208 HydrophobicContact CB-CG2 4.33Å; A156-L233 HydrophobicContact CB-CD1 3.72Å; A156-T234 PolarHBondContact N-O 3.43Å; A156-V235 CarbonylContact O-C 3.53Å; A156-V235 VanDerWaalsContact O-CA 3.3Å; A156-V235 WeakPolarHBondContact O-CA 3.28Å; A156-T236 PolarHBondContact O-N 3.11Å
157	E	95.1	Very high	94.4	Very high	37 Å²	37	62.4 Å²	62.4	17%	0.173	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	132.3	-179.5	-62.7	-179.3	-98.8	0	0	111.8	K160 P238 I239	E157-K160 HydrophobicContact CB-CB 4.24Å; E157-K160 HydrophobicContact CB-CD 3.85Å; E157-K160 HydrophobicContact CB-CG 4.07Å; E157-K160 HydrophobicContact CG-CD 4.41Å; E157-K160 PolarHBondContact O-N 2.76Å; E157-K160 IonicContact OE1-NZ 2.68Å; E157-K160 PolarHBondContact OE1-NZ 2.94Å; E157-K160 WeakPolarHBondContact OE2-CE 3.46Å; E157-K160 IonicContact OE2-NZ 3.59Å; E157-K160 PolarHBondContact OE2-NZ 3.04Å; E157-P238 WeakPolarHBondContact OE2-CA 3.28Å; E157-I239 WeakPolarHBondContact OE2-CG1 3.47Å; E157-I239 PolarHBondContact OE2-N 2.87Å
158	L	95.3	Very high	94.1	Very high	47 Å²	47	66.1 Å²	66.1	25%	0.246	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	141.1	177.4	-166.6	73.6	0	0	0	111.8	K160 V235 T236 L312	L158-K160 PolarHBondContact O-N 2.88Å; L158-V235 HydrophobicContact CB-CG1 4.25Å; L158-V235 HydrophobicContact CD1-CG1 3.89Å; L158-T236 WeakPolarHBondContact CB-O 3.31Å; L158-T236 PolarHBondContact N-O 2.86Å; L158-L312 HydrophobicContact CD2-CD1 4.45Å
159	S	93.6	Very high	94	Very high	82 Å²	82	64.5 Å²	64.5	57%	0.573	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	-0.2	-179.4	-53.9	0	0	0	0	116.2	V208	S159-V208 PolarHBondContact N-O 3.03Å
160	K	94.5	Very high	93.9	Very high	95 Å²	95	64.5 Å²	64.5	41%	0.413	31%	0.313	S	S	.	.	S	Bend	trans	-87.6	172.2	170.9	-65.1	-164.1	-174.8	171.2	0	111.4	E157 L158 E207 V208	E157-K160 HydrophobicContact CB-CB 4.24Å; E157-K160 HydrophobicContact CB-CD 3.85Å; E157-K160 HydrophobicContact CB-CG 4.07Å; E157-K160 HydrophobicContact CG-CD 4.41Å; E157-K160 PolarHBondContact O-N 2.76Å; E157-K160 IonicContact OE1-NZ 2.68Å; E157-K160 PolarHBondContact OE1-NZ 2.94Å; E157-K160 WeakPolarHBondContact OE2-CE 3.46Å; E157-K160 IonicContact OE2-NZ 3.59Å; E157-K160 PolarHBondContact OE2-NZ 3.04Å; L158-K160 PolarHBondContact O-N 2.88Å; K160-E207 WeakPolarHBondContact O-CA 3.37Å; K160-V208 PolarHBondContact O-N 3.04Å
161	R	96.3	Very high	93.8	Very high	204 Å²	204	64.5 Å²	64.5	77%	0.77	31%	0.314	S	S	*	.			trans	-83.5	136.8	169.8	-68.6	177.6	-174.7	-178.2	4.3	109.6	F205 Q206	R161-F205 WeakPolarHBondContact CA-O 3.49Å; R161-Q206 VanDerWaalsContact CG-O 3.29Å; R161-Q206 WeakPolarHBondContact CG-O 3.22Å
162	F	96.7	Very high	93.7	Very high	44 Å²	44	61.7 Å²	61.7	19%	0.193	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	165.8	177.3	-168	-104.1	0	0	0	110.6	E154 A156 I164 F205 V208 L233	E154-F162 HydrophobicContact CB-CZ 4.07Å; E154-F162 WeakPolarHBondContact OE2-CE1 3.34Å; E154-F162 WeakPolarHBondContact OE2-CZ 3.25Å; A156-F162 HydrophobicContact CB-CB 4.15Å; A156-F162 HydrophobicContact CB-CD1 3.86Å; A156-F162 HydrophobicContact CB-CD2 3.63Å; A156-F162 HydrophobicContact CB-CE1 4.19Å; A156-F162 HydrophobicContact CB-CE2 3.97Å; A156-F162 HydrophobicContact CB-CG 3.58Å; A156-F162 HydrophobicContact CB-CZ 4.25Å; F162-I164 HydrophobicContact CD1-CG1 4.32Å; F162-I164 HydrophobicContact CE1-CG1 3.85Å; F162-F205 HydrophobicContact CB-CB 4.32Å; F162-F205 HydrophobicContact CD1-CD2 4.37Å; F162-F205 PolarHBondContact N-O 3.03Å; F162-F205 PolarHBondContact O-N 3.15Å; F162-V208 HydrophobicContact CB-CG2 3.51Å; F162-L233 HydrophobicContact CD1-CD1 3.97Å; F162-L233 HydrophobicContact CE1-CD1 3.57Å; F162-L233 HydrophobicContact CZ-CD1 4.24Å
163	H	96.4	Very high	93.5	Very high	75 Å²	75	59.8 Å²	59.8	35%	0.347	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	134.2	166.4	66.1	-79.1	0	0	0	110.7	K202 L203 F204	H163-K202 VanDerWaalsContact CD2-CD 3.48Å; H163-K202 WeakPolarHBondContact CD2-CD 3.28Å; H163-L203 CarbonylContact C-O 3.58Å; H163-L203 VanDerWaalsContact CA-O 3.23Å; H163-L203 WeakPolarHBondContact CA-O 3.35Å; H163-F204 HydrophobicContact CB-CD1 3.63Å; H163-F204 HydrophobicContact CB-CE1 3.83Å; H163-F204 HydrophobicContact CB-CG 4.04Å; H163-F204 HydrophobicContact CB-CZ 4.4Å; H163-F204 AromaticContact CG-CE1 3.95Å
164	I	96.9	Very high	93	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	130.4	169.9	-58.4	169.8	0	0	0	107.2	F162 W183 K202 L203 F205 Y216 T231 L233	F162-I164 HydrophobicContact CD1-CG1 4.32Å; F162-I164 HydrophobicContact CE1-CG1 3.85Å; I164-W183 HydrophobicContact CB-CH2 4.28Å; I164-W183 HydrophobicContact CB-CZ3 4.48Å; I164-W183 HydrophobicContact CG2-CH2 3.76Å; I164-W183 HydrophobicContact CG2-CZ3 3.91Å; I164-K202 WeakPolarHBondContact O-CA 3.4Å; I164-L203 PolarHBondContact N-O 3.22Å; I164-L203 PolarHBondContact O-N 3.21Å; I164-F205 HydrophobicContact CD1-CE2 3.83Å; I164-F205 HydrophobicContact CD1-CZ 3.93Å; I164-F205 HydrophobicContact CG1-CE2 3.9Å; I164-F205 HydrophobicContact CG1-CZ 4.48Å; I164-Y216 HydrophobicContact CD1-CD1 3.78Å; I164-Y216 HydrophobicContact CD1-CD2 3.65Å; I164-Y216 HydrophobicContact CD1-CE1 4.31Å; I164-Y216 HydrophobicContact CD1-CE2 4.24Å; I164-Y216 HydrophobicContact CD1-CG 3.41Å; I164-Y216 VanDerWaalsContact CD1-CG 3.41Å; I164-T231 HydrophobicContact CG2-CG2 4.11Å; I164-L233 HydrophobicContact CD1-CB 4.36Å; I164-L233 HydrophobicContact CD1-CD2 4.32Å
165	L	95.5	Very high	92.3	Very high	66 Å²	66	65.1 Å²	65.1	35%	0.346	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	138.7	169.3	168.6	62.1	0	0	0	109.6	P167 D201 K202	L165-P167 VanDerWaalsContact O-CD 3.29Å; L165-P167 WeakPolarHBondContact O-CD 3.41Å; L165-D201 HydrophobicContact CD1-CB 4.01Å; L165-D201 WeakPolarHBondContact CD1-OD2 3.32Å; L165-K202 HydrophobicContact CB-CG 4.38Å; L165-K202 HydrophobicContact CD1-CG 4.08Å
166	C	94.3	Very high	91.6	Very high	2 Å²	2	65.2 Å²	65.2	1%	0.014	35%	0.353	C	S	.	.			trans	-79.3	111.1	163.3	-167.3	0	0	0	0	109	I169 I181 W183 D201 C218	C166-I169 HydrophobicContact CB-CG2 4.14Å; C166-I169 VanDerWaalsContact SG-CG2 3.54Å; C166-I181 HydrophobicContact CB-CD1 4.08Å; C166-W183 HydrophobicContact CB-CH2 4.01Å; C166-W183 HydrophobicContact CB-CZ2 3.84Å; C166-D201 WeakPolarHBondContact CB-O 3.48Å; C166-D201 PolarHBondContact N-O 3.31Å; C166-C218 VanDerWaalsContact CA-SG 3.52Å; C166-C218 HydrophobicContact CB-CB 3.77Å; C166-C218 WeakPolarHBondContact CB-SG 3.42Å; C166-C218 WeakPolarHBondContact SG-CB 3.39Å; C166-C218 CovalentContact SG-SG 2.04Å; C166-C218 PolarHBondContact SG-SG 3.11Å
167	P	92.7	Very high	91	Very high	22 Å²	22	71.3 Å²	71.3	14%	0.143	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	151.8	-166.2	33.4	-35.6	0	0	0	113.3	I152 L165 I169 R229	I152-P167 HydrophobicContact CD1-CB 4.11Å; I152-P167 HydrophobicContact CD1-CG 3.61Å; L165-P167 VanDerWaalsContact O-CD 3.29Å; L165-P167 WeakPolarHBondContact O-CD 3.41Å; P167-I169 VanDerWaalsContact C-N 3.32Å; P167-I169 WeakPolarHBondContact O-CG2 3.45Å; P167-I169 PolarHBondContact O-N 2.87Å; P167-R229 HydrophobicContact CG-CB 3.84Å; P167-R229 HydrophobicContact CG-CG 4.19Å
168	E	89.4	Confident	90.4	Very high	98 Å²	98	77.1 Å²	77.1	46%	0.458	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	37.8	172.1	-57.8	-156.1	-142.5	0	0	115.4	K39 Y172	K39-E168 WeakPolarHBondContact CE-OE1 3.35Å; K39-E168 WeakPolarHBondContact CE-OE2 3.25Å; K39-E168 IonicContact NZ-OE1 3.75Å; K39-E168 IonicContact NZ-OE2 3.24Å; K39-E168 PolarHBondContact NZ-OE2 2.86Å; E168-Y172 WeakPolarHBondContact O-CE2 3.34Å
169	I	90.8	Very high	90	Very high	11 Å²	11	76.1 Å²	76.1	6%	0.056	40%	0.403	C	S	.	.			trans	-91.9	-11.8	-176	69.1	172	0	0	0	114.6	C166 P167 D171 Y172 V173 P179 I181 D201 I220	C166-I169 HydrophobicContact CB-CG2 4.14Å; C166-I169 VanDerWaalsContact SG-CG2 3.54Å; P167-I169 VanDerWaalsContact C-N 3.32Å; P167-I169 WeakPolarHBondContact O-CG2 3.45Å; P167-I169 PolarHBondContact O-N 2.87Å; I169-D171 PolarHBondContact O-N 2.82Å; I169-D171 VanDerWaalsContact O-N 3.08Å; I169-Y172 PolarHBondContact O-N 2.92Å; I169-V173 HydrophobicContact CB-CG2 4.49Å; I169-V173 HydrophobicContact CD1-CG2 4.35Å; I169-V173 HydrophobicContact CG1-CG2 4.38Å; I169-V173 WeakPolarHBondContact O-CG2 3.34Å; I169-P179 HydrophobicContact CD1-CB 4.21Å; I169-P179 HydrophobicContact CD1-CG 4.19Å; I169-I181 HydrophobicContact CD1-CD1 4.01Å; I169-D201 HydrophobicContact CD1-CB 3.86Å; I169-I220 HydrophobicContact CB-CD1 3.63Å; I169-I220 HydrophobicContact CD1-CD1 4.1Å; I169-I220 HydrophobicContact CG1-CD1 4.47Å; I169-I220 HydrophobicContact CG2-CD1 3.42Å; I169-I220 VanDerWaalsContact CG2-CD1 3.42Å
170	D	88.9	Confident	89.8	Confident	135 Å²	135	80.7 Å²	80.7	72%	0.722	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-57.9	-29	-166.8	-55.1	-44.6	0	0	0	114.7	Y172	D170-Y172 VanDerWaalsContact C-N 3.32Å
171	D	89.3	Confident	89.7	Confident	37 Å²	37	76.6 Å²	76.6	20%	0.198	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-80.6	-10.1	178.6	-73.2	-62.5	0	0	0	113.9	R50 K52 W106 I169	R50-D171 HydrophobicContact CB-CB 4.4Å; R50-D171 WeakPolarHBondContact CD-OD1 3.22Å; R50-D171 IonicContact CZ-OD1 2.83Å; R50-D171 IonicContact NE-OD1 2.66Å; R50-D171 IonicContact NH1-OD1 2.75Å; R50-D171 PolarHBondContact NH1-OD1 2.88Å; K52-D171 VanDerWaalsContact CE-OD1 3.28Å; K52-D171 WeakPolarHBondContact CE-OD1 3.46Å; K52-D171 WeakPolarHBondContact CE-OD2 3.44Å; K52-D171 IonicContact NZ-OD1 3.16Å; K52-D171 PolarHBondContact NZ-OD1 3.24Å; K52-D171 IonicContact NZ-OD2 3.67Å; K52-D171 PolarHBondContact NZ-OD2 3.19Å; W106-D171 HydrophobicContact CH2-CB 4.14Å; W106-D171 WeakPolarHBondContact CH2-O 3.05Å; W106-D171 HydrophobicContact CZ2-CB 4.49Å; I169-D171 PolarHBondContact O-N 2.82Å; I169-D171 VanDerWaalsContact O-N 3.08Å
172	Y	89.9	Confident	89.6	Confident	21 Å²	21	70.2 Å²	70.2	8%	0.082	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-106.1	-1.2	-178.9	-45.4	-62.8	0	0	0	113.2	A48 W106 E168 I169 D170 F222 V227	A48-Y172 HydrophobicContact CB-CE1 4.46Å; A48-Y172 PolarHBondContact O-OH 3.08Å; W106-Y172 HydrophobicContact CH2-CE1 4.45Å; W106-Y172 HydrophobicContact CZ3-CD1 4.44Å; W106-Y172 HydrophobicContact CZ3-CE1 4.06Å; E168-Y172 WeakPolarHBondContact O-CE2 3.34Å; I169-Y172 PolarHBondContact O-N 2.92Å; D170-Y172 VanDerWaalsContact C-N 3.32Å; Y172-F222 HydrophobicContact CD1-CB 4.28Å; Y172-F222 AromaticContact CD1-CD1 3.87Å; Y172-F222 HydrophobicContact CD1-CD1 3.87Å; Y172-F222 HydrophobicContact CD1-CD2 4.29Å; Y172-F222 HydrophobicContact CD1-CE1 4.26Å; Y172-F222 AromaticContact CD1-CG 3.88Å; Y172-F222 HydrophobicContact CD1-CG 3.88Å; Y172-F222 HydrophobicContact CG-CG 4.41Å; Y172-F222 WeakPolarHBondContact O-CD2 3.29Å; Y172-V227 HydrophobicContact CD1-CG2 4.22Å; Y172-V227 HydrophobicContact CD2-CG1 4.23Å; Y172-V227 HydrophobicContact CE1-CG2 4.23Å; Y172-V227 HydrophobicContact CE2-CG1 3.96Å; Y172-V227 HydrophobicContact CG-CG2 4.4Å
173	V	88.7	Confident	89.5	Confident	36 Å²	36	68.6 Å²	68.6	22%	0.218	37%	0.374	C	S	.	.	S	Bend	trans	-117.6	132	-173.2	-175.9	0	0	0	0	110.1	I169 P179	I169-V173 HydrophobicContact CB-CG2 4.49Å; I169-V173 HydrophobicContact CD1-CG2 4.35Å; I169-V173 HydrophobicContact CG1-CG2 4.38Å; I169-V173 WeakPolarHBondContact O-CG2 3.34Å; V173-P179 HydrophobicContact CG1-CB 4.16Å; V173-P179 HydrophobicContact CG2-CB 3.78Å
174	E	83.3	Confident	89.5	Confident	121 Å²	121	67.2 Å²	67.2	57%	0.565	37%	0.367	S	S	*	.			trans	-69.9	131.2	179.6	-64.8	175.5	124.9	0	0	110.9	G176 K177	E174-G176 PolarHBondContact O-N 2.94Å; E174-G176 VanDerWaalsContact O-N 3.15Å; E174-K177 HydrophobicContact CB-CB 4.14Å; E174-K177 HydrophobicContact CB-CD 4.08Å; E174-K177 WeakPolarHBondContact O-CB 3.35Å; E174-K177 PolarHBondContact O-N 3.49Å; E174-K177 WeakPolarHBondContact OE2-CD 3.3Å; E174-K177 WeakPolarHBondContact OE2-CE 3.37Å; E174-K177 IonicContact OE2-NZ 3.56Å; E174-K177 PolarHBondContact OE2-NZ 2.99Å
175	P	81.5	Confident	89.5	Confident	139 Å²	139	68 Å²	68	90%	0.903	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	120.1	-177.3	-29.1	35.9	0	0	0	113.5
176	G	78.6	Confident	89.5	Confident	96 Å²	96	68.2 Å²	68.2	99%	0.99	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.1	4.8	-179	0	0	0	0	0	115.4	E174	E174-G176 PolarHBondContact O-N 2.94Å; E174-G176 VanDerWaalsContact O-N 3.15Å
177	K	84.3	Confident	89.5	Confident	130 Å²	130	69.5 Å²	69.5	57%	0.565	38%	0.378	S	S	*	.	S	Bend	trans	-104.8	145.3	173.7	-169.7	176.7	173.3	178.7	0	110.3	E174	E174-K177 HydrophobicContact CB-CB 4.14Å; E174-K177 HydrophobicContact CB-CD 4.08Å; E174-K177 WeakPolarHBondContact O-CB 3.35Å; E174-K177 PolarHBondContact O-N 3.49Å; E174-K177 WeakPolarHBondContact OE2-CD 3.3Å; E174-K177 WeakPolarHBondContact OE2-CE 3.37Å; E174-K177 IonicContact OE2-NZ 3.56Å; E174-K177 PolarHBondContact OE2-NZ 2.99Å
178	E	81.9	Confident	89.6	Confident	158 Å²	158	77.5 Å²	77.5	74%	0.738	41%	0.405	S	S	*	.			trans	-75.4	141.7	171.6	-66.5	-164.6	163	0	0	110.8
179	P	85.9	Confident	89.8	Confident	26 Å²	26	78.2 Å²	78.2	17%	0.169	42%	0.418	C	S	.	.			trans	-76.1	127	-178.5	31	-35.7	0	0	0	112	I169 V173 I181 D201	I169-P179 HydrophobicContact CD1-CB 4.21Å; I169-P179 HydrophobicContact CD1-CG 4.19Å; V173-P179 HydrophobicContact CG1-CB 4.16Å; V173-P179 HydrophobicContact CG2-CB 3.78Å; P179-I181 HydrophobicContact CB-CD1 3.87Å; P179-I181 HydrophobicContact CB-CG1 4.07Å; P179-I181 HydrophobicContact CG-CD1 3.77Å; P179-I181 HydrophobicContact CG-CG1 4.45Å; P179-I181 PolarHBondContact O-N 2.85Å; P179-D201 HydrophobicContact CG-CB 4.49Å
180	E	89	Confident	89.8	Confident	179 Å²	179	82.2 Å²	82.2	84%	0.836	44%	0.435	S	S	*	.			trans	-79.8	86.6	172.9	-170.4	167.5	-167	0	0	109.8
181	I	93.1	Very high	90	Very high	8 Å²	8	85.6 Å²	85.6	4%	0.041	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	133.7	-179.7	-66.6	156.1	0	0	0	110.4	C166 I169 P179 W183 Q198 C218 E219 I220	C166-I181 HydrophobicContact CB-CD1 4.08Å; I169-I181 HydrophobicContact CD1-CD1 4.01Å; P179-I181 HydrophobicContact CB-CD1 3.87Å; P179-I181 HydrophobicContact CB-CG1 4.07Å; P179-I181 HydrophobicContact CG-CD1 3.77Å; P179-I181 HydrophobicContact CG-CG1 4.45Å; P179-I181 PolarHBondContact O-N 2.85Å; I181-W183 HydrophobicContact CG2-CD2 4.4Å; I181-W183 HydrophobicContact CG2-CG 4.27Å; I181-Q198 PolarHBondContact O-NE2 3Å; I181-Q198 PolarHBondContact O-OE1 3.45Å; I181-C218 HydrophobicContact CG2-CB 3.61Å; I181-E219 WeakPolarHBondContact CA-O 3.37Å; I181-I220 HydrophobicContact CB-CG1 4.47Å; I181-I220 HydrophobicContact CD1-CD1 4.29Å; I181-I220 HydrophobicContact CG1-CD1 3.75Å; I181-I220 HydrophobicContact CG1-CG1 3.53Å
182	T	94.3	Very high	90.2	Very high	71 Å²	71	87.2 Å²	87.2	44%	0.436	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	131	164.5	-58.6	0	0	0	0	110.3	Y184 C218 E219	T182-Y184 HydrophobicContact CG2-CD2 4.28Å; T182-Y184 HydrophobicContact CG2-CE2 3.48Å; T182-Y184 VanDerWaalsContact CG2-CE2 3.48Å; T182-C218 CarbonylContact O-C 3.53Å; T182-C218 WeakPolarHBondContact O-CA 3.4Å; T182-E219 PolarHBondContact N-O 2.76Å; T182-E219 PolarHBondContact O-N 3.31Å
183	W	95.8	Very high	90.4	Very high	9 Å²	9	89.9 Å²	89.9	3%	0.034	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	135.4	178.4	-72.7	92.3	0	0	0	112.6	I164 C166 I181 W192 L203 T217 C218	I164-W183 HydrophobicContact CB-CH2 4.28Å; I164-W183 HydrophobicContact CB-CZ3 4.48Å; I164-W183 HydrophobicContact CG2-CH2 3.76Å; I164-W183 HydrophobicContact CG2-CZ3 3.91Å; C166-W183 HydrophobicContact CB-CH2 4.01Å; C166-W183 HydrophobicContact CB-CZ2 3.84Å; I181-W183 HydrophobicContact CG2-CD2 4.4Å; I181-W183 HydrophobicContact CG2-CG 4.27Å; W183-W192 HydrophobicContact CB-CZ2 3.78Å; W183-L203 HydrophobicContact CD2-CB 4.02Å; W183-L203 HydrophobicContact CD2-CD2 4.16Å; W183-L203 HydrophobicContact CE3-CB 4.4Å; W183-L203 HydrophobicContact CE3-CD2 4.15Å; W183-L203 HydrophobicContact CG-CB 4.48Å; W183-L203 HydrophobicContact CG-CD1 4.4Å; W183-L203 HydrophobicContact CG-CD2 4.36Å; W183-L203 HydrophobicContact CH2-CB 4.41Å; W183-L203 HydrophobicContact CZ2-CB 4.02Å; W183-T217 WeakPolarHBondContact CA-O 3.39Å; W183-C218 HydrophobicContact CD2-CB 3.87Å; W183-C218 HydrophobicContact CE3-CB 3.76Å; W183-C218 HydrophobicContact CH2-CB 3.73Å; W183-C218 HydrophobicContact CZ2-CB 3.83Å; W183-C218 HydrophobicContact CZ3-CB 3.69Å
184	Y	96.1	Very high	90.6	Very high	47 Å²	47	93.1 Å²	93.1	18%	0.184	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	154.3	178.7	-58.7	-106.7	0	0	0	109.9	T182 P189 Y216 T217 E219	T182-Y184 HydrophobicContact CG2-CD2 4.28Å; T182-Y184 HydrophobicContact CG2-CE2 3.48Å; T182-Y184 VanDerWaalsContact CG2-CE2 3.48Å; Y184-P189 HydrophobicContact CD1-CG 4.12Å; Y184-P189 HydrophobicContact CE1-CG 3.92Å; Y184-Y216 WeakPolarHBondContact O-CA 3.43Å; Y184-T217 PolarHBondContact N-O 2.99Å; Y184-T217 PolarHBondContact O-N 3.01Å; Y184-E219 HydrophobicContact CD2-CB 4.4Å; Y184-E219 HydrophobicContact CE2-CB 3.76Å; Y184-E219 PolarHBondContact OH-OE1 2.59Å; Y184-E219 VanDerWaalsContact OH-OE1 3.13Å
185	K	95.9	Very high	91.1	Very high	16 Å²	16	89.2 Å²	89.2	7%	0.07	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	134.6	165.1	179.9	166.6	-175.9	165.9	0	110	C187 R188 K190 W192 D211 D212 I213 N215 Y216	K185-C187 PolarHBondContact O-N 3.1Å; K185-R188 PolarHBondContact N-O 3.16Å; K185-R188 PolarHBondContact O-N 3.27Å; K185-K190 HydrophobicContact CB-CB 4.37Å; K185-K190 HydrophobicContact CB-CD 3.99Å; K185-K190 HydrophobicContact CD-CD 4.16Å; K185-K190 HydrophobicContact CG-CD 4.48Å; K185-W192 HydrophobicContact CB-CH2 4.02Å; K185-W192 HydrophobicContact CB-CZ3 4.44Å; K185-D211 PolarHBondContact NZ-O 3.27Å; K185-D212 PolarHBondContact NZ-O 3.45Å; K185-I213 WeakPolarHBondContact CE-O 3.48Å; K185-I213 VanDerWaalsContact NZ-C 3.35Å; K185-I213 PolarHBondContact NZ-O 3.13Å; K185-N215 WeakPolarHBondContact CA-O 3.49Å; K185-Y216 HydrophobicContact CD-CE1 4.17Å; K185-Y216 HydrophobicContact CD-CE2 4.04Å; K185-Y216 PolarHBondContact NZ-OH 3.46Å
186	E	95.5	Very high	91.7	Very high	71 Å²	71	83.1 Å²	83.1	33%	0.332	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.1	45.9	-168.6	-45.7	-33.2	127.9	0	0	111.9	R188 G214 N215	E186-R188 WeakPolarHBondContact O-CG 3.32Å; E186-R188 PolarHBondContact O-N 2.88Å; E186-G214 VanDerWaalsContact OE1-CA 3.23Å; E186-G214 WeakPolarHBondContact OE1-CA 3.49Å; E186-N215 PolarHBondContact N-O 3.09Å; E186-N215 PolarHBondContact OE1-N 2.94Å; E186-N215 WeakPolarHBondContact OE2-CB 3.35Å; E186-N215 PolarHBondContact OE2-N 3.19Å; E186-N215 PolarHBondContact OE2-ND2 2.8Å
187	C	95.5	Very high	92.5	Very high	29 Å²	29	82.1 Å²	82.1	20%	0.196	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	19.7	-177.3	-63.8	0	0	0	0	116.1	C145 Y146 K185	C145-C187 VanDerWaalsContact CA-SG 3.55Å; C145-C187 HydrophobicContact CB-CB 3.66Å; C145-C187 WeakPolarHBondContact CB-SG 3.44Å; C145-C187 PolarHBondContact N-SG 3.46Å; C145-C187 WeakPolarHBondContact SG-CA 3.43Å; C145-C187 WeakPolarHBondContact SG-CB 3.3Å; C145-C187 CovalentContact SG-SG 2.04Å; C145-C187 PolarHBondContact SG-SG 3.24Å; Y146-C187 WeakPolarHBondContact CD1-SG 3.29Å; Y146-C187 VanDerWaalsContact CE1-SG 3.51Å; K185-C187 PolarHBondContact O-N 3.1Å
188	R	94.9	Very high	92.9	Very high	190 Å²	190	79.8 Å²	79.8	72%	0.717	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.8	142.5	-179.5	-67.1	171	-171.5	-170.3	2	111	K185 E186 K190	K185-R188 PolarHBondContact N-O 3.16Å; K185-R188 PolarHBondContact O-N 3.27Å; E186-R188 WeakPolarHBondContact O-CG 3.32Å; E186-R188 PolarHBondContact O-N 2.88Å; R188-K190 PolarHBondContact O-N 3.48Å
189	P	93.1	Very high	93.3	Very high	113 Å²	113	79.9 Å²	79.9	73%	0.734	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.1	120.5	171.9	-22.7	33.1	0	0	0	110.5	Y184	Y184-P189 HydrophobicContact CD1-CG 4.12Å; Y184-P189 HydrophobicContact CE1-CG 3.92Å
190	K	90.9	Very high	93.5	Very high	95 Å²	95	79.4 Å²	79.4	41%	0.413	39%	0.385	S	S	.	.			trans	-111.2	133	-179.5	-170.5	167.4	-176.9	175	0	110.5	K185 R188 W192	K185-K190 HydrophobicContact CB-CB 4.37Å; K185-K190 HydrophobicContact CB-CD 3.99Å; K185-K190 HydrophobicContact CD-CD 4.16Å; K185-K190 HydrophobicContact CG-CD 4.48Å; R188-K190 PolarHBondContact O-N 3.48Å; K190-W192 HydrophobicContact CB-CH2 4.28Å; K190-W192 HydrophobicContact CB-CZ2 4.43Å; K190-W192 HydrophobicContact CB-CZ3 4.35Å; K190-W192 HydrophobicContact CD-CE3 4.48Å; K190-W192 HydrophobicContact CD-CZ3 4.1Å; K190-W192 HydrophobicContact CG-CE3 4.5Å; K190-W192 HydrophobicContact CG-CZ3 4.42Å; K190-W192 PolarHBondContact O-N 2.92Å
191	K	92	Very high	93.6	Very high	206 Å²	206	73.7 Å²	73.7	90%	0.896	36%	0.36	S	S	*	.			trans	-73.8	109.1	165.8	-69.5	-173.5	177.7	-178.6	0	108.3
192	W	93.7	Very high	93.7	Very high	71 Å²	71	75.8 Å²	75.8	27%	0.269	37%	0.369	S	S	.	.			trans	-65.5	144.6	179.2	-55.8	114.8	0	0	0	111.6	W183 K185 K190 I196 L203 Y216	W183-W192 HydrophobicContact CB-CZ2 3.78Å; K185-W192 HydrophobicContact CB-CH2 4.02Å; K185-W192 HydrophobicContact CB-CZ3 4.44Å; K190-W192 HydrophobicContact CB-CH2 4.28Å; K190-W192 HydrophobicContact CB-CZ2 4.43Å; K190-W192 HydrophobicContact CB-CZ3 4.35Å; K190-W192 HydrophobicContact CD-CE3 4.48Å; K190-W192 HydrophobicContact CD-CZ3 4.1Å; K190-W192 HydrophobicContact CG-CE3 4.5Å; K190-W192 HydrophobicContact CG-CZ3 4.42Å; K190-W192 PolarHBondContact O-N 2.92Å; W192-I196 HydrophobicContact CB-CB 4.29Å; W192-I196 HydrophobicContact CB-CG2 4.25Å; W192-I196 HydrophobicContact CD2-CG2 4.16Å; W192-I196 HydrophobicContact CE3-CD1 4.38Å; W192-I196 HydrophobicContact CE3-CG2 3.93Å; W192-I196 HydrophobicContact CG-CG2 4.29Å; W192-L203 HydrophobicContact CH2-CD2 4.01Å; W192-L203 HydrophobicContact CZ2-CD2 4.18Å; W192-L203 HydrophobicContact CZ3-CD2 4.32Å; W192-Y216 AromaticContact CH2-CD1 3.92Å; W192-Y216 HydrophobicContact CH2-CD1 3.92Å; W192-Y216 AromaticContact CH2-CE1 3.75Å; W192-Y216 HydrophobicContact CH2-CE1 3.75Å; W192-Y216 HydrophobicContact CZ3-CD1 4.31Å; W192-Y216 AromaticContact CZ3-CE1 3.67Å; W192-Y216 HydrophobicContact CZ3-CE1 3.67Å
193	R	94.4	Very high	93.8	Very high	77 Å²	77	72.4 Å²	72.4	29%	0.291	35%	0.348	S	S	.	.			trans	-74.9	154.3	170.4	67.3	175.7	-172.7	-95	-6.6	109.5	T195 I196 E207 D212	R193-T195 PolarHBondContact NE-OG1 3.39Å; R193-T195 PolarHBondContact O-N 2.88Å; R193-I196 HydrophobicContact CG-CD1 4.05Å; R193-I196 HydrophobicContact CG-CG1 4.02Å; R193-I196 PolarHBondContact O-N 3.14Å; R193-I196 VanDerWaalsContact O-O 3.1Å; R193-E207 PolarHBondContact NH2-O 2.85Å; R193-D212 IonicContact CZ-OD1 2.77Å; R193-D212 IonicContact CZ-OD2 3.19Å; R193-D212 IonicContact NH1-OD1 3.73Å; R193-D212 PolarHBondContact NH1-OD1 3.26Å; R193-D212 IonicContact NH1-OD2 3.71Å; R193-D212 PolarHBondContact NH1-OD2 3.36Å; R193-D212 IonicContact NH2-OD1 3.15Å; R193-D212 PolarHBondContact NH2-OD1 2.95Å; R193-D212 IonicContact NH2-OD2 2.69Å; R193-D212 PolarHBondContact NH2-OD2 3.23Å
194	A	92.2	Very high	93.8	Very high	104 Å²	104	74.5 Å²	74.5	86%	0.86	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-18.6	-174.1	0	0	0	0	0	115.8	I196	A194-I196 VanDerWaalsContact C-N 3.31Å
195	T	93.9	Very high	93.9	Very high	39 Å²	39	72.3 Å²	72.3	24%	0.239	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	0.5	174.3	74	0	0	0	0	113.8	R193 Q206	R193-T195 PolarHBondContact NE-OG1 3.39Å; R193-T195 PolarHBondContact O-N 2.88Å; T195-Q206 WeakPolarHBondContact O-CB 3.09Å; T195-Q206 PolarHBondContact O-N 2.84Å
196	I	95.8	Very high	93.9	Very high	10 Å²	10	76.6 Å²	76.6	5%	0.051	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.1	175.3	-61.1	177.1	0	0	0	107.8	W192 R193 A194 L203 F204 F205	W192-I196 HydrophobicContact CB-CB 4.29Å; W192-I196 HydrophobicContact CB-CG2 4.25Å; W192-I196 HydrophobicContact CD2-CG2 4.16Å; W192-I196 HydrophobicContact CE3-CD1 4.38Å; W192-I196 HydrophobicContact CE3-CG2 3.93Å; W192-I196 HydrophobicContact CG-CG2 4.29Å; R193-I196 HydrophobicContact CG-CD1 4.05Å; R193-I196 HydrophobicContact CG-CG1 4.02Å; R193-I196 PolarHBondContact O-N 3.14Å; R193-I196 VanDerWaalsContact O-O 3.1Å; A194-I196 VanDerWaalsContact C-N 3.31Å; I196-L203 HydrophobicContact CG2-CD1 3.76Å; I196-L203 HydrophobicContact CG2-CD2 4.48Å; I196-L203 HydrophobicContact CG2-CG 4.03Å; I196-F204 VanDerWaalsContact CA-O 3.24Å; I196-F204 WeakPolarHBondContact CA-O 3.13Å; I196-F205 HydrophobicContact CD1-CD1 3.7Å; I196-F205 HydrophobicContact CD1-CE1 3.68Å; I196-F205 HydrophobicContact CG1-CD1 3.83Å; I196-F205 HydrophobicContact CG1-CE1 4.24Å; I196-F205 HydrophobicContact CG1-CG 4.4Å
197	F	94.3	Very high	93.9	Very high	76 Å²	76	76.6 Å²	76.6	33%	0.333	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	146.6	-179.9	59.1	-93.1	0	0	0	111.8	F204	F197-F204 HydrophobicContact CD2-CB 4.07Å; F197-F204 HydrophobicContact CD2-CD2 4.44Å; F197-F204 HydrophobicContact CE1-CB 4.25Å; F197-F204 HydrophobicContact CE2-CB 3.68Å; F197-F204 HydrophobicContact CE2-CD2 4.04Å; F197-F204 AromaticContact CE2-CG 3.92Å; F197-F204 HydrophobicContact CE2-CG 3.92Å; F197-F204 HydrophobicContact CG-CB 4.5Å; F197-F204 HydrophobicContact CZ-CB 3.77Å; F197-F204 HydrophobicContact CZ-CG 4.26Å; F197-F204 PolarHBondContact N-O 3.05Å; F197-F204 VanDerWaalsContact N-O 3.07Å; F197-F204 WeakPolarHBondContact O-CB 3.35Å; F197-F204 PolarHBondContact O-N 2.67Å
198	Q	92.8	Very high	93.9	Very high	80 Å²	80	75.2 Å²	75.2	37%	0.374	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	147.1	172.5	-178.8	175.3	-13.2	0	0	110.5	I181 K202	I181-Q198 PolarHBondContact O-NE2 3Å; I181-Q198 PolarHBondContact O-OE1 3.45Å; Q198-K202 WeakPolarHBondContact CA-O 3.35Å
199	R	91	Very high	94	Very high	161 Å²	161	70 Å²	70	61%	0.608	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-153	112.9	167.5	177.3	-178.1	-61.9	172.4	2.3	108.5	D201 K202 F204	R199-D201 PolarHBondContact O-N 3.22Å; R199-K202 PolarHBondContact N-O 2.94Å; R199-K202 PolarHBondContact O-N 3.01Å; R199-F204 HydrophobicContact CB-CD2 4.06Å; R199-F204 HydrophobicContact CB-CE2 3.86Å
200	G	89.6	Confident	94	Very high	16 Å²	16	69.3 Å²	69.3	17%	0.165	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	-127.7	-173.7	0	0	0	0	0	112.1	K202	G200-K202 PolarHBondContact O-N 3.09Å
201	D	91.5	Very high	94.2	Very high	58 Å²	58	71 Å²	71	31%	0.31	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-4.1	-179.2	61.4	-25.4	0	0	0	115.3	L165 C166 I169 P179 R199	L165-D201 HydrophobicContact CD1-CB 4.01Å; L165-D201 WeakPolarHBondContact CD1-OD2 3.32Å; C166-D201 WeakPolarHBondContact CB-O 3.48Å; C166-D201 PolarHBondContact N-O 3.31Å; I169-D201 HydrophobicContact CD1-CB 3.86Å; P179-D201 HydrophobicContact CG-CB 4.49Å; R199-D201 PolarHBondContact O-N 3.22Å
202	K	94.8	Very high	94.4	Very high	53 Å²	53	61.2 Å²	61.2	23%	0.23	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	142.9	-161.9	-73.7	160.6	-177.3	-165.4	0	114.9	H163 I164 L165 Q198 R199 G200 F204	H163-K202 VanDerWaalsContact CD2-CD 3.48Å; H163-K202 WeakPolarHBondContact CD2-CD 3.28Å; I164-K202 WeakPolarHBondContact O-CA 3.4Å; L165-K202 HydrophobicContact CB-CG 4.38Å; L165-K202 HydrophobicContact CD1-CG 4.08Å; Q198-K202 WeakPolarHBondContact CA-O 3.35Å; R199-K202 PolarHBondContact N-O 2.94Å; R199-K202 PolarHBondContact O-N 3.01Å; G200-K202 PolarHBondContact O-N 3.09Å; K202-F204 HydrophobicContact CB-CD2 4.06Å; K202-F204 HydrophobicContact CB-CE2 3.48Å; K202-F204 VanDerWaalsContact CB-CE2 3.48Å; K202-F204 HydrophobicContact CB-CZ 4.03Å; K202-F204 HydrophobicContact CD-CE2 4.37Å; K202-F204 HydrophobicContact CD-CZ 4.11Å
203	L	95.7	Very high	94.5	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	108	169.8	-172.9	67.3	0	0	0	109.3	H163 I164 W183 W192 I196 F205 Y216	H163-L203 CarbonylContact C-O 3.58Å; H163-L203 VanDerWaalsContact CA-O 3.23Å; H163-L203 WeakPolarHBondContact CA-O 3.35Å; I164-L203 PolarHBondContact N-O 3.22Å; I164-L203 PolarHBondContact O-N 3.21Å; W183-L203 HydrophobicContact CD2-CB 4.02Å; W183-L203 HydrophobicContact CD2-CD2 4.16Å; W183-L203 HydrophobicContact CE3-CB 4.4Å; W183-L203 HydrophobicContact CE3-CD2 4.15Å; W183-L203 HydrophobicContact CG-CB 4.48Å; W183-L203 HydrophobicContact CG-CD1 4.4Å; W183-L203 HydrophobicContact CG-CD2 4.36Å; W183-L203 HydrophobicContact CH2-CB 4.41Å; W183-L203 HydrophobicContact CZ2-CB 4.02Å; W192-L203 HydrophobicContact CH2-CD2 4.01Å; W192-L203 HydrophobicContact CZ2-CD2 4.18Å; W192-L203 HydrophobicContact CZ3-CD2 4.32Å; I196-L203 HydrophobicContact CG2-CD1 3.76Å; I196-L203 HydrophobicContact CG2-CD2 4.48Å; I196-L203 HydrophobicContact CG2-CG 4.03Å; L203-F205 HydrophobicContact CD2-CE2 4.2Å; L203-F205 HydrophobicContact CD2-CZ 4.16Å; L203-F205 HydrophobicContact CG-CE2 4.15Å; L203-F205 WeakPolarHBondContact O-CD2 3.36Å; L203-Y216 HydrophobicContact CD2-CD1 3.61Å; L203-Y216 HydrophobicContact CD2-CE1 3.88Å
204	F	96.8	Very high	94.6	Very high	52 Å²	52	58.3 Å²	58.3	23%	0.228	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	139.3	-176.3	-73.1	-93.1	0	0	0	112.4	H163 I196 F197 R199 K202	H163-F204 HydrophobicContact CB-CD1 3.63Å; H163-F204 HydrophobicContact CB-CE1 3.83Å; H163-F204 HydrophobicContact CB-CG 4.04Å; H163-F204 HydrophobicContact CB-CZ 4.4Å; H163-F204 AromaticContact CG-CE1 3.95Å; I196-F204 VanDerWaalsContact CA-O 3.24Å; I196-F204 WeakPolarHBondContact CA-O 3.13Å; F197-F204 HydrophobicContact CD2-CB 4.07Å; F197-F204 HydrophobicContact CD2-CD2 4.44Å; F197-F204 HydrophobicContact CE1-CB 4.25Å; F197-F204 HydrophobicContact CE2-CB 3.68Å; F197-F204 HydrophobicContact CE2-CD2 4.04Å; F197-F204 AromaticContact CE2-CG 3.92Å; F197-F204 HydrophobicContact CE2-CG 3.92Å; F197-F204 HydrophobicContact CG-CB 4.5Å; F197-F204 HydrophobicContact CZ-CB 3.77Å; F197-F204 HydrophobicContact CZ-CG 4.26Å; F197-F204 PolarHBondContact N-O 3.05Å; F197-F204 VanDerWaalsContact N-O 3.07Å; F197-F204 WeakPolarHBondContact O-CB 3.35Å; F197-F204 PolarHBondContact O-N 2.67Å; R199-F204 HydrophobicContact CB-CD2 4.06Å; R199-F204 HydrophobicContact CB-CE2 3.86Å; K202-F204 HydrophobicContact CB-CD2 4.06Å; K202-F204 HydrophobicContact CB-CE2 3.48Å; K202-F204 VanDerWaalsContact CB-CE2 3.48Å; K202-F204 HydrophobicContact CB-CZ 4.03Å; K202-F204 HydrophobicContact CD-CE2 4.37Å; K202-F204 HydrophobicContact CD-CZ 4.11Å
205	F	97.4	Very high	94.8	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.009	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	112.8	173.6	-60.7	-110.3	0	0	0	108.2	R161 F162 I164 I196 L203 E207 V208 D212 Y216 L233	R161-F205 WeakPolarHBondContact CA-O 3.49Å; F162-F205 HydrophobicContact CB-CB 4.32Å; F162-F205 HydrophobicContact CD1-CD2 4.37Å; F162-F205 PolarHBondContact N-O 3.03Å; F162-F205 PolarHBondContact O-N 3.15Å; I164-F205 HydrophobicContact CD1-CE2 3.83Å; I164-F205 HydrophobicContact CD1-CZ 3.93Å; I164-F205 HydrophobicContact CG1-CE2 3.9Å; I164-F205 HydrophobicContact CG1-CZ 4.48Å; I196-F205 HydrophobicContact CD1-CD1 3.7Å; I196-F205 HydrophobicContact CD1-CE1 3.68Å; I196-F205 HydrophobicContact CG1-CD1 3.83Å; I196-F205 HydrophobicContact CG1-CE1 4.24Å; I196-F205 HydrophobicContact CG1-CG 4.4Å; L203-F205 HydrophobicContact CD2-CE2 4.2Å; L203-F205 HydrophobicContact CD2-CZ 4.16Å; L203-F205 HydrophobicContact CG-CE2 4.15Å; L203-F205 WeakPolarHBondContact O-CD2 3.36Å; F205-E207 VanDerWaalsContact C-N 3.3Å; F205-V208 HydrophobicContact CB-CG2 3.92Å; F205-V208 HydrophobicContact CG-CG2 4.43Å; F205-D212 HydrophobicContact CD1-CB 4.42Å; F205-D212 HydrophobicContact CE1-CB 4.03Å; F205-Y216 HydrophobicContact CE1-CE1 4.17Å; F205-Y216 HydrophobicContact CZ-CD1 4.31Å; F205-Y216 AromaticContact CZ-CE1 3.59Å; F205-Y216 HydrophobicContact CZ-CE1 3.59Å; F205-Y216 AromaticContact CZ-CZ 3.74Å; F205-L233 HydrophobicContact CE1-CD2 4.2Å; F205-L233 HydrophobicContact CZ-CD2 4.05Å
206	Q	95.7	Very high	95	Very high	105 Å²	105	52.4 Å²	52.4	49%	0.491	25%	0.249	S	C	.	.	S	Bend	trans	-72.8	-25.9	177.6	-177.2	177.9	-6.7	0	0	112.6	R161 T195	R161-Q206 VanDerWaalsContact CG-O 3.29Å; R161-Q206 WeakPolarHBondContact CG-O 3.22Å; T195-Q206 WeakPolarHBondContact O-CB 3.09Å; T195-Q206 PolarHBondContact O-N 2.84Å
207	E	95.2	Very high	95	Very high	72 Å²	72	52 Å²	52	34%	0.336	25%	0.247	S	C	.	.	S	Bend	trans	-153.2	117.1	176.5	-180	-172.2	-135.4	0	0	107.1	K160 R193 F205 K209	K160-E207 WeakPolarHBondContact O-CA 3.37Å; R193-E207 PolarHBondContact NH2-O 2.85Å; F205-E207 VanDerWaalsContact C-N 3.3Å; E207-K209 IonicContact OE1-NZ 3.87Å; E207-K209 WeakPolarHBondContact OE2-CE 3.46Å; E207-K209 IonicContact OE2-NZ 2.8Å; E207-K209 PolarHBondContact OE2-NZ 3.19Å
208	V	96.8	Very high	95.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.232	C	C	.	.			trans	-81	139.1	176.9	174.6	0	0	0	0	110.8	A156 S159 K160 F162 F205 V235	A156-V208 HydrophobicContact CB-CG1 4.26Å; A156-V208 HydrophobicContact CB-CG2 4.33Å; S159-V208 PolarHBondContact N-O 3.03Å; K160-V208 PolarHBondContact O-N 3.04Å; F162-V208 HydrophobicContact CB-CG2 3.51Å; F205-V208 HydrophobicContact CB-CG2 3.92Å; F205-V208 HydrophobicContact CG-CG2 4.43Å; V208-V235 HydrophobicContact CG1-CB 4.44Å; V208-V235 HydrophobicContact CG1-CG1 3.84Å; V208-V235 HydrophobicContact CG1-CG2 3.71Å
209	K	95.6	Very high	95.2	Very high	80 Å²	80	46.3 Å²	46.3	35%	0.348	22%	0.222	S	C	.	.			trans	-129.2	162.2	178.9	-54.6	-164.7	-175.3	-144.3	0	110.9	E207 D211 D212	E207-K209 IonicContact OE1-NZ 3.87Å; E207-K209 WeakPolarHBondContact OE2-CE 3.46Å; E207-K209 IonicContact OE2-NZ 2.8Å; E207-K209 PolarHBondContact OE2-NZ 3.19Å; K209-D211 PolarHBondContact O-N 2.93Å; K209-D212 PolarHBondContact N-OD2 3.42Å; K209-D212 WeakPolarHBondContact O-CA 3.18Å; K209-D212 VanDerWaalsContact O-CB 3.23Å; K209-D212 WeakPolarHBondContact O-CB 3.29Å; K209-D212 PolarHBondContact O-N 3.33Å
210	E	95.1	Very high	95.3	Very high	99 Å²	99	39 Å²	39	46%	0.463	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-57.9	-36.6	176.6	-166.4	173.2	-173.1	0	0	112.3	D212 I213 H311 L312	E210-D212 PolarHBondContact O-N 3.31Å; E210-I213 HydrophobicContact CG-CD1 3.9Å; E210-I213 WeakPolarHBondContact O-CB 3.38Å; E210-I213 VanDerWaalsContact O-CG1 3.26Å; E210-I213 WeakPolarHBondContact O-CG1 3.41Å; E210-I213 PolarHBondContact O-N 3.4Å; E210-H311 IonicContact OE1-CE1 2.93Å; E210-H311 PolarHBondContact OE1-CE1 3.23Å; E210-L312 HydrophobicContact CG-CD2 4.29Å
211	D	94	Very high	95.4	Very high	130 Å²	130	44.1 Å²	44.1	70%	0.695	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-57.9	-14	171.3	-64	-31.8	0	0	0	114.9	K185 K209	K185-D211 PolarHBondContact NZ-O 3.27Å; K209-D211 PolarHBondContact O-N 2.93Å
212	D	95.8	Very high	95.3	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-82.8	-14	175.4	-61	-44.4	0	0	0	112.8	K185 R193 F205 K209 E210 G214 Y216 L233	K185-D212 PolarHBondContact NZ-O 3.45Å; R193-D212 IonicContact CZ-OD1 2.77Å; R193-D212 IonicContact CZ-OD2 3.19Å; R193-D212 IonicContact NH1-OD1 3.73Å; R193-D212 PolarHBondContact NH1-OD1 3.26Å; R193-D212 IonicContact NH1-OD2 3.71Å; R193-D212 PolarHBondContact NH1-OD2 3.36Å; R193-D212 IonicContact NH2-OD1 3.15Å; R193-D212 PolarHBondContact NH2-OD1 2.95Å; R193-D212 IonicContact NH2-OD2 2.69Å; R193-D212 PolarHBondContact NH2-OD2 3.23Å; F205-D212 HydrophobicContact CD1-CB 4.42Å; F205-D212 HydrophobicContact CE1-CB 4.03Å; K209-D212 PolarHBondContact N-OD2 3.42Å; K209-D212 WeakPolarHBondContact O-CA 3.18Å; K209-D212 VanDerWaalsContact O-CB 3.23Å; K209-D212 WeakPolarHBondContact O-CB 3.29Å; K209-D212 PolarHBondContact O-N 3.33Å; E210-D212 PolarHBondContact O-N 3.31Å; D212-G214 PolarHBondContact O-N 3.23Å; D212-Y216 WeakPolarHBondContact O-CE2 3.39Å; D212-Y216 PolarHBondContact O-OH 3.33Å; D212-L233 HydrophobicContact CB-CD2 4.12Å
213	I	96.8	Very high	94.8	Very high	77 Å²	77	44.8 Å²	44.8	40%	0.395	24%	0.236	S	C	.	.			trans	-54.6	130.7	172.3	-64.6	169.4	0	0	0	110.7	K185 E210 L233 V235 L312	K185-I213 WeakPolarHBondContact CE-O 3.48Å; K185-I213 VanDerWaalsContact NZ-C 3.35Å; K185-I213 PolarHBondContact NZ-O 3.13Å; E210-I213 HydrophobicContact CG-CD1 3.9Å; E210-I213 WeakPolarHBondContact O-CB 3.38Å; E210-I213 VanDerWaalsContact O-CG1 3.26Å; E210-I213 WeakPolarHBondContact O-CG1 3.41Å; E210-I213 PolarHBondContact O-N 3.4Å; I213-L233 WeakPolarHBondContact CA-O 3.42Å; I213-V235 HydrophobicContact CD1-CB 4.09Å; I213-V235 HydrophobicContact CG1-CB 3.58Å; I213-V235 HydrophobicContact CG1-CG2 3.57Å; I213-L312 HydrophobicContact CD1-CD2 4.35Å
214	G	95.9	Very high	94.3	Very high	10 Å²	10	48 Å²	48	10%	0.103	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	145.5	-171.9	175.4	0	0	0	0	0	115	E186 D212 Y216 L233	E186-G214 VanDerWaalsContact OE1-CA 3.23Å; E186-G214 WeakPolarHBondContact OE1-CA 3.49Å; D212-G214 PolarHBondContact O-N 3.23Å; G214-Y216 WeakPolarHBondContact O-CD2 3.23Å; G214-L233 PolarHBondContact N-O 3.37Å; G214-L233 PolarHBondContact O-N 3.25Å
215	N	97.2	Very high	94.1	Very high	17 Å²	17	48 Å²	48	9%	0.091	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	120.5	-172.1	-54.6	-88.7	0	0	0	110.8	Y146 R151 K185 E186 T230	Y146-N215 HydrophobicContact CE1-CB 3.83Å; Y146-N215 VanDerWaalsContact OH-CG 3.29Å; Y146-N215 PolarHBondContact OH-ND2 2.91Å; R151-N215 PolarHBondContact NH1-OD1 3.29Å; K185-N215 WeakPolarHBondContact CA-O 3.49Å; E186-N215 PolarHBondContact N-O 3.09Å; E186-N215 PolarHBondContact OE1-N 2.94Å; E186-N215 WeakPolarHBondContact OE2-CB 3.35Å; E186-N215 PolarHBondContact OE2-N 3.19Å; E186-N215 PolarHBondContact OE2-ND2 2.8Å; N215-T230 HydrophobicContact CB-CG2 4.08Å
216	Y	97.2	Very high	93.8	Very high	1 Å²	1	49.9 Å²	49.9	0%	0.004	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	115.4	179.1	-71.3	-103.1	0	0	0	109.9	I164 Y184 K185 W192 L203 F205 D212 G214 T230 T231 L233	I164-Y216 HydrophobicContact CD1-CD1 3.78Å; I164-Y216 HydrophobicContact CD1-CD2 3.65Å; I164-Y216 HydrophobicContact CD1-CE1 4.31Å; I164-Y216 HydrophobicContact CD1-CE2 4.24Å; I164-Y216 HydrophobicContact CD1-CG 3.41Å; I164-Y216 VanDerWaalsContact CD1-CG 3.41Å; Y184-Y216 WeakPolarHBondContact O-CA 3.43Å; K185-Y216 HydrophobicContact CD-CE1 4.17Å; K185-Y216 HydrophobicContact CD-CE2 4.04Å; K185-Y216 PolarHBondContact NZ-OH 3.46Å; W192-Y216 AromaticContact CH2-CD1 3.92Å; W192-Y216 HydrophobicContact CH2-CD1 3.92Å; W192-Y216 AromaticContact CH2-CE1 3.75Å; W192-Y216 HydrophobicContact CH2-CE1 3.75Å; W192-Y216 HydrophobicContact CZ3-CD1 4.31Å; W192-Y216 AromaticContact CZ3-CE1 3.67Å; W192-Y216 HydrophobicContact CZ3-CE1 3.67Å; L203-Y216 HydrophobicContact CD2-CD1 3.61Å; L203-Y216 HydrophobicContact CD2-CE1 3.88Å; F205-Y216 HydrophobicContact CE1-CE1 4.17Å; F205-Y216 HydrophobicContact CZ-CD1 4.31Å; F205-Y216 AromaticContact CZ-CE1 3.59Å; F205-Y216 HydrophobicContact CZ-CE1 3.59Å; F205-Y216 AromaticContact CZ-CZ 3.74Å; D212-Y216 WeakPolarHBondContact O-CE2 3.39Å; D212-Y216 PolarHBondContact O-OH 3.33Å; G214-Y216 WeakPolarHBondContact O-CD2 3.23Å; Y216-T230 WeakPolarHBondContact O-CA 3.43Å; Y216-T231 PolarHBondContact N-O 2.95Å; Y216-T231 PolarHBondContact O-N 2.91Å; Y216-L233 HydrophobicContact CD2-CB 3.86Å; Y216-L233 HydrophobicContact CE2-CB 3.79Å; Y216-L233 HydrophobicContact CE2-CD2 3.93Å
217	T	96.8	Very high	93.8	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	124.3	178.6	-52.8	0	0	0	0	109.4	C145 W183 Y184 R228 R229 T230	C145-T217 PolarHBondContact SG-OG1 3.44Å; W183-T217 WeakPolarHBondContact CA-O 3.39Å; Y184-T217 PolarHBondContact N-O 2.99Å; Y184-T217 PolarHBondContact O-N 3.01Å; T217-R228 HydrophobicContact CG2-CB 4.01Å; T217-R228 HydrophobicContact CG2-CG 4.34Å; T217-R229 CarbonylContact C-O 3.59Å; T217-R229 WeakPolarHBondContact CA-O 3.48Å; T217-T230 WeakPolarHBondContact CB-OG1 3.42Å; T217-T230 WeakPolarHBondContact CG2-OG1 3.38Å; T217-T230 PolarHBondContact OG1-OG1 3.24Å
218	C	95.6	Very high	93.7	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.014	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	143.8	163.8	55.6	0	0	0	0	110.1	C166 I181 T182 W183 R228 R229	C166-C218 VanDerWaalsContact CA-SG 3.52Å; C166-C218 HydrophobicContact CB-CB 3.77Å; C166-C218 WeakPolarHBondContact CB-SG 3.42Å; C166-C218 WeakPolarHBondContact SG-CB 3.39Å; C166-C218 CovalentContact SG-SG 2.04Å; C166-C218 PolarHBondContact SG-SG 3.11Å; I181-C218 HydrophobicContact CG2-CB 3.61Å; T182-C218 CarbonylContact O-C 3.53Å; T182-C218 WeakPolarHBondContact O-CA 3.4Å; W183-C218 HydrophobicContact CD2-CB 3.87Å; W183-C218 HydrophobicContact CE3-CB 3.76Å; W183-C218 HydrophobicContact CH2-CB 3.73Å; W183-C218 HydrophobicContact CZ2-CB 3.83Å; W183-C218 HydrophobicContact CZ3-CB 3.69Å; C218-R228 VanDerWaalsContact O-CA 3.27Å; C218-R228 WeakPolarHBondContact O-CA 3.24Å; C218-R229 PolarHBondContact N-O 3.04Å; C218-R229 PolarHBondContact O-N 2.85Å; C218-R229 PolarHBondContact SG-O 3Å
219	E	94.9	Very high	93.6	Very high	35 Å²	35	47.2 Å²	47.2	16%	0.164	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	133	-179.4	-173.5	176.4	90.1	0	0	110.1	I181 T182 Y184 V226 V227 R228	I181-E219 WeakPolarHBondContact CA-O 3.37Å; T182-E219 PolarHBondContact N-O 2.76Å; T182-E219 PolarHBondContact O-N 3.31Å; Y184-E219 HydrophobicContact CD2-CB 4.4Å; Y184-E219 HydrophobicContact CE2-CB 3.76Å; Y184-E219 PolarHBondContact OH-OE1 2.59Å; Y184-E219 VanDerWaalsContact OH-OE1 3.13Å; E219-V226 HydrophobicContact CG-CG1 3.39Å; E219-V227 WeakPolarHBondContact CA-O 3.43Å; E219-R228 HydrophobicContact CB-CG 4.32Å; E219-R228 HydrophobicContact CG-CG 4.09Å; E219-R228 IonicContact OE2-CZ 3.48Å; E219-R228 IonicContact OE2-NE 3.37Å; E219-R228 PolarHBondContact OE2-NE 3.22Å; E219-R228 IonicContact OE2-NH2 2.65Å; E219-R228 PolarHBondContact OE2-NH2 3.49Å
220	I	93.9	Very high	93.6	Very high	8 Å²	8	43.9 Å²	43.9	4%	0.041	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	140	178.8	-68.1	174.5	0	0	0	109.6	I169 I181 V226 V227	I169-I220 HydrophobicContact CB-CD1 3.63Å; I169-I220 HydrophobicContact CD1-CD1 4.1Å; I169-I220 HydrophobicContact CG1-CD1 4.47Å; I169-I220 HydrophobicContact CG2-CD1 3.42Å; I169-I220 VanDerWaalsContact CG2-CD1 3.42Å; I181-I220 HydrophobicContact CB-CG1 4.47Å; I181-I220 HydrophobicContact CD1-CD1 4.29Å; I181-I220 HydrophobicContact CG1-CD1 3.75Å; I181-I220 HydrophobicContact CG1-CG1 3.53Å; I220-V226 WeakPolarHBondContact O-CA 3.5Å; I220-V227 PolarHBondContact N-O 2.84Å; I220-V227 PolarHBondContact O-N 3.1Å
221	Q	91	Very high	93.7	Very high	124 Å²	124	39.3 Å²	39.3	58%	0.579	23%	0.228	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	123.4	173.2	-168.2	81.7	79.8	0	0	110.4	F225	Q221-F225 PolarHBondContact NE2-O 3.11Å
222	F	89.1	Confident	93.9	Very high	50 Å²	50	35 Å²	35	22%	0.219	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	117	-179.8	173.4	-100.1	0	0	0	111.5	A48 W106 Y172 G224 F225	A48-F222 HydrophobicContact CB-CD1 4.09Å; A48-F222 HydrophobicContact CB-CE1 4.35Å; W106-F222 AromaticContact CH2-CE1 3.97Å; W106-F222 HydrophobicContact CH2-CE1 3.97Å; W106-F222 AromaticContact CH2-CZ 3.73Å; W106-F222 HydrophobicContact CH2-CZ 3.73Å; W106-F222 AromaticContact CZ3-CE1 3.77Å; W106-F222 HydrophobicContact CZ3-CE1 3.77Å; W106-F222 HydrophobicContact CZ3-CZ 4.02Å; Y172-F222 HydrophobicContact CD1-CB 4.28Å; Y172-F222 AromaticContact CD1-CD1 3.87Å; Y172-F222 HydrophobicContact CD1-CD1 3.87Å; Y172-F222 HydrophobicContact CD1-CD2 4.29Å; Y172-F222 HydrophobicContact CD1-CE1 4.26Å; Y172-F222 AromaticContact CD1-CG 3.88Å; Y172-F222 HydrophobicContact CD1-CG 3.88Å; Y172-F222 HydrophobicContact CG-CG 4.41Å; Y172-F222 WeakPolarHBondContact O-CD2 3.29Å; F222-G224 PolarHBondContact O-N 2.94Å; F222-F225 PolarHBondContact N-O 3.23Å; F222-F225 WeakPolarHBondContact O-CA 3.39Å; F222-F225 WeakPolarHBondContact O-CB 3.41Å; F222-F225 PolarHBondContact O-N 2.54Å
223	G	84.1	Confident	93.9	Very high	74 Å²	74	35 Å²	35	76%	0.763	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	19.7	173.7	0	0	0	0	0	115.7
224	G	86.7	Confident	93.9	Very high	67 Å²	67	33.6 Å²	33.6	69%	0.691	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	92.6	-13.9	-171.4	0	0	0	0	0	114.5	F222	F222-G224 PolarHBondContact O-N 2.94Å
225	F	90.9	Very high	93.9	Very high	54 Å²	54	33.5 Å²	33.5	24%	0.237	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	156.7	169.4	-53.3	-79.8	0	0	0	110.8	A48 R108 P109 Q221 F222	A48-F225 HydrophobicContact CB-CB 4.24Å; A48-F225 HydrophobicContact CB-CD2 4.19Å; A48-F225 HydrophobicContact CB-CG 4.21Å; R108-F225 HydrophobicContact CB-CE2 3.91Å; R108-F225 HydrophobicContact CB-CZ 3.91Å; P109-F225 HydrophobicContact CB-CD1 4.04Å; P109-F225 HydrophobicContact CB-CE1 3.82Å; P109-F225 HydrophobicContact CG-CE1 4.1Å; Q221-F225 PolarHBondContact NE2-O 3.11Å; F222-F225 PolarHBondContact N-O 3.23Å; F222-F225 WeakPolarHBondContact O-CA 3.39Å; F222-F225 WeakPolarHBondContact O-CB 3.41Å; F222-F225 PolarHBondContact O-N 2.54Å
226	V	92.7	Very high	93.8	Very high	40 Å²	40	33.1 Å²	33.1	24%	0.242	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	141	170.7	-179.7	0	0	0	0	107.8	E219 I220 R228	E219-V226 HydrophobicContact CG-CG1 3.39Å; I220-V226 WeakPolarHBondContact O-CA 3.5Å; V226-R228 HydrophobicContact CG1-CG 4.26Å
227	V	93.8	Very high	93.7	Very high	5 Å²	5	33.3 Å²	33.3	3%	0.03	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.3	177.2	-178.1	0	0	0	0	108.5	Y172 E219 I220	Y172-V227 HydrophobicContact CD1-CG2 4.22Å; Y172-V227 HydrophobicContact CD2-CG1 4.23Å; Y172-V227 HydrophobicContact CE1-CG2 4.23Å; Y172-V227 HydrophobicContact CE2-CG1 3.96Å; Y172-V227 HydrophobicContact CG-CG2 4.4Å; E219-V227 WeakPolarHBondContact CA-O 3.43Å; I220-V227 PolarHBondContact N-O 2.84Å; I220-V227 PolarHBondContact O-N 3.1Å
228	R	94.3	Very high	93.5	Very high	83 Å²	83	36.4 Å²	36.4	31%	0.313	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	138.7	-177.9	-64.9	-173.2	-175.2	97.5	8.2	112.2	E47 T217 C218 E219 V226	E47-R228 PolarHBondContact OE1-N 3.48Å; T217-R228 HydrophobicContact CG2-CB 4.01Å; T217-R228 HydrophobicContact CG2-CG 4.34Å; C218-R228 VanDerWaalsContact O-CA 3.27Å; C218-R228 WeakPolarHBondContact O-CA 3.24Å; E219-R228 HydrophobicContact CB-CG 4.32Å; E219-R228 HydrophobicContact CG-CG 4.09Å; E219-R228 IonicContact OE2-CZ 3.48Å; E219-R228 IonicContact OE2-NE 3.37Å; E219-R228 PolarHBondContact OE2-NE 3.22Å; E219-R228 IonicContact OE2-NH2 2.65Å; E219-R228 PolarHBondContact OE2-NH2 3.49Å; V226-R228 HydrophobicContact CG1-CG 4.26Å
229	R	94.8	Very high	93.3	Very high	33 Å²	33	39 Å²	39	13%	0.125	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	137.2	172.3	-56.3	-70.2	174	-104.7	4.9	108.8	E47 P167 T217 C218	E47-R229 IonicContact OE1-NH1 2.77Å; E47-R229 IonicContact OE2-CZ 2.7Å; E47-R229 IonicContact OE2-NH1 3.74Å; E47-R229 PolarHBondContact OE2-NH1 3.29Å; E47-R229 IonicContact OE2-NH2 3.76Å; P167-R229 HydrophobicContact CG-CB 3.84Å; P167-R229 HydrophobicContact CG-CG 4.19Å; T217-R229 CarbonylContact C-O 3.59Å; T217-R229 WeakPolarHBondContact CA-O 3.48Å; C218-R229 PolarHBondContact N-O 3.04Å; C218-R229 PolarHBondContact O-N 2.85Å; C218-R229 PolarHBondContact SG-O 3Å
230	T	96.3	Very high	93.2	Very high	10 Å²	10	38.3 Å²	38.3	6%	0.061	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	128.1	-174.4	-60.8	0	0	0	0	111.5	Y146 R151 I152 N215 Y216 T217	Y146-T230 WeakPolarHBondContact CB-OG1 3.4Å; Y146-T230 HydrophobicContact CD1-CG2 3.7Å; Y146-T230 HydrophobicContact CE1-CG2 4.15Å; Y146-T230 HydrophobicContact CG-CG2 3.94Å; R151-T230 WeakPolarHBondContact CA-O 3.49Å; I152-T230 PolarHBondContact N-O 2.84Å; N215-T230 HydrophobicContact CB-CG2 4.08Å; Y216-T230 WeakPolarHBondContact O-CA 3.43Å; T217-T230 WeakPolarHBondContact CB-OG1 3.42Å; T217-T230 WeakPolarHBondContact CG2-OG1 3.38Å; T217-T230 PolarHBondContact OG1-OG1 3.24Å
231	T	97.3	Very high	93.1	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.018	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	121.6	173.1	-54.7	0	0	0	0	109.3	I152 E154 I164 Y216 L233	I152-T231 CarbonylContact O-C 3.54Å; I152-T231 VanDerWaalsContact O-CA 3.23Å; I152-T231 WeakPolarHBondContact O-CA 3.22Å; E154-T231 HydrophobicContact CB-CG2 3.91Å; E154-T231 HydrophobicContact CG-CG2 3.64Å; I164-T231 HydrophobicContact CG2-CG2 4.11Å; Y216-T231 PolarHBondContact N-O 2.95Å; Y216-T231 PolarHBondContact O-N 2.91Å; T231-L233 PolarHBondContact O-N 2.95Å
232	E	97.2	Very high	93.2	Very high	41 Å²	41	40.9 Å²	40.9	19%	0.192	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	113	164.4	178.8	177.1	-124.4	0	0	108.5	R151 I152 T153 E154 T234	R151-E232 IonicContact CZ-OE1 3.81Å; R151-E232 IonicContact CZ-OE2 2.63Å; R151-E232 IonicContact NE-OE2 2.63Å; R151-E232 IonicContact NH1-OE1 3.72Å; R151-E232 PolarHBondContact NH1-OE1 3.27Å; R151-E232 IonicContact NH1-OE2 2.69Å; R151-E232 IonicContact NH2-OE1 2.71Å; R151-E232 PolarHBondContact NH2-OE1 2.89Å; R151-E232 IonicContact NH2-OE2 3.93Å; R151-E232 PolarHBondContact NH2-OE2 3.33Å; I152-E232 PolarHBondContact O-N 3.05Å; T153-E232 HydrophobicContact CG2-CB 4.46Å; E154-E232 PolarHBondContact N-O 3.03Å; E232-T234 HydrophobicContact CG-CG2 4.37Å
233	L	96.7	Very high	93.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	114.9	173.1	-173	66.4	0	0	0	109.4	E154 A156 F162 I164 F205 D212 I213 G214 Y216 T231	E154-L233 HydrophobicContact CB-CD1 4.42Å; A156-L233 HydrophobicContact CB-CD1 3.72Å; F162-L233 HydrophobicContact CD1-CD1 3.97Å; F162-L233 HydrophobicContact CE1-CD1 3.57Å; F162-L233 HydrophobicContact CZ-CD1 4.24Å; I164-L233 HydrophobicContact CD1-CB 4.36Å; I164-L233 HydrophobicContact CD1-CD2 4.32Å; F205-L233 HydrophobicContact CE1-CD2 4.2Å; F205-L233 HydrophobicContact CZ-CD2 4.05Å; D212-L233 HydrophobicContact CB-CD2 4.12Å; I213-L233 WeakPolarHBondContact CA-O 3.42Å; G214-L233 PolarHBondContact N-O 3.37Å; G214-L233 PolarHBondContact O-N 3.25Å; Y216-L233 HydrophobicContact CD2-CB 3.86Å; Y216-L233 HydrophobicContact CE2-CB 3.79Å; Y216-L233 HydrophobicContact CE2-CD2 3.93Å; T231-L233 PolarHBondContact O-N 2.95Å
234	T	95.6	Very high	93.8	Very high	48 Å²	48	37.4 Å²	37.4	29%	0.294	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	138.9	167.1	59.8	0	0	0	0	109.4	E154 A156 E232	E154-T234 PolarHBondContact O-N 2.85Å; E154-T234 PolarHBondContact O-OG1 2.91Å; A156-T234 PolarHBondContact N-O 3.43Å; E232-T234 HydrophobicContact CG-CG2 4.37Å
235	V	96	Very high	94.2	Very high	8 Å²	8	38.6 Å²	38.6	5%	0.048	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	132.7	178.6	179.4	0	0	0	0	109.3	A156 L158 V208 I213 L312	A156-V235 CarbonylContact O-C 3.53Å; A156-V235 VanDerWaalsContact O-CA 3.3Å; A156-V235 WeakPolarHBondContact O-CA 3.28Å; L158-V235 HydrophobicContact CB-CG1 4.25Å; L158-V235 HydrophobicContact CD1-CG1 3.89Å; V208-V235 HydrophobicContact CG1-CB 4.44Å; V208-V235 HydrophobicContact CG1-CG1 3.84Å; V208-V235 HydrophobicContact CG1-CG2 3.71Å; I213-V235 HydrophobicContact CD1-CB 4.09Å; I213-V235 HydrophobicContact CG1-CB 3.58Å; I213-V235 HydrophobicContact CG1-CG2 3.57Å; V235-L312 WeakPolarHBondContact O-CD2 3.47Å
236	T	95.5	Very high	94.3	Very high	9 Å²	9	36.6 Å²	36.6	6%	0.055	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	163.3	179.5	68.5	0	0	0	0	110.5	K155 A156 L158 Y275 L312	K155-T236 HydrophobicContact CB-CG2 4.41Å; A156-T236 PolarHBondContact O-N 3.11Å; L158-T236 WeakPolarHBondContact CB-O 3.31Å; L158-T236 PolarHBondContact N-O 2.86Å; T236-Y275 HydrophobicContact CG2-CD2 4.48Å; T236-Y275 HydrophobicContact CG2-CE1 4.14Å; T236-Y275 HydrophobicContact CG2-CE2 3.87Å; T236-Y275 WeakPolarHBondContact OG1-CE1 3.13Å; T236-L312 CarbonylContact C-O 3.58Å; T236-L312 WeakPolarHBondContact CA-O 3.36Å; T236-L312 WeakPolarHBondContact CB-O 3.37Å
237	A	94.4	Very high	94.4	Very high	5 Å²	5	39 Å²	39	4%	0.041	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-58.8	162.4	164.6	0	0	0	0	0	110.1	Y275 L312 E314	A237-Y275 WeakPolarHBondContact O-CD1 3.31Å; A237-L312 HydrophobicContact CB-CB 4.43Å; A237-L312 PolarHBondContact N-O 3.29Å; A237-E314 HydrophobicContact CB-CG 3.58Å
238	P	93.4	Very high	94.3	Very high	65 Å²	65	43.7 Å²	43.7	42%	0.422	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-57.7	146	165.3	-20	33.3	0	0	0	110.2	E157 T240	E157-P238 WeakPolarHBondContact OE2-CA 3.28Å; P238-T240 PolarHBondContact O-N 3.45Å
239	I	92.1	Very high	94.2	Very high	58 Å²	58	39.7 Å²	39.7	30%	0.297	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-54.5	125.9	173.7	-66.8	162.6	0	0	0	109.2	E157 Y275	E157-I239 WeakPolarHBondContact OE2-CG1 3.47Å; E157-I239 PolarHBondContact OE2-N 2.87Å; I239-Y275 WeakPolarHBondContact CA-O 3.49Å; I239-Y275 HydrophobicContact CG1-CD1 4.22Å; I239-Y275 HydrophobicContact CG1-CE1 4.13Å
240	T	92.1	Very high	93.8	Very high	19 Å²	19	40.4 Å²	40.4	12%	0.117	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-60.6	144.1	-179.7	-172.7	0	0	0	0	111.4	P238 D242 G274 Y275 H342	P238-T240 PolarHBondContact O-N 3.45Å; T240-D242 PolarHBondContact OG1-N 3.37Å; T240-D242 VanDerWaalsContact OG1-N 3.11Å; T240-D242 PolarHBondContact OG1-O 2.53Å; T240-G274 WeakPolarHBondContact CG2-O 3.48Å; T240-Y275 PolarHBondContact N-O 3.35Å; T240-H342 PolarHBondContact O-CE1 3.03Å; T240-H342 PolarHBondContact O-ND1 3.42Å
241	V	92.3	Very high	93	Very high	114 Å²	114	43.8 Å²	43.8	69%	0.691	24%	0.241	S	C	*	.			trans	-112.7	-4.3	166.7	-62.5	0	0	0	0	112
242	D	91.3	Very high	92	Very high	73 Å²	73	50.4 Å²	50.4	39%	0.39	28%	0.276	S	S	.	.	S	Bend	trans	-93.4	153	178.8	-74.8	-3.5	0	0	0	110.8	T240 K245 N340	T240-D242 PolarHBondContact OG1-N 3.37Å; T240-D242 VanDerWaalsContact OG1-N 3.11Å; T240-D242 PolarHBondContact OG1-O 2.53Å; D242-K245 IonicContact OD2-NZ 3.14Å; D242-K245 PolarHBondContact OD2-NZ 3.16Å; D242-N340 PolarHBondContact O-ND2 3.27Å
243	P	92.6	Very high	91.1	Very high	49 Å²	49	55.7 Å²	55.7	32%	0.318	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-63.1	168.7	163	30.3	-36.3	0	0	0	111.9
244	P	94.4	Very high	90.4	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.006	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-63.8	167.3	172.2	-13.6	29.8	0	0	0	111.2	F272 F273 V338 N340 I345	P244-F272 WeakPolarHBondContact CA-O 3.4Å; P244-F273 HydrophobicContact CB-CD1 3.86Å; P244-F273 HydrophobicContact CB-CE1 3.76Å; P244-F273 HydrophobicContact CB-CE2 4.44Å; P244-F273 HydrophobicContact CB-CG 4.25Å; P244-F273 HydrophobicContact CB-CZ 4.06Å; P244-F273 HydrophobicContact CG-CD1 3.75Å; P244-F273 HydrophobicContact CG-CE1 3.51Å; P244-F273 HydrophobicContact CG-CZ 4.2Å; P244-V338 HydrophobicContact CB-CB 4.13Å; P244-V338 HydrophobicContact CB-CG2 3.82Å; P244-V338 HydrophobicContact CG-CB 4.34Å; P244-V338 HydrophobicContact CG-CG2 4.3Å; P244-N340 HydrophobicContact CG-CB 3.98Å; P244-I345 WeakPolarHBondContact O-CD1 3.43Å
245	K	94	Very high	89.9	Confident	92 Å²	92	59.2 Å²	59.2	40%	0.4	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	117.6	-178.6	-67.4	169	-172.5	163.5	0	109.9	D242 L247 A271 F272	D242-K245 IonicContact OD2-NZ 3.14Å; D242-K245 PolarHBondContact OD2-NZ 3.16Å; K245-L247 PolarHBondContact O-N 3.31Å; K245-A271 CarbonylContact O-C 3.57Å; K245-A271 VanDerWaalsContact O-CA 3.31Å; K245-A271 WeakPolarHBondContact O-CA 3.4Å; K245-F272 PolarHBondContact N-O 2.96Å; K245-F272 PolarHBondContact O-N 3.37Å
246	I	94.5	Very high	89.6	Confident	13 Å²	13	64 Å²	64	7%	0.067	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	122.8	177.5	-55.8	173.5	0	0	0	108.6	P249 V338 I345 A347	I246-P249 WeakPolarHBondContact CG2-O 3.38Å; I246-V338 HydrophobicContact CD1-CG2 3.96Å; I246-V338 HydrophobicContact CG1-CG1 4.39Å; I246-V338 HydrophobicContact CG1-CG2 3.48Å; I246-V338 VanDerWaalsContact CG1-CG2 3.48Å; I246-I345 HydrophobicContact CD1-CD1 4.31Å; I246-I345 HydrophobicContact CD1-CG1 4.24Å; I246-I345 HydrophobicContact CG1-CD1 3.88Å; I246-I345 HydrophobicContact CG1-CG1 4.17Å; I246-A347 HydrophobicContact CD1-CB 3.69Å; I246-A347 HydrophobicContact CG2-CB 4.22Å
247	L	93.9	Very high	89.2	Confident	89 Å²	89	67 Å²	67	47%	0.466	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-33.4	178.4	-55.4	-177.3	0	0	0	111.4	K245 R270 F272 E316	K245-L247 PolarHBondContact O-N 3.31Å; L247-R270 HydrophobicContact CB-CG 4.22Å; L247-R270 HydrophobicContact CD1-CG 4.22Å; L247-R270 PolarHBondContact N-O 2.97Å; L247-F272 HydrophobicContact CD1-CB 4.33Å; L247-F272 HydrophobicContact CD2-CB 4.37Å; L247-F272 HydrophobicContact CG-CB 4.39Å; L247-E316 HydrophobicContact CD1-CG 3.93Å
248	F	92.5	Very high	88.9	Confident	104 Å²	104	73.4 Å²	73.4	46%	0.456	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	137.7	173.5	-179.2	-93.7	0	0	0	109.9	T268 C269 R270	F248-T268 WeakPolarHBondContact CD1-O 3.46Å; F248-T268 VanDerWaalsContact CE1-O 3.26Å; F248-T268 WeakPolarHBondContact CE1-O 3.45Å; F248-C269 CarbonylContact O-C 3.47Å; F248-C269 WeakPolarHBondContact O-CA 3.41Å; F248-R270 HydrophobicContact CB-CB 4.44Å; F248-R270 PolarHBondContact N-O 3.49Å; F248-R270 VanDerWaalsContact N-O 3.15Å; F248-R270 PolarHBondContact O-N 3.46Å
249	P	91.6	Very high	88.5	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	cis	-62.1	164.7	-8.2	28.9	-36.2	0	0	0	112.3	I246 E251 A347 I349	I246-P249 WeakPolarHBondContact CG2-O 3.38Å; P249-E251 PolarHBondContact O-N 3.06Å; P249-A347 HydrophobicContact CG-CB 3.86Å; P249-I349 HydrophobicContact CB-CD1 4.11Å; P249-I349 HydrophobicContact CB-CG1 3.85Å; P249-I349 HydrophobicContact CG-CD1 4.09Å; P249-I349 HydrophobicContact CG-CG1 3.78Å
250	A	87	Confident	88.2	Confident	47 Å²	47	72.1 Å²	72.1	39%	0.388	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	126.9	-171.9	0	0	0	0	0	112.3	K253	A250-K253 PolarHBondContact O-N 2.95Å
251	E	79.5	Confident	88	Confident	82 Å²	82	74 Å²	74	38%	0.383	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	145.1	175.5	-155.7	-161.3	120.4	0	0	111.8	P249 K253 I345	P249-E251 PolarHBondContact O-N 3.06Å; E251-K253 PolarHBondContact O-N 3.09Å; E251-K253 VanDerWaalsContact O-N 3.14Å; E251-I345 HydrophobicContact CG-CD1 4.44Å
252	N	76.2	Confident	87.7	Confident	141 Å²	141	71.1 Å²	71.1	75%	0.754	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	16.2	-179.6	-54.4	-75	0	0	0	115.8
253	K	77.4	Confident	87.6	Confident	152 Å²	152	69.6 Å²	69.6	66%	0.661	37%	0.374	S	S	*	.	S	Bend	trans	-137.3	116.3	173.4	-69.7	-178.8	-179.3	174.3	0	111.9	A250 E251 T255	A250-K253 PolarHBondContact O-N 2.95Å; E251-K253 PolarHBondContact O-N 3.09Å; E251-K253 VanDerWaalsContact O-N 3.14Å; K253-T255 PolarHBondContact O-N 2.78Å; K253-T255 VanDerWaalsContact O-N 3.11Å; K253-T255 PolarHBondContact O-OG1 2.83Å
254	T	82.9	Confident	87.6	Confident	81 Å²	81	71.1 Å²	71.1	50%	0.497	39%	0.391	S	S	.	.			trans	-57.5	117.9	168.2	-45.1	0	0	0	0	109.4	N256 T348 Q350	T254-N256 PolarHBondContact O-N 3.15Å; T254-T348 WeakPolarHBondContact CA-O 3.38Å; T254-Q350 HydrophobicContact CG2-CB 3.71Å
255	T	84.9	Confident	87.4	Confident	42 Å²	42	71.7 Å²	71.7	26%	0.258	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	102.4	179.9	-61.6	0	0	0	0	108.4	K253 T348 I349 Q350	K253-T255 PolarHBondContact O-N 2.78Å; K253-T255 VanDerWaalsContact O-N 3.11Å; K253-T255 PolarHBondContact O-OG1 2.83Å; T255-T348 PolarHBondContact N-O 2.69Å; T255-I349 CarbonylContact O-C 3.58Å; T255-I349 VanDerWaalsContact O-CA 3.31Å; T255-I349 WeakPolarHBondContact O-CA 3.22Å; T255-I349 WeakPolarHBondContact O-CG2 3.37Å; T255-Q350 PolarHBondContact O-N 3.07Å
256	N	88.6	Confident	87.4	Confident	109 Å²	109	71.4 Å²	71.4	58%	0.583	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	130.6	179.7	-63	-2.4	0	0	0	110	T254 Q350 F352	T254-N256 PolarHBondContact O-N 3.15Å; N256-Q350 WeakPolarHBondContact CA-O 3.5Å; N256-F352 HydrophobicContact CB-CD2 4.29Å; N256-F352 HydrophobicContact CB-CE2 4.17Å
257	M	86.9	Confident	87.4	Confident	70 Å²	70	71 Å²	71	35%	0.345	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	117.6	179.5	-170.2	168	179.7	0	0	110.7	T259 L265 L267 I349 Q350 F352	M257-T259 HydrophobicContact CE-CG2 4.39Å; M257-T259 HydrophobicContact CG-CG2 4.16Å; M257-L265 HydrophobicContact CE-CD1 3.44Å; M257-L265 VanDerWaalsContact CE-CD1 3.44Å; M257-L265 HydrophobicContact SD-CD1 3.89Å; M257-L267 HydrophobicContact SD-CD2 3.87Å; M257-I349 HydrophobicContact CB-CG2 4.14Å; M257-Q350 PolarHBondContact N-O 2.97Å; M257-F352 PolarHBondContact O-N 3.47Å
258	E	87.8	Confident	87.5	Confident	140 Å²	140	68.9 Å²	68.9	65%	0.654	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	125.2	176	-70.6	-177.9	-149.7	0	0	111.3	F352 R354	E258-F352 WeakPolarHBondContact CA-O 3.19Å; E258-R354 HydrophobicContact CB-CB 4.39Å
259	T	85.6	Confident	87.6	Confident	10 Å²	10	63.9 Å²	63.9	6%	0.061	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	160.2	-176.1	53.8	0	0	0	0	111.7	M257 L265 L326 I351 F352 R354	M257-T259 HydrophobicContact CE-CG2 4.39Å; M257-T259 HydrophobicContact CG-CG2 4.16Å; T259-L265 HydrophobicContact CG2-CD1 4.11Å; T259-L265 HydrophobicContact CG2-CD2 4.44Å; T259-L326 HydrophobicContact CG2-CD2 4.46Å; T259-L326 WeakPolarHBondContact OG1-CD2 2.85Å; T259-I351 HydrophobicContact CG2-CG2 4.3Å; T259-I351 WeakPolarHBondContact OG1-CG2 3.37Å; T259-F352 PolarHBondContact N-O 3.14Å; T259-R354 VanDerWaalsContact O-CB 3.3Å; T259-R354 WeakPolarHBondContact O-CB 3.45Å; T259-R354 PolarHBondContact O-N 3.01Å
260	Q	86.8	Confident	87.9	Confident	86 Å²	86	68.4 Å²	68.4	40%	0.402	38%	0.38	S	S	.	.			trans	-98.4	144.6	170.4	-77.5	169.1	-58.6	0	0	109.7	S263 R354 E356	Q260-S263 WeakPolarHBondContact O-CB 3.49Å; Q260-S263 PolarHBondContact O-N 3.4Å; Q260-S263 PolarHBondContact O-OG 3.47Å; Q260-R354 HydrophobicContact CG-CB 4.32Å; Q260-E356 PolarHBondContact NE2-OE1 3.1Å
261	L	88.3	Confident	88.3	Confident	58 Å²	58	66.2 Å²	66.2	30%	0.304	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	146.8	173.5	-60.4	173.6	0	0	0	110.1	S263 L326 E328 L331 R353	L261-S263 PolarHBondContact O-N 3.34Å; L261-L326 WeakPolarHBondContact CA-O 3.49Å; L261-E328 HydrophobicContact CD1-CG 3.57Å; L261-E328 HydrophobicContact CD2-CG 3.94Å; L261-E328 HydrophobicContact CG-CG 4.42Å; L261-L331 HydrophobicContact CD2-CD1 4.45Å; L261-R353 HydrophobicContact CG-CG 4.49Å
262	G	85.9	Confident	89.1	Confident	54 Å²	54	65.1 Å²	65.1	56%	0.557	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	8.9	-173.5	0	0	0	0	0	114.9	L326	G262-L326 PolarHBondContact N-O 2.94Å
263	S	89.1	Confident	90	Very high	42 Å²	42	59 Å²	59	29%	0.294	32%	0.323	S	S	.	.			trans	-92.3	146.3	171	68.6	0	0	0	0	111.4	Q260 L261 L326	Q260-S263 WeakPolarHBondContact O-CB 3.49Å; Q260-S263 PolarHBondContact O-N 3.4Å; Q260-S263 PolarHBondContact O-OG 3.47Å; L261-S263 PolarHBondContact O-N 3.34Å; S263-L326 WeakPolarHBondContact O-CB 3.21Å; S263-L326 PolarHBondContact O-N 2.74Å
264	A	91.1	Very high	90.7	Very high	81 Å²	81	52.2 Å²	52.2	67%	0.669	30%	0.296	S	S	*	.			trans	-75.1	133.8	172.7	0	0	0	0	0	110.2	I323 E324	A264-I323 CarbonylContact C-O 3.58Å; A264-I323 WeakPolarHBondContact CA-O 3.4Å; A264-E324 VanDerWaalsContact CA-O 3.3Å; A264-E324 WeakPolarHBondContact CA-O 3.46Å; A264-E324 VanDerWaalsContact CB-O 3.3Å; A264-E324 WeakPolarHBondContact CB-O 3.46Å
265	L	91.8	Very high	91.2	Very high	13 Å²	13	49 Å²	49	7%	0.068	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	141.5	-177.8	-177.2	60.7	0	0	0	111	M257 T259 L267 T322 I323 L326 I351	M257-L265 HydrophobicContact CE-CD1 3.44Å; M257-L265 VanDerWaalsContact CE-CD1 3.44Å; M257-L265 HydrophobicContact SD-CD1 3.89Å; T259-L265 HydrophobicContact CG2-CD1 4.11Å; T259-L265 HydrophobicContact CG2-CD2 4.44Å; L265-L267 HydrophobicContact CD1-CD2 3.99Å; L265-L267 HydrophobicContact CD2-CD2 4.06Å; L265-L267 HydrophobicContact CD2-CG 4.27Å; L265-L267 HydrophobicContact CG-CD2 4.02Å; L265-L267 HydrophobicContact CG-CG 4.26Å; L265-T322 WeakPolarHBondContact O-CA 3.39Å; L265-I323 HydrophobicContact CB-CB 4.41Å; L265-I323 PolarHBondContact N-O 3.19Å; L265-I323 PolarHBondContact O-N 3.14Å; L265-L326 HydrophobicContact CD2-CD1 4.04Å; L265-I351 HydrophobicContact CD2-CD1 3.53Å; L265-I351 HydrophobicContact CD2-CG1 4.23Å; L265-I351 HydrophobicContact CD2-CG2 4.49Å
266	N	93.6	Very high	91.4	Very high	85 Å²	85	48.5 Å²	48.5	46%	0.455	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	113	172.5	-178.1	-31.1	0	0	0	109	T268 L321 T322	N266-T268 PolarHBondContact OD1-OG1 2.91Å; N266-L321 CarbonylContact C-O 3.59Å; N266-L321 WeakPolarHBondContact CA-O 3.38Å; N266-T322 HydrophobicContact CB-CG2 4.04Å
267	L	93.9	Very high	91.1	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	100.2	173.1	-57	-174.2	0	0	0	108.8	M257 L265 W285 S320 L321 Y334 I349 I351	M257-L267 HydrophobicContact SD-CD2 3.87Å; L265-L267 HydrophobicContact CD1-CD2 3.99Å; L265-L267 HydrophobicContact CD2-CD2 4.06Å; L265-L267 HydrophobicContact CD2-CG 4.27Å; L265-L267 HydrophobicContact CG-CD2 4.02Å; L265-L267 HydrophobicContact CG-CG 4.26Å; L267-W285 HydrophobicContact CB-CH2 3.9Å; L267-W285 HydrophobicContact CB-CZ2 3.71Å; L267-W285 HydrophobicContact CD1-CH2 4.49Å; L267-W285 HydrophobicContact CD1-CZ3 4.49Å; L267-W285 VanDerWaalsContact O-CZ2 3.27Å; L267-W285 WeakPolarHBondContact O-CZ2 3.49Å; L267-W285 PolarHBondContact O-NE1 3.41Å; L267-S320 WeakPolarHBondContact O-CA 3.18Å; L267-L321 HydrophobicContact CB-CB 4.39Å; L267-L321 PolarHBondContact N-O 3.47Å; L267-L321 PolarHBondContact O-N 2.89Å; L267-Y334 HydrophobicContact CD1-CD1 4.35Å; L267-Y334 HydrophobicContact CD1-CG 3.97Å; L267-I349 HydrophobicContact CB-CD1 4.39Å; L267-I349 HydrophobicContact CD1-CD1 4.46Å; L267-I349 HydrophobicContact CD2-CD1 4.03Å; L267-I349 HydrophobicContact CD2-CG2 4.25Å; L267-I351 HydrophobicContact CD1-CD1 4.27Å
268	T	95.5	Very high	90.6	Very high	45 Å²	45	52.2 Å²	52.2	28%	0.276	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	130.3	171.2	-60.8	0	0	0	0	109.9	F248 N266 A318 I319 S320	F248-T268 WeakPolarHBondContact CD1-O 3.46Å; F248-T268 VanDerWaalsContact CE1-O 3.26Å; F248-T268 WeakPolarHBondContact CE1-O 3.45Å; N266-T268 PolarHBondContact OD1-OG1 2.91Å; T268-A318 HydrophobicContact CG2-CB 4.3Å; T268-I319 CarbonylContact C-O 3.45Å; T268-I319 WeakPolarHBondContact CA-O 3.45Å; T268-S320 PolarHBondContact OG1-OG 2.92Å
269	C	95.9	Very high	90.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	147.7	163.1	-177	0	0	0	0	109.5	F248 W285 A318 I319 C336	F248-C269 CarbonylContact O-C 3.47Å; F248-C269 WeakPolarHBondContact O-CA 3.41Å; C269-W285 HydrophobicContact CB-CH2 4.26Å; C269-W285 HydrophobicContact CB-CZ2 3.55Å; C269-A318 CarbonylContact O-C 3.55Å; C269-A318 WeakPolarHBondContact O-CA 3.33Å; C269-A318 WeakPolarHBondContact O-CB 3.34Å; C269-I319 HydrophobicContact CB-CG2 4.08Å; C269-I319 PolarHBondContact N-O 3.32Å; C269-I319 PolarHBondContact O-N 2.92Å; C269-I319 VanDerWaalsContact O-O 3.14Å; C269-C336 HydrophobicContact CB-CB 3.52Å; C269-C336 WeakPolarHBondContact CB-SG 3.41Å; C269-C336 WeakPolarHBondContact SG-CB 3.36Å; C269-C336 CovalentContact SG-SG 2.02Å; C269-C336 PolarHBondContact SG-SG 3.29Å
270	R	96.2	Very high	90.2	Very high	95 Å²	95	53.3 Å²	53.3	36%	0.358	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	129.5	-178.3	179.2	-172.2	-70.9	-128.8	2.3	109.3	L247 F248 E316 V317 A318	L247-R270 HydrophobicContact CB-CG 4.22Å; L247-R270 HydrophobicContact CD1-CG 4.22Å; L247-R270 PolarHBondContact N-O 2.97Å; F248-R270 HydrophobicContact CB-CB 4.44Å; F248-R270 PolarHBondContact N-O 3.49Å; F248-R270 VanDerWaalsContact N-O 3.15Å; F248-R270 PolarHBondContact O-N 3.46Å; R270-E316 VanDerWaalsContact CD-OE1 3.3Å; R270-E316 WeakPolarHBondContact CD-OE1 3.3Å; R270-E316 HydrophobicContact CG-CG 4.3Å; R270-E316 IonicContact CZ-OE1 2.68Å; R270-E316 IonicContact NE-OE1 2.59Å; R270-E316 IonicContact NH1-OE1 3.83Å; R270-E316 PolarHBondContact NH1-OE1 3.46Å; R270-V317 CarbonylContact C-O 3.52Å; R270-V317 WeakPolarHBondContact CA-O 3.28Å; R270-A318 HydrophobicContact CB-CB 4.33Å
271	A	96.3	Very high	90.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	157.3	-178.6	0	0	0	0	0	112.7	K245 F273 I283 E316 V317 V338	K245-A271 CarbonylContact O-C 3.57Å; K245-A271 VanDerWaalsContact O-CA 3.31Å; K245-A271 WeakPolarHBondContact O-CA 3.4Å; A271-F273 HydrophobicContact CB-CE2 3.93Å; A271-I283 HydrophobicContact CB-CD1 4.19Å; A271-E316 WeakPolarHBondContact O-CA 3.33Å; A271-V317 PolarHBondContact N-O 2.93Å; A271-V317 PolarHBondContact O-N 3.44Å; A271-V338 HydrophobicContact CB-CB 4.5Å; A271-V338 HydrophobicContact CB-CG1 3.73Å; A271-V338 HydrophobicContact CB-CG2 4.46Å
272	F	95.3	Very high	90.6	Very high	60 Å²	60	51.6 Å²	51.6	26%	0.263	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	130.9	176.7	173.8	-92.5	0	0	0	110.4	P244 K245 L247 E314 Q315	P244-F272 WeakPolarHBondContact CA-O 3.4Å; K245-F272 PolarHBondContact N-O 2.96Å; K245-F272 PolarHBondContact O-N 3.37Å; L247-F272 HydrophobicContact CD1-CB 4.33Å; L247-F272 HydrophobicContact CD2-CB 4.37Å; L247-F272 HydrophobicContact CG-CB 4.39Å; F272-E314 HydrophobicContact CE2-CB 3.9Å; F272-E314 HydrophobicContact CZ-CB 3.88Å; F272-E314 HydrophobicContact CZ-CG 4.32Å; F272-Q315 WeakPolarHBondContact CA-O 3.44Å
273	F	95.1	Very high	91	Very high	13 Å²	13	49.2 Å²	49.2	6%	0.057	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	116.3	176.4	-68.2	-104	0	0	0	108.8	P244 A271 P281 L282 I283 E314 Q315 V317 V338	P244-F273 HydrophobicContact CB-CD1 3.86Å; P244-F273 HydrophobicContact CB-CE1 3.76Å; P244-F273 HydrophobicContact CB-CE2 4.44Å; P244-F273 HydrophobicContact CB-CG 4.25Å; P244-F273 HydrophobicContact CB-CZ 4.06Å; P244-F273 HydrophobicContact CG-CD1 3.75Å; P244-F273 HydrophobicContact CG-CE1 3.51Å; P244-F273 HydrophobicContact CG-CZ 4.2Å; A271-F273 HydrophobicContact CB-CE2 3.93Å; F273-P281 HydrophobicContact CB-CB 4.38Å; F273-P281 HydrophobicContact CD1-CB 3.63Å; F273-P281 HydrophobicContact CD2-CB 3.63Å; F273-P281 HydrophobicContact CE1-CB 3.68Å; F273-P281 HydrophobicContact CE2-CB 3.69Å; F273-P281 HydrophobicContact CG-CB 3.61Å; F273-P281 HydrophobicContact CZ-CB 3.71Å; F273-L282 WeakPolarHBondContact CZ-O 3.49Å; F273-I283 HydrophobicContact CZ-CB 4.29Å; F273-E314 WeakPolarHBondContact O-CA 3.17Å; F273-Q315 PolarHBondContact N-O 3.22Å; F273-Q315 PolarHBondContact O-N 3.5Å; F273-V317 HydrophobicContact CD2-CG2 3.74Å; F273-V317 HydrophobicContact CE2-CG2 3.44Å; F273-V317 VanDerWaalsContact CE2-CG2 3.44Å; F273-V338 HydrophobicContact CE2-CG1 4.45Å; F273-V338 HydrophobicContact CZ-CB 3.91Å; F273-V338 HydrophobicContact CZ-CG1 4.06Å
274	G	93.3	Very high	91.3	Very high	9 Å²	9	49.1 Å²	49.1	9%	0.093	28%	0.275	C	S	.	.			trans	-66	153.1	168.9	0	0	0	0	0	111	T240 S276	T240-G274 WeakPolarHBondContact CG2-O 3.48Å; G274-S276 PolarHBondContact O-N 3Å
275	Y	92.8	Very high	91.5	Very high	12 Å²	12	45.4 Å²	45.4	5%	0.047	24%	0.243	C	C	.	.			trans	-55.8	128.2	-169.7	171.7	-114.4	0	0	0	113.5	K155 T236 A237 I239 T240 G313	K155-Y275 WeakPolarHBondContact CD-OH 3.26Å; T236-Y275 HydrophobicContact CG2-CD2 4.48Å; T236-Y275 HydrophobicContact CG2-CE1 4.14Å; T236-Y275 HydrophobicContact CG2-CE2 3.87Å; T236-Y275 WeakPolarHBondContact OG1-CE1 3.13Å; A237-Y275 WeakPolarHBondContact O-CD1 3.31Å; I239-Y275 WeakPolarHBondContact CA-O 3.49Å; I239-Y275 HydrophobicContact CG1-CD1 4.22Å; I239-Y275 HydrophobicContact CG1-CE1 4.13Å; T240-Y275 PolarHBondContact N-O 3.35Å; Y275-G313 WeakPolarHBondContact CA-O 3.38Å; Y275-G313 WeakPolarHBondContact CD2-O 3.49Å
276	S	89.3	Confident	91.6	Very high	32 Å²	32	45.8 Å²	45.8	22%	0.224	25%	0.245	C	C	.	.			trans	-134.3	61.4	-179.6	-164.9	0	0	0	0	111.9	G274 D278 A279	G274-S276 PolarHBondContact O-N 3Å; S276-D278 PolarHBondContact O-N 3.4Å; S276-A279 PolarHBondContact O-N 3.26Å
277	R	83.3	Confident	91.5	Very high	130 Å²	130	43.7 Å²	43.7	49%	0.491	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.7	-82.3	174.7	-161.1	-168.6	-72.3	-73.8	-8.6	116.9	K155	K155-R277 PolarHBondContact NZ-O 3.39Å
278	D	76.8	Confident	91.2	Very high	127 Å²	127	45.5 Å²	45.5	68%	0.679	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.8	15	-174.3	-48.5	-55.4	0	0	0	112	K155 S276	K155-D278 IonicContact NZ-OD1 3.65Å; K155-D278 PolarHBondContact NZ-OD1 2.95Å; S276-D278 PolarHBondContact O-N 3.4Å
279	A	81.5	Confident	90.8	Very high	65 Å²	65	52.6 Å²	52.6	54%	0.537	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-92	128	177	0	0	0	0	0	111.1	S276	S276-A279 PolarHBondContact O-N 3.26Å
280	S	83.6	Confident	90.6	Very high	108 Å²	108	58 Å²	58	76%	0.755	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-70.6	143.6	174.7	51.6	0	0	0	0	111.9	L282	S280-L282 PolarHBondContact O-N 2.93Å
281	P	88.8	Confident	90.3	Very high	23 Å²	23	57.5 Å²	57.5	15%	0.149	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-66.8	124.6	175.8	27.6	-33.7	0	0	0	111	F273 V317	F273-P281 HydrophobicContact CB-CB 4.38Å; F273-P281 HydrophobicContact CD1-CB 3.63Å; F273-P281 HydrophobicContact CD2-CB 3.63Å; F273-P281 HydrophobicContact CE1-CB 3.68Å; F273-P281 HydrophobicContact CE2-CB 3.69Å; F273-P281 HydrophobicContact CG-CB 3.61Å; F273-P281 HydrophobicContact CZ-CB 3.71Å; P281-V317 HydrophobicContact CB-CG1 4.5Å; P281-V317 HydrophobicContact CB-CG2 4.31Å; P281-V317 HydrophobicContact CG-CG1 3.92Å; P281-V317 HydrophobicContact CG-CG2 4.5Å
282	L	93.3	Very high	90	Very high	86 Å²	86	58.2 Å²	58.2	45%	0.45	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	112.1	176.1	-174.3	59	0	0	0	109.7	F273 S280 Y284 V338 E339	F273-L282 WeakPolarHBondContact CZ-O 3.49Å; S280-L282 PolarHBondContact O-N 2.93Å; L282-Y284 HydrophobicContact CD1-CD1 4.19Å; L282-Y284 HydrophobicContact CD2-CE1 4.42Å; L282-Y284 HydrophobicContact CG-CD1 4.14Å; L282-Y284 HydrophobicContact CG-CE1 4.13Å; L282-V338 WeakPolarHBondContact O-CA 3.44Å; L282-E339 HydrophobicContact CD2-CB 4.27Å; L282-E339 PolarHBondContact O-N 2.83Å
283	I	95.1	Very high	89.5	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.021	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	129.7	-179.8	177.4	168.3	0	0	0	109	A271 F273 I305 V317 I319 H337 V338	A271-I283 HydrophobicContact CB-CD1 4.19Å; F273-I283 HydrophobicContact CZ-CB 4.29Å; I283-I305 HydrophobicContact CG2-CD1 3.8Å; I283-I305 HydrophobicContact CG2-CG1 3.89Å; I283-I305 HydrophobicContact CG2-CG2 3.83Å; I283-V317 HydrophobicContact CD1-CG2 4.31Å; I283-V317 HydrophobicContact CG2-CG2 4Å; I283-I319 HydrophobicContact CD1-CB 4.35Å; I283-I319 HydrophobicContact CD1-CG2 3.92Å; I283-I319 HydrophobicContact CG1-CB 4.28Å; I283-I319 HydrophobicContact CG1-CG2 3.72Å; I283-I319 WeakPolarHBondContact O-CD1 3.31Å; I283-H337 WeakPolarHBondContact CA-O 3.35Å; I283-V338 HydrophobicContact CB-CG1 3.78Å; I283-V338 HydrophobicContact CD1-CG1 3.85Å; I283-V338 HydrophobicContact CG1-CG1 3.61Å
284	Y	94.5	Very high	89	Confident	40 Å²	40	67 Å²	67	16%	0.157	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	161	-176.4	59.6	-84.9	0	0	0	111.8	L282 M286 F291 H337	L282-Y284 HydrophobicContact CD1-CD1 4.19Å; L282-Y284 HydrophobicContact CD2-CE1 4.42Å; L282-Y284 HydrophobicContact CG-CD1 4.14Å; L282-Y284 HydrophobicContact CG-CE1 4.13Å; Y284-M286 HydrophobicContact CD2-CG 4.02Å; Y284-M286 HydrophobicContact CE2-CE 4.25Å; Y284-M286 HydrophobicContact CE2-CG 3.85Å; Y284-M286 HydrophobicContact CE2-SD 4.04Å; Y284-F291 HydrophobicContact CD2-CD1 4.05Å; Y284-F291 HydrophobicContact CD2-CE1 4.02Å; Y284-F291 HydrophobicContact CE2-CD1 4.03Å; Y284-F291 AromaticContact CE2-CE1 3.57Å; Y284-F291 HydrophobicContact CE2-CE1 3.57Å; Y284-H337 HydrophobicContact CD1-CB 4.38Å; Y284-H337 HydrophobicContact CD2-CB 4.12Å; Y284-H337 HydrophobicContact CE1-CB 3.91Å; Y284-H337 HydrophobicContact CE2-CB 3.63Å; Y284-H337 HydrophobicContact CG-CB 4.48Å; Y284-H337 PolarHBondContact N-O 2.95Å; Y284-H337 VanDerWaalsContact N-O 3.09Å; Y284-H337 PolarHBondContact O-N 3.03Å
285	W	95.1	Very high	88.4	Confident	2 Å²	2	67.9 Å²	67.9	1%	0.008	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	155.5	172	-73.9	97.9	0	0	0	113.1	L267 C269 I292 E302 L321 S335 C336 I349	L267-W285 HydrophobicContact CB-CH2 3.9Å; L267-W285 HydrophobicContact CB-CZ2 3.71Å; L267-W285 HydrophobicContact CD1-CH2 4.49Å; L267-W285 HydrophobicContact CD1-CZ3 4.49Å; L267-W285 VanDerWaalsContact O-CZ2 3.27Å; L267-W285 WeakPolarHBondContact O-CZ2 3.49Å; L267-W285 PolarHBondContact O-NE1 3.41Å; C269-W285 HydrophobicContact CB-CH2 4.26Å; C269-W285 HydrophobicContact CB-CZ2 3.55Å; W285-I292 HydrophobicContact CB-CD1 4.31Å; W285-I292 HydrophobicContact CB-CG1 3.78Å; W285-E302 VanDerWaalsContact CB-OE1 3.32Å; W285-E302 WeakPolarHBondContact CB-OE1 3.3Å; W285-E302 VanDerWaalsContact CD1-OE1 3.22Å; W285-E302 PolarHBondContact N-OE1 3.01Å; W285-L321 HydrophobicContact CB-CD2 4.19Å; W285-L321 HydrophobicContact CD2-CB 4.29Å; W285-L321 HydrophobicContact CD2-CD2 4.44Å; W285-L321 HydrophobicContact CG-CB 3.97Å; W285-L321 HydrophobicContact CG-CD2 4.19Å; W285-S335 CarbonylContact C-O 3.55Å; W285-S335 WeakPolarHBondContact CA-O 3.33Å; W285-S335 VanDerWaalsContact CE3-C 3.42Å; W285-C336 HydrophobicContact CD2-CB 4.2Å; W285-C336 HydrophobicContact CE3-CB 4Å; W285-C336 HydrophobicContact CH2-CB 3.98Å; W285-C336 HydrophobicContact CZ2-CB 4.22Å; W285-C336 HydrophobicContact CZ3-CB 3.88Å; W285-I349 HydrophobicContact CH2-CD1 3.71Å; W285-I349 HydrophobicContact CH2-CG1 4.12Å; W285-I349 HydrophobicContact CZ3-CD1 4.4Å; W285-I349 HydrophobicContact CZ3-CG1 4.39Å
286	M	93.9	Very high	87	Confident	22 Å²	22	75.7 Å²	75.7	11%	0.108	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	143.1	167.2	-68.7	-157.7	-69.4	0	0	111.5	Y284 K290 F291 Y334 S335 H337	Y284-M286 HydrophobicContact CD2-CG 4.02Å; Y284-M286 HydrophobicContact CE2-CE 4.25Å; Y284-M286 HydrophobicContact CE2-CG 3.85Å; Y284-M286 HydrophobicContact CE2-SD 4.04Å; M286-K290 CarbonylContact C-O 3.58Å; M286-K290 WeakPolarHBondContact CA-O 3.36Å; M286-K290 WeakPolarHBondContact CB-O 3.4Å; M286-F291 HydrophobicContact CG-CD1 4.07Å; M286-F291 HydrophobicContact CG-CE1 4.42Å; M286-F291 HydrophobicContact SD-CD1 3.97Å; M286-F291 HydrophobicContact SD-CE1 3.86Å; M286-F291 HydrophobicContact SD-CG 4.39Å; M286-F291 HydrophobicContact SD-CZ 4.17Å; M286-Y334 WeakPolarHBondContact O-CA 3.49Å; M286-S335 PolarHBondContact N-O 3.37Å; M286-S335 PolarHBondContact O-N 3.48Å; M286-H337 WeakPolarHBondContact CE-CE1 3.43Å; M286-H337 WeakPolarHBondContact CE-NE2 3.27Å
287	K	92.4	Very high	86.1	Confident	40 Å²	40	77.2 Å²	77.2	17%	0.174	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	98	173.6	-172.9	176	-179.6	176.9	0	107.6	E289 K290 I292 L295 E329 D330 Y334	K287-E289 PolarHBondContact O-N 2.96Å; K287-K290 PolarHBondContact N-O 3.08Å; K287-K290 PolarHBondContact O-N 3.35Å; K287-I292 HydrophobicContact CB-CD1 4.13Å; K287-L295 HydrophobicContact CB-CD1 4.19Å; K287-L295 HydrophobicContact CD-CD1 3.72Å; K287-L295 HydrophobicContact CD-CD2 4.28Å; K287-E329 WeakPolarHBondContact CE-O 3.3Å; K287-E329 PolarHBondContact NZ-O 3.43Å; K287-D330 IonicContact NZ-OD1 2.62Å; K287-D330 PolarHBondContact NZ-OD1 3.13Å; K287-Y334 HydrophobicContact CB-CD1 4.33Å; K287-Y334 HydrophobicContact CB-CE1 4.04Å; K287-Y334 HydrophobicContact CD-CE1 3.99Å; K287-Y334 WeakPolarHBondContact CD-OH 3.45Å; K287-Y334 WeakPolarHBondContact CE-OH 3.49Å; K287-Y334 HydrophobicContact CG-CD1 4.47Å; K287-Y334 HydrophobicContact CG-CE1 3.88Å; K287-Y334 HydrophobicContact CG-CE2 4.21Å; K287-Y334 PolarHBondContact NZ-OH 3.38Å
288	G	87.6	Confident	85.8	Confident	43 Å²	43	79.8 Å²	79.8	44%	0.443	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	-108.7	-169.5	0	0	0	0	0	112.4	N333	G288-N333 PolarHBondContact N-O 2.79Å
289	E	87.7	Confident	86.1	Confident	193 Å²	193	75.5 Å²	75.5	90%	0.902	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	5	178.1	-62.2	-175.8	161.6	0	0	113.1	K287	K287-E289 PolarHBondContact O-N 2.96Å
290	K	90.1	Very high	86.4	Confident	113 Å²	113	73 Å²	73	49%	0.491	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	144.8	178	-71.1	-170.5	168.5	-160.3	0	112.1	M286 K287 L295	M286-K290 CarbonylContact C-O 3.58Å; M286-K290 WeakPolarHBondContact CA-O 3.36Å; M286-K290 WeakPolarHBondContact CB-O 3.4Å; K287-K290 PolarHBondContact N-O 3.08Å; K287-K290 PolarHBondContact O-N 3.35Å; K290-L295 HydrophobicContact CD-CD2 3.91Å
291	F	90.9	Very high	86.6	Confident	86 Å²	86	72.7 Å²	72.7	38%	0.377	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	157.6	163	-61.3	-84	0	0	0	110.6	Y284 M286 E293 D294	Y284-F291 HydrophobicContact CD2-CD1 4.05Å; Y284-F291 HydrophobicContact CD2-CE1 4.02Å; Y284-F291 HydrophobicContact CE2-CD1 4.03Å; Y284-F291 AromaticContact CE2-CE1 3.57Å; Y284-F291 HydrophobicContact CE2-CE1 3.57Å; M286-F291 HydrophobicContact CG-CD1 4.07Å; M286-F291 HydrophobicContact CG-CE1 4.42Å; M286-F291 HydrophobicContact SD-CD1 3.97Å; M286-F291 HydrophobicContact SD-CE1 3.86Å; M286-F291 HydrophobicContact SD-CG 4.39Å; M286-F291 HydrophobicContact SD-CZ 4.17Å; F291-E293 VanDerWaalsContact C-N 3.29Å; F291-E293 HydrophobicContact CB-CG 3.97Å; F291-E293 PolarHBondContact O-N 3.46Å; F291-D294 WeakPolarHBondContact CD2-OD2 3.31Å; F291-D294 PolarHBondContact O-N 3.15Å
292	I	90.1	Very high	86.8	Confident	14 Å²	14	75.2 Å²	75.2	7%	0.072	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-67.9	-31.8	176.9	-60.2	-56.5	0	0	0	111.3	W285 K287 D294 L295 V300 E302 L321 Y334	W285-I292 HydrophobicContact CB-CD1 4.31Å; W285-I292 HydrophobicContact CB-CG1 3.78Å; K287-I292 HydrophobicContact CB-CD1 4.13Å; I292-D294 PolarHBondContact O-N 3.05Å; I292-L295 HydrophobicContact CD1-CD1 4.05Å; I292-L295 WeakPolarHBondContact O-CB 3.33Å; I292-L295 PolarHBondContact O-N 3.33Å; I292-V300 HydrophobicContact CG2-CG1 3.98Å; I292-E302 HydrophobicContact CG2-CB 4.44Å; I292-L321 HydrophobicContact CB-CD1 4.43Å; I292-L321 HydrophobicContact CD1-CD1 4.07Å; I292-L321 HydrophobicContact CD1-CD2 3.8Å; I292-L321 HydrophobicContact CG1-CD1 3.91Å; I292-L321 HydrophobicContact CG1-CD2 4.29Å; I292-L321 HydrophobicContact CG2-CD1 3.71Å; I292-Y334 HydrophobicContact CD1-CE1 4.47Å
293	E	84.9	Confident	86.7	Confident	171 Å²	171	72.4 Å²	72.4	80%	0.799	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-68.4	-17.5	175	62.7	-179.5	171.5	0	0	114.3	F291 L295	F291-E293 VanDerWaalsContact C-N 3.29Å; F291-E293 HydrophobicContact CB-CG 3.97Å; F291-E293 PolarHBondContact O-N 3.46Å; E293-L295 VanDerWaalsContact C-N 3.26Å; E293-L295 PolarHBondContact O-N 3.03Å
294	D	84.5	Confident	86.6	Confident	86 Å²	86	79 Å²	79	46%	0.46	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-86.3	10.6	173.7	-68.3	-44.8	0	0	0	113.2	F291 I292	F291-D294 WeakPolarHBondContact CD2-OD2 3.31Å; F291-D294 PolarHBondContact O-N 3.15Å; I292-D294 PolarHBondContact O-N 3.05Å
295	L	80.5	Confident	86.6	Confident	28 Å²	28	80.9 Å²	80.9	15%	0.147	40%	0.404	C	S	.	.	S	Bend	trans	-103	115.9	174.2	-54.4	177.4	0	0	0	108.3	K287 K290 I292 E293 E297 V300	K287-L295 HydrophobicContact CB-CD1 4.19Å; K287-L295 HydrophobicContact CD-CD1 3.72Å; K287-L295 HydrophobicContact CD-CD2 4.28Å; K290-L295 HydrophobicContact CD-CD2 3.91Å; I292-L295 HydrophobicContact CD1-CD1 4.05Å; I292-L295 WeakPolarHBondContact O-CB 3.33Å; I292-L295 PolarHBondContact O-N 3.33Å; E293-L295 VanDerWaalsContact C-N 3.26Å; E293-L295 PolarHBondContact O-N 3.03Å; L295-E297 PolarHBondContact O-N 3.43Å; L295-V300 HydrophobicContact CD1-CG1 4.32Å
296	D	63	Low	86.5	Confident	177 Å²	177	85.9 Å²	85.9	95%	0.947	43%	0.426	S	S	*	.			trans	-70.9	45.5	178.9	-71.4	-59.1	0	0	0	112.6
297	E	69.8	Low	86.5	Confident	63 Å²	63	89.4 Å²	89.4	29%	0.294	44%	0.444	S	S	.	.			trans	-137	98.8	-167.8	-65.2	-167.5	-107	0	0	112.9	L295 R299 V300	L295-E297 PolarHBondContact O-N 3.43Å; E297-R299 PolarHBondContact O-N 3.1Å; E297-R299 IonicContact OE1-NH2 2.76Å; E297-R299 IonicContact OE2-CZ 3.53Å; E297-R299 IonicContact OE2-NE 3.11Å; E297-R299 PolarHBondContact OE2-NE 3.42Å; E297-R299 IonicContact OE2-NH2 2.67Å; E297-R299 PolarHBondContact OE2-NH2 3.11Å; E297-V300 HydrophobicContact CB-CG2 4.45Å; E297-V300 PolarHBondContact O-N 3.36Å
298	E	76.7	Confident	86.6	Confident	184 Å²	184	90.6 Å²	90.6	86%	0.86	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-15.8	173.1	-61	-175.9	153.6	0	0	113.9	V300 Q301	E298-V300 VanDerWaalsContact C-N 3.34Å; E298-Q301 WeakPolarHBondContact O-CG 3.46Å; E298-Q301 PolarHBondContact O-NE2 3.38Å
299	R	85	Confident	86.9	Confident	38 Å²	38	96.2 Å²	96.2	14%	0.143	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-20	178.3	-171.9	-176.2	66.5	80.4	7.9	114	E297 I323 E324 S325 E327 D330	E297-R299 PolarHBondContact O-N 3.1Å; E297-R299 IonicContact OE1-NH2 2.76Å; E297-R299 IonicContact OE2-CZ 3.53Å; E297-R299 IonicContact OE2-NE 3.11Å; E297-R299 PolarHBondContact OE2-NE 3.42Å; E297-R299 IonicContact OE2-NH2 2.67Å; E297-R299 PolarHBondContact OE2-NH2 3.11Å; R299-I323 VanDerWaalsContact NH1-CG2 3.32Å; R299-E324 PolarHBondContact O-N 3.3Å; R299-S325 PolarHBondContact NH1-O 2.84Å; R299-E327 IonicContact NE-OE1 3.65Å; R299-D330 IonicContact CZ-OD1 3.39Å; R299-D330 IonicContact CZ-OD2 2.71Å; R299-D330 VanDerWaalsContact CZ-OD2 3.27Å; R299-D330 IonicContact NH1-OD1 2.84Å; R299-D330 IonicContact NH1-OD2 2.72Å; R299-D330 PolarHBondContact NH1-OD2 2.68Å; R299-D330 VanDerWaalsContact NH2-CG 3.31Å; R299-D330 IonicContact NH2-OD1 3.22Å; R299-D330 PolarHBondContact NH2-OD1 3.48Å; R299-D330 IonicContact NH2-OD2 3.13Å; R299-D330 PolarHBondContact NH2-OD2 3.36Å
300	V	87.6	Confident	87.1	Confident	11 Å²	11	91.9 Å²	91.9	7%	0.067	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	108.6	-178.1	-178.8	0	0	0	0	108.6	I292 L295 E297 E298 L321 I323	I292-V300 HydrophobicContact CG2-CG1 3.98Å; L295-V300 HydrophobicContact CD1-CG1 4.32Å; E297-V300 HydrophobicContact CB-CG2 4.45Å; E297-V300 PolarHBondContact O-N 3.36Å; E298-V300 VanDerWaalsContact C-N 3.34Å; V300-L321 HydrophobicContact CG1-CD1 3.81Å; V300-L321 HydrophobicContact CG1-CG 4.47Å; V300-I323 HydrophobicContact CG1-CG1 4.26Å; V300-I323 HydrophobicContact CG2-CG1 4.27Å; V300-I323 HydrophobicContact CG2-CG2 4.38Å
301	Q	87.8	Confident	87.2	Confident	103 Å²	103	90.6 Å²	90.6	48%	0.481	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	126	-171.5	-62.3	179.5	13.7	0	0	111.2	E298 T322	E298-Q301 WeakPolarHBondContact O-CG 3.46Å; E298-Q301 PolarHBondContact O-NE2 3.38Å; Q301-T322 PolarHBondContact N-O 3.47Å; Q301-T322 PolarHBondContact O-N 3.11Å; Q301-T322 PolarHBondContact O-OG1 2.93Å; Q301-T322 VanDerWaalsContact O-OG1 3.05Å
302	E	91.9	Very high	87.3	Confident	75 Å²	75	87.8 Å²	87.8	35%	0.35	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	134.3	166.9	-174.4	168.2	-101.8	0	0	109.9	W285 I292 I319 L321	W285-E302 VanDerWaalsContact CB-OE1 3.32Å; W285-E302 WeakPolarHBondContact CB-OE1 3.3Å; W285-E302 VanDerWaalsContact CD1-OE1 3.22Å; W285-E302 PolarHBondContact N-OE1 3.01Å; I292-E302 HydrophobicContact CG2-CB 4.44Å; E302-I319 HydrophobicContact CG-CD1 3.6Å; E302-I319 HydrophobicContact CG-CG1 3.87Å; E302-L321 HydrophobicContact CB-CD1 4.27Å
303	S	91.8	Very high	87.3	Confident	27 Å²	27	88 Å²	88	19%	0.189	43%	0.433	C	S	.	.			trans	-86.6	152.3	178.7	85.4	0	0	0	0	112.2	K306 I319 S320	S303-K306 PolarHBondContact OG-NZ 3.34Å; S303-I319 WeakPolarHBondContact O-CG1 3.42Å; S303-S320 PolarHBondContact N-O 3.09Å; S303-S320 PolarHBondContact OG-N 3.46Å
304	D	92.3	Very high	87.7	Confident	142 Å²	142	83 Å²	83	76%	0.759	41%	0.409	S	S	*	.			trans	-45	144.8	168	-57.9	-64.7	0	0	0	113.5	K306	D304-K306 PolarHBondContact O-N 2.97Å
305	I	94.1	Very high	88.1	Confident	80 Å²	80	81.1 Å²	81.1	41%	0.41	40%	0.398	S	S	.	.			trans	-63.2	118.1	176.2	-57.2	172.4	0	0	0	109.4	I283 V317 I319	I283-I305 HydrophobicContact CG2-CD1 3.8Å; I283-I305 HydrophobicContact CG2-CG1 3.89Å; I283-I305 HydrophobicContact CG2-CG2 3.83Å; I305-V317 HydrophobicContact CG2-CB 3.98Å; I305-V317 HydrophobicContact CG2-CG1 4.22Å; I305-V317 HydrophobicContact CG2-CG2 4.4Å; I305-I319 HydrophobicContact CG1-CD1 3.99Å; I305-I319 HydrophobicContact CG1-CG1 4.49Å
306	K	94.1	Very high	88.9	Confident	108 Å²	108	81.5 Å²	81.5	47%	0.47	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	121.2	-178.9	-72.1	149.4	-170.4	157.5	0	110.5	S303 D304 V308 V317 A318	S303-K306 PolarHBondContact OG-NZ 3.34Å; D304-K306 PolarHBondContact O-N 2.97Å; K306-V308 PolarHBondContact O-N 2.96Å; K306-V317 CarbonylContact O-C 3.56Å; K306-V317 WeakPolarHBondContact O-CA 3.38Å; K306-A318 PolarHBondContact N-O 2.99Å; K306-A318 PolarHBondContact O-N 2.82Å
307	L	94.2	Very high	90.4	Very high	95 Å²	95	73.2 Å²	73.2	50%	0.497	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	114.3	168	-174	64.3	0	0	0	109.2	R309 E310 Q315 V317	L307-R309 WeakPolarHBondContact CD1-O 3.3Å; L307-E310 HydrophobicContact CD1-CB 4.26Å; L307-E310 HydrophobicContact CD2-CB 4.1Å; L307-Q315 HydrophobicContact CD1-CB 3.94Å; L307-Q315 HydrophobicContact CD1-CG 3.99Å; L307-V317 HydrophobicContact CD1-CG1 4.05Å
308	V	94.3	Very high	91.7	Very high	65 Å²	65	70.7 Å²	70.7	39%	0.394	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-40.1	178.3	-177.9	0	0	0	0	110.2	K306 E316 A318	K306-V308 PolarHBondContact O-N 2.96Å; V308-E316 WeakPolarHBondContact CA-O 3.38Å; V308-E316 HydrophobicContact CB-CB 4.41Å; V308-E316 HydrophobicContact CB-CG 4.23Å; V308-E316 WeakPolarHBondContact CB-O 3.38Å; V308-E316 PolarHBondContact N-O 3.22Å; V308-A318 HydrophobicContact CG2-CB 3.66Å
309	R	93.4	Very high	92.6	Very high	161 Å²	161	62 Å²	62	61%	0.608	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.8	143.1	178.5	-173.4	177.8	179.6	177.2	-1.1	110.4	L307 E316	L307-R309 WeakPolarHBondContact CD1-O 3.3Å; R309-E316 HydrophobicContact CB-CB 4.02Å; R309-E316 PolarHBondContact N-O 3.5Å; R309-E316 VanDerWaalsContact N-O 3.13Å; R309-E316 PolarHBondContact O-N 3.26Å
310	E	92.8	Very high	93.1	Very high	103 Å²	103	61 Å²	61	48%	0.481	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	142.9	166.2	-177.9	165.8	-135.1	0	0	109.7	L307 E314 Q315	L307-E310 HydrophobicContact CD1-CB 4.26Å; L307-E310 HydrophobicContact CD2-CB 4.1Å; E310-E314 WeakPolarHBondContact CA-O 3.26Å; E310-Q315 HydrophobicContact CB-CG 4.45Å; E310-Q315 HydrophobicContact CG-CG 4.09Å; E310-Q315 PolarHBondContact OE1-NE2 2.76Å
311	H	92.3	Very high	93.4	Very high	85 Å²	85	60.5 Å²	60.5	39%	0.394	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	125.6	172.4	-179.6	60.9	0	0	0	109.3	E210 G313 E314	E210-H311 IonicContact OE1-CE1 2.93Å; E210-H311 PolarHBondContact OE1-CE1 3.23Å; H311-G313 PolarHBondContact O-N 3.18Å; H311-E314 PolarHBondContact N-O 3.26Å; H311-E314 WeakPolarHBondContact O-CB 3.03Å; H311-E314 PolarHBondContact O-N 3.44Å
312	L	92.1	Very high	93.7	Very high	28 Å²	28	57.9 Å²	57.9	15%	0.147	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	52	28	-176.2	-52.4	175.8	0	0	0	113.7	L158 E210 I213 V235 T236 A237 E314	L158-L312 HydrophobicContact CD2-CD1 4.45Å; E210-L312 HydrophobicContact CG-CD2 4.29Å; I213-L312 HydrophobicContact CD1-CD2 4.35Å; V235-L312 WeakPolarHBondContact O-CD2 3.47Å; T236-L312 CarbonylContact C-O 3.58Å; T236-L312 WeakPolarHBondContact CA-O 3.36Å; T236-L312 WeakPolarHBondContact CB-O 3.37Å; A237-L312 HydrophobicContact CB-CB 4.43Å; A237-L312 PolarHBondContact N-O 3.29Å; L312-E314 VanDerWaalsContact C-N 3.27Å; L312-E314 PolarHBondContact O-N 3.1Å
313	G	90.3	Very high	93.7	Very high	19 Å²	19	54.4 Å²	54.4	20%	0.196	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	76	3.9	-175.8	0	0	0	0	0	115.4	Y275 H311	Y275-G313 WeakPolarHBondContact CA-O 3.38Å; Y275-G313 WeakPolarHBondContact CD2-O 3.49Å; H311-G313 PolarHBondContact O-N 3.18Å
314	E	93.1	Very high	93.6	Very high	65 Å²	65	59.8 Å²	59.8	30%	0.304	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	136.2	162	-52.2	-166.9	117	0	0	109.1	A237 F272 F273 E310 H311 L312	A237-E314 HydrophobicContact CB-CG 3.58Å; F272-E314 HydrophobicContact CE2-CB 3.9Å; F272-E314 HydrophobicContact CZ-CB 3.88Å; F272-E314 HydrophobicContact CZ-CG 4.32Å; F273-E314 WeakPolarHBondContact O-CA 3.17Å; E310-E314 WeakPolarHBondContact CA-O 3.26Å; H311-E314 PolarHBondContact N-O 3.26Å; H311-E314 WeakPolarHBondContact O-CB 3.03Å; H311-E314 PolarHBondContact O-N 3.44Å; L312-E314 VanDerWaalsContact C-N 3.27Å; L312-E314 PolarHBondContact O-N 3.1Å
315	Q	94.1	Very high	93.5	Very high	47 Å²	47	55.3 Å²	55.3	22%	0.22	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125.4	-167.9	-66	-177.9	-9.2	0	0	111.8	F272 F273 L307 E310 V317	F272-Q315 WeakPolarHBondContact CA-O 3.44Å; F273-Q315 PolarHBondContact N-O 3.22Å; F273-Q315 PolarHBondContact O-N 3.5Å; L307-Q315 HydrophobicContact CD1-CB 3.94Å; L307-Q315 HydrophobicContact CD1-CG 3.99Å; E310-Q315 HydrophobicContact CB-CG 4.45Å; E310-Q315 HydrophobicContact CG-CG 4.09Å; E310-Q315 PolarHBondContact OE1-NE2 2.76Å; Q315-V317 HydrophobicContact CB-CG1 4.39Å
316	E	95.5	Very high	93.3	Very high	36 Å²	36	51.6 Å²	51.6	17%	0.168	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	117.1	163.5	-169.5	-173	150.9	0	0	107.7	L247 R270 A271 V308 R309	L247-E316 HydrophobicContact CD1-CG 3.93Å; R270-E316 VanDerWaalsContact CD-OE1 3.3Å; R270-E316 WeakPolarHBondContact CD-OE1 3.3Å; R270-E316 HydrophobicContact CG-CG 4.3Å; R270-E316 IonicContact CZ-OE1 2.68Å; R270-E316 IonicContact NE-OE1 2.59Å; R270-E316 IonicContact NH1-OE1 3.83Å; R270-E316 PolarHBondContact NH1-OE1 3.46Å; A271-E316 WeakPolarHBondContact O-CA 3.33Å; V308-E316 WeakPolarHBondContact CA-O 3.38Å; V308-E316 HydrophobicContact CB-CB 4.41Å; V308-E316 HydrophobicContact CB-CG 4.23Å; V308-E316 WeakPolarHBondContact CB-O 3.38Å; V308-E316 PolarHBondContact N-O 3.22Å; R309-E316 HydrophobicContact CB-CB 4.02Å; R309-E316 PolarHBondContact N-O 3.5Å; R309-E316 VanDerWaalsContact N-O 3.13Å; R309-E316 PolarHBondContact O-N 3.26Å
317	V	95.9	Very high	93.1	Very high	3 Å²	3	51 Å²	51	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	155.9	-179.9	-62.1	0	0	0	0	111.2	R270 A271 F273 P281 I283 I305 K306 L307 Q315	R270-V317 CarbonylContact C-O 3.52Å; R270-V317 WeakPolarHBondContact CA-O 3.28Å; A271-V317 PolarHBondContact N-O 2.93Å; A271-V317 PolarHBondContact O-N 3.44Å; F273-V317 HydrophobicContact CD2-CG2 3.74Å; F273-V317 HydrophobicContact CE2-CG2 3.44Å; F273-V317 VanDerWaalsContact CE2-CG2 3.44Å; P281-V317 HydrophobicContact CB-CG1 4.5Å; P281-V317 HydrophobicContact CB-CG2 4.31Å; P281-V317 HydrophobicContact CG-CG1 3.92Å; P281-V317 HydrophobicContact CG-CG2 4.5Å; I283-V317 HydrophobicContact CD1-CG2 4.31Å; I283-V317 HydrophobicContact CG2-CG2 4Å; I305-V317 HydrophobicContact CG2-CB 3.98Å; I305-V317 HydrophobicContact CG2-CG1 4.22Å; I305-V317 HydrophobicContact CG2-CG2 4.4Å; K306-V317 CarbonylContact O-C 3.56Å; K306-V317 WeakPolarHBondContact O-CA 3.38Å; L307-V317 HydrophobicContact CD1-CG1 4.05Å; Q315-V317 HydrophobicContact CB-CG1 4.39Å
318	A	96.6	Very high	92.7	Very high	9 Å²	9	52 Å²	52	7%	0.074	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	144.1	172.7	0	0	0	0	0	111.5	T268 C269 R270 K306 V308	T268-A318 HydrophobicContact CG2-CB 4.3Å; C269-A318 CarbonylContact O-C 3.55Å; C269-A318 WeakPolarHBondContact O-CA 3.33Å; C269-A318 WeakPolarHBondContact O-CB 3.34Å; R270-A318 HydrophobicContact CB-CB 4.33Å; K306-A318 PolarHBondContact N-O 2.99Å; K306-A318 PolarHBondContact O-N 2.82Å; V308-A318 HydrophobicContact CG2-CB 3.66Å
319	I	96.1	Very high	92.4	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.015	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	149.9	172.9	-154.6	172	0	0	0	108.1	T268 C269 I283 E302 S303 I305	T268-I319 CarbonylContact C-O 3.45Å; T268-I319 WeakPolarHBondContact CA-O 3.45Å; C269-I319 HydrophobicContact CB-CG2 4.08Å; C269-I319 PolarHBondContact N-O 3.32Å; C269-I319 PolarHBondContact O-N 2.92Å; C269-I319 VanDerWaalsContact O-O 3.14Å; I283-I319 HydrophobicContact CD1-CB 4.35Å; I283-I319 HydrophobicContact CD1-CG2 3.92Å; I283-I319 HydrophobicContact CG1-CB 4.28Å; I283-I319 HydrophobicContact CG1-CG2 3.72Å; I283-I319 WeakPolarHBondContact O-CD1 3.31Å; E302-I319 HydrophobicContact CG-CD1 3.6Å; E302-I319 HydrophobicContact CG-CG1 3.87Å; S303-I319 WeakPolarHBondContact O-CG1 3.42Å; I305-I319 HydrophobicContact CG1-CD1 3.99Å; I305-I319 HydrophobicContact CG1-CG1 4.49Å
320	S	95.4	Very high	92.1	Very high	15 Å²	15	48.8 Å²	48.8	11%	0.105	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	128.7	-177.2	-62.2	0	0	0	0	110.7	L267 T268 S303	L267-S320 WeakPolarHBondContact O-CA 3.18Å; T268-S320 PolarHBondContact OG1-OG 2.92Å; S303-S320 PolarHBondContact N-O 3.09Å; S303-S320 PolarHBondContact OG-N 3.46Å
321	L	94.5	Very high	92	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	118.3	171.5	-177.3	65.5	0	0	0	109.2	N266 L267 W285 I292 V300 E302 Y334	N266-L321 CarbonylContact C-O 3.59Å; N266-L321 WeakPolarHBondContact CA-O 3.38Å; L267-L321 HydrophobicContact CB-CB 4.39Å; L267-L321 PolarHBondContact N-O 3.47Å; L267-L321 PolarHBondContact O-N 2.89Å; W285-L321 HydrophobicContact CB-CD2 4.19Å; W285-L321 HydrophobicContact CD2-CB 4.29Å; W285-L321 HydrophobicContact CD2-CD2 4.44Å; W285-L321 HydrophobicContact CG-CB 3.97Å; W285-L321 HydrophobicContact CG-CD2 4.19Å; I292-L321 HydrophobicContact CB-CD1 4.43Å; I292-L321 HydrophobicContact CD1-CD1 4.07Å; I292-L321 HydrophobicContact CD1-CD2 3.8Å; I292-L321 HydrophobicContact CG1-CD1 3.91Å; I292-L321 HydrophobicContact CG1-CD2 4.29Å; I292-L321 HydrophobicContact CG2-CD1 3.71Å; V300-L321 HydrophobicContact CG1-CD1 3.81Å; V300-L321 HydrophobicContact CG1-CG 4.47Å; E302-L321 HydrophobicContact CB-CD1 4.27Å; L321-Y334 HydrophobicContact CD2-CD1 3.38Å; L321-Y334 HydrophobicContact CD2-CE1 3.62Å
322	T	92.9	Very high	91.9	Very high	49 Å²	49	43.7 Å²	43.7	30%	0.301	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	133	179	37.9	0	0	0	0	111.4	L265 N266 Q301	L265-T322 WeakPolarHBondContact O-CA 3.39Å; N266-T322 HydrophobicContact CB-CG2 4.04Å; Q301-T322 PolarHBondContact N-O 3.47Å; Q301-T322 PolarHBondContact O-N 3.11Å; Q301-T322 PolarHBondContact O-OG1 2.93Å; Q301-T322 VanDerWaalsContact O-OG1 3.05Å
323	I	92.3	Very high	92	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	115.7	175.7	-54.7	178	0	0	0	106.5	A264 L265 R299 V300 S325 L326 Y334	A264-I323 CarbonylContact C-O 3.58Å; A264-I323 WeakPolarHBondContact CA-O 3.4Å; L265-I323 HydrophobicContact CB-CB 4.41Å; L265-I323 PolarHBondContact N-O 3.19Å; L265-I323 PolarHBondContact O-N 3.14Å; R299-I323 VanDerWaalsContact NH1-CG2 3.32Å; V300-I323 HydrophobicContact CG1-CG1 4.26Å; V300-I323 HydrophobicContact CG2-CG1 4.27Å; V300-I323 HydrophobicContact CG2-CG2 4.38Å; I323-S325 PolarHBondContact O-N 3.36Å; I323-L326 HydrophobicContact CD1-CD1 4.21Å; I323-L326 HydrophobicContact CG2-CD1 4.41Å; I323-Y334 HydrophobicContact CD1-CE1 4.23Å
324	E	89.3	Confident	92.1	Very high	140 Å²	140	45 Å²	45	65%	0.654	23%	0.233	S	C	*	.	S	Bend	trans	-69.3	-34.9	-170.8	-65.1	-159.6	141.1	0	0	113.9	A264 R299	A264-E324 VanDerWaalsContact CA-O 3.3Å; A264-E324 WeakPolarHBondContact CA-O 3.46Å; A264-E324 VanDerWaalsContact CB-O 3.3Å; A264-E324 WeakPolarHBondContact CB-O 3.46Å; R299-E324 PolarHBondContact O-N 3.3Å
325	S	89.4	Confident	92.2	Very high	48 Å²	48	42.5 Å²	42.5	34%	0.336	22%	0.222	S	C	.	.	S	Bend	trans	-149.2	104.3	-178.7	166.3	0	0	0	0	108.7	R299 I323 E327	R299-S325 PolarHBondContact NH1-O 2.84Å; I323-S325 PolarHBondContact O-N 3.36Å; S325-E327 PolarHBondContact O-N 3.18Å
326	L	89.9	Confident	92.3	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.211	C	C	.	.			trans	-66.7	126	-174.3	-169.4	79.9	0	0	0	112.9	T259 L261 G262 S263 L265 I323 D330 L331 I351	T259-L326 HydrophobicContact CG2-CD2 4.46Å; T259-L326 WeakPolarHBondContact OG1-CD2 2.85Å; L261-L326 WeakPolarHBondContact CA-O 3.49Å; G262-L326 PolarHBondContact N-O 2.94Å; S263-L326 WeakPolarHBondContact O-CB 3.21Å; S263-L326 PolarHBondContact O-N 2.74Å; L265-L326 HydrophobicContact CD2-CD1 4.04Å; I323-L326 HydrophobicContact CD1-CD1 4.21Å; I323-L326 HydrophobicContact CG2-CD1 4.41Å; L326-D330 HydrophobicContact CD1-CB 3.41Å; L326-D330 VanDerWaalsContact CD1-CB 3.41Å; L326-D330 HydrophobicContact CG-CB 4.14Å; L326-L331 HydrophobicContact CD2-CD2 4.29Å; L326-I351 HydrophobicContact CD1-CD1 4.4Å; L326-I351 HydrophobicContact CD2-CG2 4.05Å
327	E	89.8	Confident	92.2	Very high	96 Å²	96	39 Å²	39	45%	0.449	21%	0.206	S	C	.	.			trans	-107.8	171.2	179	-59.6	-165.1	-165.6	0	0	112.1	R299 S325 E329 D330	R299-E327 IonicContact NE-OE1 3.65Å; S325-E327 PolarHBondContact O-N 3.18Å; E327-E329 PolarHBondContact O-N 2.88Å; E327-D330 PolarHBondContact N-OD2 2.8Å; E327-D330 PolarHBondContact O-N 2.63Å; E327-D330 VanDerWaalsContact O-N 3.1Å
328	E	87.1	Confident	92.2	Very high	116 Å²	116	38.9 Å²	38.9	54%	0.542	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-66.8	-24	179	-63.4	-155.9	134.5	0	0	112.3	L261 D330 L331 R353	L261-E328 HydrophobicContact CD1-CG 3.57Å; L261-E328 HydrophobicContact CD2-CG 3.94Å; L261-E328 HydrophobicContact CG-CG 4.42Å; E328-D330 PolarHBondContact O-N 2.97Å; E328-L331 HydrophobicContact CB-CD1 4.47Å; E328-L331 PolarHBondContact O-N 3.15Å; E328-R353 IonicContact OE1-CZ 2.82Å; E328-R353 IonicContact OE1-NH1 3.64Å; E328-R353 PolarHBondContact OE1-NH1 2.97Å
329	E	86.9	Confident	92	Very high	159 Å²	159	42.2 Å²	42.2	74%	0.743	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-76.1	-5.5	174.2	-55.8	-165.6	-164.1	0	0	113.5	K287 E327	K287-E329 WeakPolarHBondContact CE-O 3.3Å; K287-E329 PolarHBondContact NZ-O 3.43Å; E327-E329 PolarHBondContact O-N 2.88Å
330	D	87.8	Confident	91.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-96.1	-2.3	170.1	-60.6	-46.2	0	0	0	113.8	K287 R299 L326 E327 E328 G332 Y334	K287-D330 IonicContact NZ-OD1 2.62Å; K287-D330 PolarHBondContact NZ-OD1 3.13Å; R299-D330 IonicContact CZ-OD1 3.39Å; R299-D330 IonicContact CZ-OD2 2.71Å; R299-D330 VanDerWaalsContact CZ-OD2 3.27Å; R299-D330 IonicContact NH1-OD1 2.84Å; R299-D330 IonicContact NH1-OD2 2.72Å; R299-D330 PolarHBondContact NH1-OD2 2.68Å; R299-D330 VanDerWaalsContact NH2-CG 3.31Å; R299-D330 IonicContact NH2-OD1 3.22Å; R299-D330 PolarHBondContact NH2-OD1 3.48Å; R299-D330 IonicContact NH2-OD2 3.13Å; R299-D330 PolarHBondContact NH2-OD2 3.36Å; L326-D330 HydrophobicContact CD1-CB 3.41Å; L326-D330 VanDerWaalsContact CD1-CB 3.41Å; L326-D330 HydrophobicContact CG-CB 4.14Å; E327-D330 PolarHBondContact N-OD2 2.8Å; E327-D330 PolarHBondContact O-N 2.63Å; E327-D330 VanDerWaalsContact O-N 3.1Å; E328-D330 PolarHBondContact O-N 2.97Å; D330-G332 PolarHBondContact O-N 2.65Å; D330-Y334 WeakPolarHBondContact O-CE2 3.39Å; D330-Y334 PolarHBondContact OD1-OH 2.91Å
331	L	90.4	Very high	91.4	Very high	59 Å²	59	47.1 Å²	47.1	31%	0.309	25%	0.251	S	S	.	.			trans	-77.1	119.2	177.8	-58.8	178.4	0	0	0	109.2	L261 L326 E328 I351 R353	L261-L331 HydrophobicContact CD2-CD1 4.45Å; L326-L331 HydrophobicContact CD2-CD2 4.29Å; E328-L331 HydrophobicContact CB-CD1 4.47Å; E328-L331 PolarHBondContact O-N 3.15Å; L331-I351 HydrophobicContact CD2-CG2 3.97Å; L331-R353 HydrophobicContact CD1-CB 3.89Å; L331-R353 HydrophobicContact CD2-CB 4.41Å
332	G	91.1	Very high	91.2	Very high	22 Å²	22	51.5 Å²	51.5	23%	0.227	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.3	-158.3	-175.3	0	0	0	0	0	114.7	D330 Q350 I351	D330-G332 PolarHBondContact O-N 2.65Å; G332-Q350 WeakPolarHBondContact O-CA 3.26Å; G332-I351 PolarHBondContact N-O 2.66Å; G332-I351 PolarHBondContact O-N 2.98Å
333	N	93.3	Very high	91.1	Very high	74 Å²	74	50.3 Å²	50.3	40%	0.396	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	119.5	-173.5	-67.6	-6.4	0	0	0	111	G288 T348 Q350	G288-N333 PolarHBondContact N-O 2.79Å; N333-T348 HydrophobicContact CB-CG2 3.8Å; N333-Q350 WeakPolarHBondContact OD1-CG 3.41Å; N333-Q350 PolarHBondContact OD1-NE2 2.89Å
334	Y	93.5	Very high	91.1	Very high	1 Å²	1	54.6 Å²	54.6	0%	0.004	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	117.6	170.2	-72.5	-103.8	0	0	0	108.2	L267 M286 K287 I292 L321 I323 D330 T348 I349 I351	L267-Y334 HydrophobicContact CD1-CD1 4.35Å; L267-Y334 HydrophobicContact CD1-CG 3.97Å; M286-Y334 WeakPolarHBondContact O-CA 3.49Å; K287-Y334 HydrophobicContact CB-CD1 4.33Å; K287-Y334 HydrophobicContact CB-CE1 4.04Å; K287-Y334 HydrophobicContact CD-CE1 3.99Å; K287-Y334 WeakPolarHBondContact CD-OH 3.45Å; K287-Y334 WeakPolarHBondContact CE-OH 3.49Å; K287-Y334 HydrophobicContact CG-CD1 4.47Å; K287-Y334 HydrophobicContact CG-CE1 3.88Å; K287-Y334 HydrophobicContact CG-CE2 4.21Å; K287-Y334 PolarHBondContact NZ-OH 3.38Å; I292-Y334 HydrophobicContact CD1-CE1 4.47Å; L321-Y334 HydrophobicContact CD2-CD1 3.38Å; L321-Y334 HydrophobicContact CD2-CE1 3.62Å; I323-Y334 HydrophobicContact CD1-CE1 4.23Å; D330-Y334 WeakPolarHBondContact O-CE2 3.39Å; D330-Y334 PolarHBondContact OD1-OH 2.91Å; Y334-T348 CarbonylContact O-C 3.58Å; Y334-T348 WeakPolarHBondContact O-CA 3.45Å; Y334-I349 PolarHBondContact N-O 2.83Å; Y334-I349 PolarHBondContact O-N 2.86Å; Y334-I351 HydrophobicContact CD2-CD1 3.51Å; Y334-I351 HydrophobicContact CD2-CG1 4.05Å; Y334-I351 HydrophobicContact CE2-CD1 3.4Å; Y334-I351 VanDerWaalsContact CE2-CD1 3.4Å; Y334-I351 HydrophobicContact CE2-CG1 4.3Å; Y334-I351 HydrophobicContact CG-CD1 4.4Å
335	S	94.7	Very high	91.3	Very high	11 Å²	11	49.3 Å²	49.3	8%	0.077	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	127	-179.6	-63.5	0	0	0	0	109.7	W285 M286 H337 T348	W285-S335 CarbonylContact C-O 3.55Å; W285-S335 WeakPolarHBondContact CA-O 3.33Å; W285-S335 VanDerWaalsContact CE3-C 3.42Å; M286-S335 PolarHBondContact N-O 3.37Å; M286-S335 PolarHBondContact O-N 3.48Å; S335-H337 VanDerWaalsContact CB-NE2 3.29Å; S335-H337 WeakPolarHBondContact CB-NE2 3.34Å; S335-T348 PolarHBondContact OG-OG1 2.83Å
336	C	95.3	Very high	91.5	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	130.9	162.8	176.5	0	0	0	0	108.5	C269 W285 N346 A347	C269-C336 HydrophobicContact CB-CB 3.52Å; C269-C336 WeakPolarHBondContact CB-SG 3.41Å; C269-C336 WeakPolarHBondContact SG-CB 3.36Å; C269-C336 CovalentContact SG-SG 2.02Å; C269-C336 PolarHBondContact SG-SG 3.29Å; W285-C336 HydrophobicContact CD2-CB 4.2Å; W285-C336 HydrophobicContact CE3-CB 4Å; W285-C336 HydrophobicContact CH2-CB 3.98Å; W285-C336 HydrophobicContact CZ2-CB 4.22Å; W285-C336 HydrophobicContact CZ3-CB 3.88Å; C336-N346 CarbonylContact O-C 3.6Å; C336-N346 WeakPolarHBondContact O-CA 3.14Å; C336-N346 VanDerWaalsContact O-CB 3.28Å; C336-N346 WeakPolarHBondContact O-CB 3.32Å; C336-A347 PolarHBondContact N-O 2.96Å; C336-A347 PolarHBondContact O-N 3.03Å
337	H	94.1	Very high	91.7	Very high	11 Å²	11	50.1 Å²	50.1	5%	0.051	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.1	179.6	-77	-115.1	0	0	0	109.5	I283 Y284 M286 S335 H344 N346	I283-H337 WeakPolarHBondContact CA-O 3.35Å; Y284-H337 HydrophobicContact CD1-CB 4.38Å; Y284-H337 HydrophobicContact CD2-CB 4.12Å; Y284-H337 HydrophobicContact CE1-CB 3.91Å; Y284-H337 HydrophobicContact CE2-CB 3.63Å; Y284-H337 HydrophobicContact CG-CB 4.48Å; Y284-H337 PolarHBondContact N-O 2.95Å; Y284-H337 VanDerWaalsContact N-O 3.09Å; Y284-H337 PolarHBondContact O-N 3.03Å; M286-H337 WeakPolarHBondContact CE-CE1 3.43Å; M286-H337 WeakPolarHBondContact CE-NE2 3.27Å; S335-H337 VanDerWaalsContact CB-NE2 3.29Å; S335-H337 WeakPolarHBondContact CB-NE2 3.34Å; H337-H344 AromaticContact CE1-NE2 3.24Å; H337-H344 PolarHBondContact CE1-NE2 2.81Å; H337-H344 AromaticContact ND1-NE2 3.12Å; H337-H344 PolarHBondContact ND1-NE2 2.97Å; H337-H344 VanDerWaalsContact ND1-NE2 3.12Å; H337-N346 PolarHBondContact CE1-ND2 3.48Å; H337-N346 PolarHBondContact NE2-ND2 2.99Å; H337-N346 VanDerWaalsContact NE2-ND2 3.15Å
338	V	94.9	Very high	91.9	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	137.8	174.1	-63.4	0	0	0	0	111.3	P244 I246 A271 F273 L282 I283 H344 I345	P244-V338 HydrophobicContact CB-CB 4.13Å; P244-V338 HydrophobicContact CB-CG2 3.82Å; P244-V338 HydrophobicContact CG-CB 4.34Å; P244-V338 HydrophobicContact CG-CG2 4.3Å; I246-V338 HydrophobicContact CD1-CG2 3.96Å; I246-V338 HydrophobicContact CG1-CG1 4.39Å; I246-V338 HydrophobicContact CG1-CG2 3.48Å; I246-V338 VanDerWaalsContact CG1-CG2 3.48Å; A271-V338 HydrophobicContact CB-CB 4.5Å; A271-V338 HydrophobicContact CB-CG1 3.73Å; A271-V338 HydrophobicContact CB-CG2 4.46Å; F273-V338 HydrophobicContact CE2-CG1 4.45Å; F273-V338 HydrophobicContact CZ-CB 3.91Å; F273-V338 HydrophobicContact CZ-CG1 4.06Å; L282-V338 WeakPolarHBondContact O-CA 3.44Å; I283-V338 HydrophobicContact CB-CG1 3.78Å; I283-V338 HydrophobicContact CD1-CG1 3.85Å; I283-V338 HydrophobicContact CG1-CG1 3.61Å; V338-H344 WeakPolarHBondContact O-CA 3.23Å; V338-I345 HydrophobicContact CG2-CD1 4.14Å; V338-I345 HydrophobicContact CG2-CG1 3.5Å; V338-I345 VanDerWaalsContact CG2-CG1 3.5Å; V338-I345 PolarHBondContact N-O 3.45Å; V338-I345 PolarHBondContact O-N 3.3Å
339	E	92.8	Very high	92.2	Very high	79 Å²	79	41.6 Å²	41.6	37%	0.369	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	144.2	-171.8	-178.4	169.4	172.4	0	0	112.3	L282 G343 H344	L282-E339 HydrophobicContact CD2-CB 4.27Å; L282-E339 PolarHBondContact O-N 2.83Å; E339-G343 WeakPolarHBondContact CA-O 3.34Å; E339-H344 HydrophobicContact CB-CB 4.15Å; E339-H344 HydrophobicContact CG-CB 3.98Å; E339-H344 IonicContact OE2-CD2 3.75Å
340	N	91.7	Very high	92.5	Very high	25 Å²	25	36.8 Å²	36.8	13%	0.134	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	-179.7	163	75.4	14.6	0	0	0	110.1	D242 P244 H342 G343	D242-N340 PolarHBondContact O-ND2 3.27Å; P244-N340 HydrophobicContact CG-CB 3.98Å; N340-H342 PolarHBondContact O-N 3.39Å; N340-H342 WeakPolarHBondContact OD1-CA 3.14Å; N340-H342 WeakPolarHBondContact OD1-CB 3.35Å; N340-H342 PolarHBondContact OD1-N 3.29Å; N340-G343 PolarHBondContact N-O 2.69Å; N340-G343 PolarHBondContact O-N 3.35Å; N340-G343 VanDerWaalsContact O-N 3.1Å; N340-G343 PolarHBondContact OD1-N 2.87Å
341	S	88.6	Confident	92.7	Very high	95 Å²	95	36.9 Å²	36.9	66%	0.664	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-7.2	-179.5	59.7	0	0	0	0	116.2
342	H	90.1	Very high	92.7	Very high	93 Å²	93	38.1 Å²	38.1	43%	0.431	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112	-12.4	179.9	-58.2	107.6	0	0	0	113.3	T240 N340	T240-H342 PolarHBondContact O-CE1 3.03Å; T240-H342 PolarHBondContact O-ND1 3.42Å; N340-H342 PolarHBondContact O-N 3.39Å; N340-H342 WeakPolarHBondContact OD1-CA 3.14Å; N340-H342 WeakPolarHBondContact OD1-CB 3.35Å; N340-H342 PolarHBondContact OD1-N 3.29Å
343	G	90.6	Very high	92.4	Very high	25 Å²	25	44.1 Å²	44.1	26%	0.258	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	165	170.1	172.9	0	0	0	0	0	115.1	E339 N340	E339-G343 WeakPolarHBondContact CA-O 3.34Å; N340-G343 PolarHBondContact N-O 2.69Å; N340-G343 PolarHBondContact O-N 3.35Å; N340-G343 VanDerWaalsContact O-N 3.1Å; N340-G343 PolarHBondContact OD1-N 2.87Å
344	H	92.2	Very high	91.8	Very high	91 Å²	91	46.9 Å²	46.9	42%	0.421	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.9	-178.1	158.6	-67.4	0	0	0	108.9	H337 V338 E339	H337-H344 AromaticContact CE1-NE2 3.24Å; H337-H344 PolarHBondContact CE1-NE2 2.81Å; H337-H344 AromaticContact ND1-NE2 3.12Å; H337-H344 PolarHBondContact ND1-NE2 2.97Å; H337-H344 VanDerWaalsContact ND1-NE2 3.12Å; V338-H344 WeakPolarHBondContact O-CA 3.23Å; E339-H344 HydrophobicContact CB-CB 4.15Å; E339-H344 HydrophobicContact CG-CB 3.98Å; E339-H344 IonicContact OE2-CD2 3.75Å
345	I	92.9	Very high	90.5	Very high	29 Å²	29	50.5 Å²	50.5	15%	0.149	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	158.5	172.1	64.2	164.3	0	0	0	110.8	P244 I246 E251 V338	P244-I345 WeakPolarHBondContact O-CD1 3.43Å; I246-I345 HydrophobicContact CD1-CD1 4.31Å; I246-I345 HydrophobicContact CD1-CG1 4.24Å; I246-I345 HydrophobicContact CG1-CD1 3.88Å; I246-I345 HydrophobicContact CG1-CG1 4.17Å; E251-I345 HydrophobicContact CG-CD1 4.44Å; V338-I345 HydrophobicContact CG2-CD1 4.14Å; V338-I345 HydrophobicContact CG2-CG1 3.5Å; V338-I345 VanDerWaalsContact CG2-CG1 3.5Å; V338-I345 PolarHBondContact N-O 3.45Å; V338-I345 PolarHBondContact O-N 3.3Å
346	N	93.7	Very high	89	Confident	63 Å²	63	56.7 Å²	56.7	34%	0.337	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	160.6	177.7	68	-19	0	0	0	113.1	C336 H337	C336-N346 CarbonylContact O-C 3.6Å; C336-N346 WeakPolarHBondContact O-CA 3.14Å; C336-N346 VanDerWaalsContact O-CB 3.28Å; C336-N346 WeakPolarHBondContact O-CB 3.32Å; H337-N346 PolarHBondContact CE1-ND2 3.48Å; H337-N346 PolarHBondContact NE2-ND2 2.99Å; H337-N346 VanDerWaalsContact NE2-ND2 3.15Å
347	A	94.3	Very high	87.2	Confident	4 Å²	4	62.5 Å²	62.5	3%	0.033	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	131.4	175	0	0	0	0	0	110.6	I246 P249 C336	I246-A347 HydrophobicContact CD1-CB 3.69Å; I246-A347 HydrophobicContact CG2-CB 4.22Å; P249-A347 HydrophobicContact CG-CB 3.86Å; C336-A347 PolarHBondContact N-O 2.96Å; C336-A347 PolarHBondContact O-N 3.03Å
348	T	93.8	Very high	85.4	Confident	29 Å²	29	68.6 Å²	68.6	18%	0.178	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.2	-169.1	-51.2	0	0	0	0	112.4	T254 T255 N333 Y334 S335	T254-T348 WeakPolarHBondContact CA-O 3.38Å; T255-T348 PolarHBondContact N-O 2.69Å; N333-T348 HydrophobicContact CB-CG2 3.8Å; Y334-T348 CarbonylContact O-C 3.58Å; Y334-T348 WeakPolarHBondContact O-CA 3.45Å; S335-T348 PolarHBondContact OG-OG1 2.83Å
349	I	94.3	Very high	83.8	Confident	4 Å²	4	76.4 Å²	76.4	2%	0.021	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	135	163.9	-53.9	-170.9	0	0	0	107.5	P249 T255 M257 L267 W285 Y334	P249-I349 HydrophobicContact CB-CD1 4.11Å; P249-I349 HydrophobicContact CB-CG1 3.85Å; P249-I349 HydrophobicContact CG-CD1 4.09Å; P249-I349 HydrophobicContact CG-CG1 3.78Å; T255-I349 CarbonylContact O-C 3.58Å; T255-I349 VanDerWaalsContact O-CA 3.31Å; T255-I349 WeakPolarHBondContact O-CA 3.22Å; T255-I349 WeakPolarHBondContact O-CG2 3.37Å; M257-I349 HydrophobicContact CB-CG2 4.14Å; L267-I349 HydrophobicContact CB-CD1 4.39Å; L267-I349 HydrophobicContact CD1-CD1 4.46Å; L267-I349 HydrophobicContact CD2-CD1 4.03Å; L267-I349 HydrophobicContact CD2-CG2 4.25Å; W285-I349 HydrophobicContact CH2-CD1 3.71Å; W285-I349 HydrophobicContact CH2-CG1 4.12Å; W285-I349 HydrophobicContact CZ3-CD1 4.4Å; W285-I349 HydrophobicContact CZ3-CG1 4.39Å; Y334-I349 PolarHBondContact N-O 2.83Å; Y334-I349 PolarHBondContact O-N 2.86Å
350	Q	93.1	Very high	82.4	Confident	58 Å²	58	76.2 Å²	76.2	27%	0.271	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	115.4	174	-168.9	168.3	16.8	0	0	109.8	T254 T255 N256 M257 G332 N333 F352	T254-Q350 HydrophobicContact CG2-CB 3.71Å; T255-Q350 PolarHBondContact O-N 3.07Å; N256-Q350 WeakPolarHBondContact CA-O 3.5Å; M257-Q350 PolarHBondContact N-O 2.97Å; G332-Q350 WeakPolarHBondContact O-CA 3.26Å; N333-Q350 WeakPolarHBondContact OD1-CG 3.41Å; N333-Q350 PolarHBondContact OD1-NE2 2.89Å; Q350-F352 HydrophobicContact CB-CE2 3.87Å; Q350-F352 HydrophobicContact CB-CZ 4.39Å; Q350-F352 HydrophobicContact CG-CD2 4.15Å; Q350-F352 HydrophobicContact CG-CE1 4.26Å; Q350-F352 HydrophobicContact CG-CE2 3.46Å; Q350-F352 VanDerWaalsContact CG-CE2 3.46Å; Q350-F352 HydrophobicContact CG-CZ 3.55Å
351	I	92.5	Very high	81.2	Confident	2 Å²	2	79.7 Å²	79.7	1%	0.01	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	128	-179.2	-51	174.4	0	0	0	109	T259 L265 L267 L326 L331 G332 Y334	T259-I351 HydrophobicContact CG2-CG2 4.3Å; T259-I351 WeakPolarHBondContact OG1-CG2 3.37Å; L265-I351 HydrophobicContact CD2-CD1 3.53Å; L265-I351 HydrophobicContact CD2-CG1 4.23Å; L265-I351 HydrophobicContact CD2-CG2 4.49Å; L267-I351 HydrophobicContact CD1-CD1 4.27Å; L326-I351 HydrophobicContact CD1-CD1 4.4Å; L326-I351 HydrophobicContact CD2-CG2 4.05Å; L331-I351 HydrophobicContact CD2-CG2 3.97Å; G332-I351 PolarHBondContact N-O 2.66Å; G332-I351 PolarHBondContact O-N 2.98Å; Y334-I351 HydrophobicContact CD2-CD1 3.51Å; Y334-I351 HydrophobicContact CD2-CG1 4.05Å; Y334-I351 HydrophobicContact CE2-CD1 3.4Å; Y334-I351 VanDerWaalsContact CE2-CD1 3.4Å; Y334-I351 HydrophobicContact CE2-CG1 4.3Å; Y334-I351 HydrophobicContact CG-CD1 4.4Å
352	F	89.3	Confident	80.4	Confident	84 Å²	84	81.7 Å²	81.7	37%	0.368	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	141.1	176.1	-67.5	-79.6	0	0	0	111.4	N256 M257 E258 T259 Q350 R354	N256-F352 HydrophobicContact CB-CD2 4.29Å; N256-F352 HydrophobicContact CB-CE2 4.17Å; M257-F352 PolarHBondContact O-N 3.47Å; E258-F352 WeakPolarHBondContact CA-O 3.19Å; T259-F352 PolarHBondContact N-O 3.14Å; Q350-F352 HydrophobicContact CB-CE2 3.87Å; Q350-F352 HydrophobicContact CB-CZ 4.39Å; Q350-F352 HydrophobicContact CG-CD2 4.15Å; Q350-F352 HydrophobicContact CG-CE1 4.26Å; Q350-F352 HydrophobicContact CG-CE2 3.46Å; Q350-F352 VanDerWaalsContact CG-CE2 3.46Å; Q350-F352 HydrophobicContact CG-CZ 3.55Å; F352-R354 PolarHBondContact O-N 2.75Å
353	R	85.9	Confident	79.7	Confident	149 Å²	149	81.6 Å²	81.6	56%	0.562	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.9	122.3	170.6	-179.6	176.6	176	170.1	-1.2	110.1	L261 E328 L331 A355	L261-R353 HydrophobicContact CG-CG 4.49Å; E328-R353 IonicContact OE1-CZ 2.82Å; E328-R353 IonicContact OE1-NH1 3.64Å; E328-R353 PolarHBondContact OE1-NH1 2.97Å; L331-R353 HydrophobicContact CD1-CB 3.89Å; L331-R353 HydrophobicContact CD2-CB 4.41Å; R353-A355 PolarHBondContact O-N 3.48Å
354	R	79.3	Confident	79	Confident	131 Å²	131	83.5 Å²	83.5	49%	0.494	42%	0.42	S	S	.	.			trans	-59.8	128.4	175.9	-170.4	178.8	-171.7	-170.3	1.7	111.1	E258 T259 Q260 F352	E258-R354 HydrophobicContact CB-CB 4.39Å; T259-R354 VanDerWaalsContact O-CB 3.3Å; T259-R354 WeakPolarHBondContact O-CB 3.45Å; T259-R354 PolarHBondContact O-N 3.01Å; Q260-R354 HydrophobicContact CG-CB 4.32Å; F352-R354 PolarHBondContact O-N 2.75Å
355	A	67.3	Low	78.3	Confident	77 Å²	77	81.4 Å²	81.4	64%	0.636	42%	0.423	S	S	*	.			trans	-87.5	110.3	-178.3	0	0	0	0	0	111.9	R353 L357	R353-A355 PolarHBondContact O-N 3.48Å; A355-L357 VanDerWaalsContact C-N 3.3Å; A355-L357 PolarHBondContact O-N 3Å
356	E	62	Low	77.8	Confident	142 Å²	142	81.8 Å²	81.8	66%	0.664	43%	0.434	S	S	*	.			trans	-81.1	70.1	-177.2	-62.8	-171.3	164.9	0	0	112.6	Q260 M358	Q260-E356 PolarHBondContact NE2-OE1 3.1Å; E356-M358 PolarHBondContact O-N 2.94Å
357	L	57.3	Low	77.3	Confident	122 Å²	122	84.1 Å²	84.1	64%	0.639	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-1.3	-174.1	-139.5	83.3	0	0	0	115.3	A355 Y359 T360	A355-L357 VanDerWaalsContact C-N 3.3Å; A355-L357 PolarHBondContact O-N 3Å; L357-Y359 PolarHBondContact O-N 2.83Å; L357-T360 PolarHBondContact O-OG1 3.06Å
358	M	57.1	Low	76.8	Confident	139 Å²	139	85.5 Å²	85.5	69%	0.685	46%	0.46	S	S	*	.	H	α-helix	trans	-64.9	-42.5	-171.9	-74.5	177.5	58.5	0	0	113.4	E356 T360 V361 E362	E356-M358 PolarHBondContact O-N 2.94Å; M358-T360 VanDerWaalsContact C-N 3.32Å; M358-T360 PolarHBondContact O-N 3.19Å; M358-V361 PolarHBondContact O-N 3.26Å; M358-E362 PolarHBondContact O-N 2.86Å
359	Y	60.7	Low	76.5	Confident	164 Å²	164	86.9 Å²	86.9	64%	0.643	48%	0.475	S	S	*	.	H	α-helix	trans	-55.2	-42.3	-175.4	150.7	-110.4	0	0	0	113.4	L357 L363	L357-Y359 PolarHBondContact O-N 2.83Å; Y359-L363 HydrophobicContact CE2-CD1 4.35Å; Y359-L363 HydrophobicContact CE2-CD2 4.3Å; Y359-L363 WeakPolarHBondContact O-CB 3.47Å; Y359-L363 PolarHBondContact O-N 2.96Å
360	T	63	Low	76.3	Confident	74 Å²	74	91.7 Å²	91.7	45%	0.454	50%	0.5	S	S	.	.	H	α-helix	trans	-73.9	-33.2	-174.4	56.1	0	0	0	0	112.7	L357 M358 A364	L357-T360 PolarHBondContact O-OG1 3.06Å; M358-T360 VanDerWaalsContact C-N 3.32Å; M358-T360 PolarHBondContact O-N 3.19Å; T360-A364 WeakPolarHBondContact O-CB 3.34Å; T360-A364 PolarHBondContact O-N 2.8Å; T360-A364 VanDerWaalsContact O-N 3.1Å
361	V	67.3	Low	76.1	Confident	98 Å²	98	94 Å²	94	59%	0.594	51%	0.513	S	S	*	.	H	α-helix	trans	-73.1	-43.1	-179.4	-177.9	0	0	0	0	111	M358 A364 G365	M358-V361 PolarHBondContact O-N 3.26Å; V361-A364 PolarHBondContact O-N 2.85Å; V361-G365 PolarHBondContact O-N 2.88Å
362	E	71.6	Confident	75.9	Confident	137 Å²	137	99.9 Å²	99.9	64%	0.64	54%	0.544	S	S	*	.	H	α-helix	trans	-65.4	-42.1	177.1	-68	-175.2	179.5	0	0	111.8	M358 A364 G365 G366	M358-E362 PolarHBondContact O-N 2.86Å; E362-A364 PolarHBondContact O-N 2.8Å; E362-G365 PolarHBondContact O-N 3.37Å; E362-G366 PolarHBondContact O-N 3.4Å
363	L	75.5	Confident	76	Confident	92 Å²	92	100.9 Å²	100.9	48%	0.482	55%	0.552	S	S	.	*	H	α-helix	trans	-62.9	-43.5	176.8	-155.3	84.1	0	0	0	111.9	Y359 G366 L367	Y359-L363 HydrophobicContact CE2-CD1 4.35Å; Y359-L363 HydrophobicContact CE2-CD2 4.3Å; Y359-L363 WeakPolarHBondContact O-CB 3.47Å; Y359-L363 PolarHBondContact O-N 2.96Å; L363-G366 PolarHBondContact O-N 3.45Å; L363-L367 HydrophobicContact CG-CD1 4.49Å; L363-L367 WeakPolarHBondContact O-CG 3.5Å; L363-L367 PolarHBondContact O-N 3.38Å; L363-L367 VanDerWaalsContact O-N 3.09Å
364	A	76.7	Confident	76.2	Confident	64 Å²	64	98.1 Å²	98.1	53%	0.529	55%	0.549	S	S	.	.	H	α-helix	trans	-64.9	-40.9	177	0	0	0	0	0	112.2	T360 V361 E362 G368	T360-A364 WeakPolarHBondContact O-CB 3.34Å; T360-A364 PolarHBondContact O-N 2.8Å; T360-A364 VanDerWaalsContact O-N 3.1Å; V361-A364 PolarHBondContact O-N 2.85Å; E362-A364 PolarHBondContact O-N 2.8Å; A364-G368 PolarHBondContact O-N 3.1Å
365	G	77.9	Confident	76.7	Confident	47 Å²	47	96.6 Å²	96.6	49%	0.485	55%	0.549	S	S	.	.	H	α-helix	trans	-61.5	-46.1	175.1	0	0	0	0	0	112.7	V361 E362 G368 A369	V361-G365 PolarHBondContact O-N 2.88Å; E362-G365 PolarHBondContact O-N 3.37Å; G365-G368 PolarHBondContact O-N 3.3Å; G365-A369 PolarHBondContact O-N 3.21Å
366	G	81.4	Confident	77.7	Confident	37 Å²	37	99.1 Å²	99.1	38%	0.381	55%	0.546	S	S	.	.	H	α-helix	trans	-60.6	-47.6	177.2	0	0	0	0	0	113	E362 L363 G368 A369 I370	E362-G366 PolarHBondContact O-N 3.4Å; L363-G366 PolarHBondContact O-N 3.45Å; G366-G368 PolarHBondContact O-N 3.35Å; G366-A369 PolarHBondContact O-N 3.3Å; G366-I370 WeakPolarHBondContact O-CG1 2.96Å; G366-I370 PolarHBondContact O-N 3.04Å; G366-I370 VanDerWaalsContact O-N 3.15Å
367	L	84.3	Confident	78.9	Confident	112 Å²	112	96.8 Å²	96.8	59%	0.586	54%	0.538	S	S	*	.	H	α-helix	trans	-63.3	-40.2	177.6	-70	169.5	0	0	0	112.3	L363 I370 L371	L363-L367 HydrophobicContact CG-CD1 4.49Å; L363-L367 WeakPolarHBondContact O-CG 3.5Å; L363-L367 PolarHBondContact O-N 3.38Å; L363-L367 VanDerWaalsContact O-N 3.09Å; L367-I370 PolarHBondContact O-N 2.87Å; L367-L371 PolarHBondContact O-N 2.79Å; L367-L371 VanDerWaalsContact O-N 3.11Å
368	G	83.9	Confident	80.3	Confident	33 Å²	33	95.9 Å²	95.9	34%	0.34	53%	0.532	S	S	.	.	H	α-helix	trans	-63	-41.7	175.9	0	0	0	0	0	113.3	A364 G365 G366 L371 L372	A364-G368 PolarHBondContact O-N 3.1Å; G365-G368 PolarHBondContact O-N 3.3Å; G366-G368 PolarHBondContact O-N 3.35Å; G368-L371 PolarHBondContact O-N 2.99Å; G368-L372 PolarHBondContact O-N 2.72Å; G368-L372 VanDerWaalsContact O-N 3.1Å
369	A	86.7	Confident	81.6	Confident	59 Å²	59	92.4 Å²	92.4	49%	0.488	52%	0.521	S	S	.	.	H	α-helix	trans	-64.4	-42.6	177.3	0	0	0	0	0	112.5	G365 G366 L372 L373	G365-A369 PolarHBondContact O-N 3.21Å; G366-A369 PolarHBondContact O-N 3.3Å; A369-L372 PolarHBondContact O-N 3.01Å; A369-L373 WeakPolarHBondContact O-CB 3.42Å; A369-L373 PolarHBondContact O-N 2.91Å; A369-L373 VanDerWaalsContact O-N 3.08Å
370	I	89.1	Confident	82.6	Confident	105 Å²	105	87.9 Å²	87.9	54%	0.538	51%	0.508	S	S	.	.	H	α-helix	trans	-62.2	-44	177	-66.9	164.2	0	0	0	110.8	G366 L367 L373 L374	G366-I370 WeakPolarHBondContact O-CG1 2.96Å; G366-I370 PolarHBondContact O-N 3.04Å; G366-I370 VanDerWaalsContact O-N 3.15Å; L367-I370 PolarHBondContact O-N 2.87Å; I370-L373 PolarHBondContact O-N 3.29Å; I370-L374 HydrophobicContact CG2-CD1 4.1Å; I370-L374 WeakPolarHBondContact O-CG 2.99Å; I370-L374 PolarHBondContact O-N 2.92Å
371	L	89	Confident	83.5	Confident	106 Å²	106	88.9 Å²	88.9	56%	0.555	51%	0.507	S	S	*	.	H	α-helix	trans	-62.9	-44.1	179	-177.7	61.6	0	0	0	112.3	L367 G368 L373 L374 I375	L367-L371 PolarHBondContact O-N 2.79Å; L367-L371 VanDerWaalsContact O-N 3.11Å; G368-L371 PolarHBondContact O-N 2.99Å; L371-L373 PolarHBondContact O-N 2.99Å; L371-L374 PolarHBondContact O-N 2.82Å; L371-I375 HydrophobicContact CD1-CD1 4.24Å; L371-I375 HydrophobicContact CG-CD1 4.05Å; L371-I375 VanDerWaalsContact O-CG1 3.31Å; L371-I375 WeakPolarHBondContact O-CG1 3.4Å; L371-I375 PolarHBondContact O-N 2.92Å
372	L	88.9	Confident	84	Confident	125 Å²	125	91.9 Å²	91.9	65%	0.654	51%	0.512	S	S	*	.	H	α-helix	trans	-61.3	-42.2	176	-79.3	167.9	0	0	0	112.3	G368 A369 I375 F376	G368-L372 PolarHBondContact O-N 2.72Å; G368-L372 VanDerWaalsContact O-N 3.1Å; A369-L372 PolarHBondContact O-N 3.01Å; L372-I375 PolarHBondContact O-N 3.33Å; L372-F376 WeakPolarHBondContact O-CB 3.13Å; L372-F376 PolarHBondContact O-N 3.05Å
373	L	91	Very high	84.3	Confident	105 Å²	105	90 Å²	90	55%	0.55	51%	0.513	S	S	.	.	H	α-helix	trans	-66.5	-40	179.8	-166	151.3	0	0	0	111.6	A369 I370 L371 F376 L377	A369-L373 WeakPolarHBondContact O-CB 3.42Å; A369-L373 PolarHBondContact O-N 2.91Å; A369-L373 VanDerWaalsContact O-N 3.08Å; I370-L373 PolarHBondContact O-N 3.29Å; L371-L373 PolarHBondContact O-N 2.99Å; L373-F376 PolarHBondContact O-N 2.82Å; L373-L377 HydrophobicContact CD2-CD1 3.63Å; L373-L377 HydrophobicContact CD2-CG 4.14Å; L373-L377 WeakPolarHBondContact O-CG 3.38Å; L373-L377 PolarHBondContact O-N 2.8Å
374	L	90.3	Very high	84.5	Confident	92 Å²	92	91.6 Å²	91.6	48%	0.482	51%	0.514	S	S	.	.	H	α-helix	trans	-61.4	-46.1	172.7	-74.8	168.4	0	0	0	112.2	I370 L371 F376 L377 I378	I370-L374 HydrophobicContact CG2-CD1 4.1Å; I370-L374 WeakPolarHBondContact O-CG 2.99Å; I370-L374 PolarHBondContact O-N 2.92Å; L371-L374 PolarHBondContact O-N 2.82Å; L374-F376 VanDerWaalsContact C-N 3.31Å; L374-F376 PolarHBondContact O-N 2.02Å; L374-L377 PolarHBondContact O-N 2.93Å; L374-I378 WeakPolarHBondContact O-CB 3.22Å; L374-I378 WeakPolarHBondContact O-CD1 3.5Å; L374-I378 VanDerWaalsContact O-CG1 3.26Å; L374-I378 WeakPolarHBondContact O-CG1 3.23Å; L374-I378 PolarHBondContact O-N 3.48Å
375	I	89.9	Confident	84.6	Confident	98 Å²	98	93.6 Å²	93.6	50%	0.503	51%	0.51	S	S	.	.	H	α-helix	trans	-60.8	-42.1	177.3	-68.7	164.9	0	0	0	110.8	L371 L372 I378 S379	L371-I375 HydrophobicContact CD1-CD1 4.24Å; L371-I375 HydrophobicContact CG-CD1 4.05Å; L371-I375 VanDerWaalsContact O-CG1 3.31Å; L371-I375 WeakPolarHBondContact O-CG1 3.4Å; L371-I375 PolarHBondContact O-N 2.92Å; L372-I375 PolarHBondContact O-N 3.33Å; I375-I378 PolarHBondContact O-N 2.72Å; I375-S379 WeakPolarHBondContact O-CB 3.33Å; I375-S379 PolarHBondContact O-N 2.81Å
376	F	88.1	Confident	84.4	Confident	131 Å²	131	94.3 Å²	94.3	58%	0.575	50%	0.502	S	S	*	.	H	α-helix	trans	-62.5	-47.2	177	-179.5	-109	0	0	0	112.5	L372 L373 L374 I378 S379 L380	L372-F376 WeakPolarHBondContact O-CB 3.13Å; L372-F376 PolarHBondContact O-N 3.05Å; L373-F376 PolarHBondContact O-N 2.82Å; L374-F376 VanDerWaalsContact C-N 3.31Å; L374-F376 PolarHBondContact O-N 2.02Å; F376-I378 PolarHBondContact O-N 2.9Å; F376-S379 WeakPolarHBondContact O-CB 3.47Å; F376-S379 PolarHBondContact O-N 3.42Å; F376-L380 HydrophobicContact CD1-CD1 4.01Å; F376-L380 HydrophobicContact CE1-CD1 3.49Å; F376-L380 VanDerWaalsContact CE1-CD1 3.49Å; F376-L380 HydrophobicContact CE1-CG 4.29Å; F376-L380 HydrophobicContact CE2-CD1 4.41Å; F376-L380 HydrophobicContact CE2-CG 4.4Å; F376-L380 HydrophobicContact CZ-CD1 3.72Å; F376-L380 HydrophobicContact CZ-CD2 4.42Å; F376-L380 HydrophobicContact CZ-CG 4.18Å; F376-L380 WeakPolarHBondContact O-CG 3.48Å; F376-L380 PolarHBondContact O-N 2.94Å
377	L	86.7	Confident	84.2	Confident	93 Å²	93	96.7 Å²	96.7	49%	0.487	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-41.4	176.9	-71.1	177.4	0	0	0	112.5	L373 L374 S379 L380 H381	L373-L377 HydrophobicContact CD2-CD1 3.63Å; L373-L377 HydrophobicContact CD2-CG 4.14Å; L373-L377 WeakPolarHBondContact O-CG 3.38Å; L373-L377 PolarHBondContact O-N 2.8Å; L374-L377 PolarHBondContact O-N 2.93Å; L377-S379 VanDerWaalsContact C-N 3.35Å; L377-L380 PolarHBondContact O-N 3.24Å; L377-H381 WeakPolarHBondContact O-CB 3.3Å; L377-H381 PolarHBondContact O-N 2.99Å
378	I	86.9	Confident	83.7	Confident	103 Å²	103	96.2 Å²	96.2	53%	0.528	50%	0.501	S	S	.	.	H	α-helix	trans	-63.2	-42.7	175.6	-68.6	165.1	0	0	0	110.5	L374 I375 F376 H381 K382	L374-I378 WeakPolarHBondContact O-CB 3.22Å; L374-I378 WeakPolarHBondContact O-CD1 3.5Å; L374-I378 VanDerWaalsContact O-CG1 3.26Å; L374-I378 WeakPolarHBondContact O-CG1 3.23Å; L374-I378 PolarHBondContact O-N 3.48Å; I375-I378 PolarHBondContact O-N 2.72Å; F376-I378 PolarHBondContact O-N 2.9Å; I378-H381 PolarHBondContact O-N 2.82Å; I378-K382 HydrophobicContact CG2-CG 4.41Å; I378-K382 VanDerWaalsContact O-CG 3.28Å; I378-K382 WeakPolarHBondContact O-CG 3.15Å; I378-K382 PolarHBondContact O-N 2.69Å
379	S	83.9	Confident	83.2	Confident	65 Å²	65	98.3 Å²	98.3	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-60.3	-50.6	176.6	-171.3	0	0	0	0	111.7	I375 F376 L377 H381 K382 C383	I375-S379 WeakPolarHBondContact O-CB 3.33Å; I375-S379 PolarHBondContact O-N 2.81Å; F376-S379 WeakPolarHBondContact O-CB 3.47Å; F376-S379 PolarHBondContact O-N 3.42Å; L377-S379 VanDerWaalsContact C-N 3.35Å; S379-H381 PolarHBondContact O-N 2.94Å; S379-K382 PolarHBondContact O-N 2.9Å; S379-C383 WeakPolarHBondContact O-CB 3.29Å; S379-C383 PolarHBondContact O-N 2.92Å; S379-C383 PolarHBondContact O-SG 2.85Å
380	L	83.6	Confident	82.6	Confident	69 Å²	69	96.9 Å²	96.9	36%	0.361	49%	0.487	S	S	.	.	H	α-helix	trans	-56.3	-47.9	175.3	-73.2	178.7	0	0	0	111.9	F376 L377 K382 C383 Y384	F376-L380 HydrophobicContact CD1-CD1 4.01Å; F376-L380 HydrophobicContact CE1-CD1 3.49Å; F376-L380 VanDerWaalsContact CE1-CD1 3.49Å; F376-L380 HydrophobicContact CE1-CG 4.29Å; F376-L380 HydrophobicContact CE2-CD1 4.41Å; F376-L380 HydrophobicContact CE2-CG 4.4Å; F376-L380 HydrophobicContact CZ-CD1 3.72Å; F376-L380 HydrophobicContact CZ-CD2 4.42Å; F376-L380 HydrophobicContact CZ-CG 4.18Å; F376-L380 WeakPolarHBondContact O-CG 3.48Å; F376-L380 PolarHBondContact O-N 2.94Å; L377-L380 PolarHBondContact O-N 3.24Å; L380-K382 VanDerWaalsContact C-N 3.34Å; L380-K382 PolarHBondContact O-N 2.96Å; L380-C383 PolarHBondContact O-N 2.88Å; L380-Y384 HydrophobicContact CD2-CD2 4.15Å; L380-Y384 HydrophobicContact CD2-CE2 3.97Å; L380-Y384 WeakPolarHBondContact O-CB 3.24Å; L380-Y384 WeakPolarHBondContact O-CD2 3.34Å; L380-Y384 PolarHBondContact O-N 2.8Å
381	H	81.9	Confident	82	Confident	95 Å²	95	97.7 Å²	97.7	44%	0.44	49%	0.487	S	S	.	.	H	α-helix	trans	-60.8	-41.3	178.5	-178.9	87.4	0	0	0	112.2	L377 I378 S379 K385	L377-H381 WeakPolarHBondContact O-CB 3.3Å; L377-H381 PolarHBondContact O-N 2.99Å; I378-H381 PolarHBondContact O-N 2.82Å; S379-H381 PolarHBondContact O-N 2.94Å; H381-K385 WeakPolarHBondContact O-CA 3.4Å; H381-K385 WeakPolarHBondContact O-CB 3.28Å; H381-K385 PolarHBondContact O-N 3.07Å; H381-K385 VanDerWaalsContact O-N 3.1Å
382	K	77.3	Confident	81.3	Confident	162 Å²	162	99.4 Å²	99.4	70%	0.704	49%	0.487	S	S	*	.	H	α-helix	trans	-68.1	-42	177.7	-69.4	-68.9	-174.5	179.9	0	112.3	I378 S379 L380	I378-K382 HydrophobicContact CG2-CG 4.41Å; I378-K382 VanDerWaalsContact O-CG 3.28Å; I378-K382 WeakPolarHBondContact O-CG 3.15Å; I378-K382 PolarHBondContact O-N 2.69Å; S379-K382 PolarHBondContact O-N 2.9Å; L380-K382 VanDerWaalsContact C-N 3.34Å; L380-K382 PolarHBondContact O-N 2.96Å
383	C	78.1	Confident	80.7	Confident	97 Å²	97	96.1 Å²	96.1	66%	0.655	47%	0.466	S	S	*	.	H	α-helix	trans	-70.3	-40.1	-179.5	-72.4	0	0	0	0	113.2	S379 L380	S379-C383 WeakPolarHBondContact O-CB 3.29Å; S379-C383 PolarHBondContact O-N 2.92Å; S379-C383 PolarHBondContact O-SG 2.85Å; L380-C383 PolarHBondContact O-N 2.88Å
384	Y	78.4	Confident	79.8	Confident	125 Å²	125	99.9 Å²	99.9	49%	0.49	47%	0.473	S	S	.	.	H	α-helix	trans	-104.2	6.7	-172	-66.8	-77.9	0	0	0	114.7	L380 I386 E387 L388	L380-Y384 HydrophobicContact CD2-CD2 4.15Å; L380-Y384 HydrophobicContact CD2-CE2 3.97Å; L380-Y384 WeakPolarHBondContact O-CB 3.24Å; L380-Y384 WeakPolarHBondContact O-CD2 3.34Å; L380-Y384 PolarHBondContact O-N 2.8Å; Y384-I386 VanDerWaalsContact C-N 3.3Å; Y384-I386 PolarHBondContact O-N 2.91Å; Y384-I386 VanDerWaalsContact O-N 3.09Å; Y384-E387 WeakPolarHBondContact CD1-OE2 3.36Å; Y384-E387 PolarHBondContact O-N 2.81Å; Y384-L388 WeakPolarHBondContact O-CB 3.11Å; Y384-L388 PolarHBondContact O-N 3.22Å
385	K	79.8	Confident	78.9	Confident	106 Å²	106	100.9 Å²	100.9	46%	0.461	48%	0.475	S	S	.	.	H	α-helix	trans	-44	-49.3	-175.4	-171.5	-172.8	174.5	-169.3	0	114.1	H381 M389	H381-K385 WeakPolarHBondContact O-CA 3.4Å; H381-K385 WeakPolarHBondContact O-CB 3.28Å; H381-K385 PolarHBondContact O-N 3.07Å; H381-K385 VanDerWaalsContact O-N 3.1Å; K385-M389 VanDerWaalsContact O-CB 3.31Å; K385-M389 WeakPolarHBondContact O-CB 3.41Å; K385-M389 WeakPolarHBondContact O-CG 3.5Å; K385-M389 PolarHBondContact O-N 3.14Å
386	I	73.4	Confident	77.9	Confident	62 Å²	62	103.3 Å²	103.3	32%	0.318	48%	0.482	S	S	.	.	H	α-helix	trans	-67.3	-42.6	-177.6	-60.9	167.9	0	0	0	110.6	Y384 M389 L390	Y384-I386 VanDerWaalsContact C-N 3.3Å; Y384-I386 PolarHBondContact O-N 2.91Å; Y384-I386 VanDerWaalsContact O-N 3.09Å; I386-M389 PolarHBondContact O-N 3.11Å; I386-L390 HydrophobicContact CG2-CD1 3.87Å; I386-L390 HydrophobicContact CG2-CG 4.34Å; I386-L390 WeakPolarHBondContact O-CB 3.29Å; I386-L390 VanDerWaalsContact O-CG 3.29Å; I386-L390 WeakPolarHBondContact O-CG 3.45Å; I386-L390 PolarHBondContact O-N 3.18Å
387	E	76.4	Confident	76.7	Confident	88 Å²	88	97.7 Å²	97.7	41%	0.411	46%	0.461	S	S	.	.	H	α-helix	trans	-72	-39.6	-177.2	-53.4	-163.7	148.7	0	0	111.5	Y384 L390 F391 K571	Y384-E387 WeakPolarHBondContact CD1-OE2 3.36Å; Y384-E387 PolarHBondContact O-N 2.81Å; E387-L390 PolarHBondContact O-N 2.94Å; E387-F391 VanDerWaalsContact O-CB 3.28Å; E387-F391 WeakPolarHBondContact O-CB 3.06Å; E387-F391 PolarHBondContact O-N 2.89Å; E387-K571 IonicContact OE1-NZ 3.98Å; E387-K571 PolarHBondContact OE1-NZ 3.41Å
388	L	74.1	Confident	75.4	Confident	101 Å²	101	97.4 Å²	97.4	53%	0.529	47%	0.467	S	S	.	.	H	α-helix	trans	-62.8	-41.6	173.5	-158.6	91.8	0	0	0	111.5	Y384 Y392	Y384-L388 WeakPolarHBondContact O-CB 3.11Å; Y384-L388 PolarHBondContact O-N 3.22Å; L388-Y392 WeakPolarHBondContact O-CB 2.98Å; L388-Y392 PolarHBondContact O-N 3.17Å
389	M	73.6	Confident	74.1	Confident	78 Å²	78	96.9 Å²	96.9	38%	0.384	46%	0.462	S	S	.	.	H	α-helix	trans	-72.2	-38.2	177.7	-72.9	-68.7	175	0	0	112.7	K385 I386 Y392 R393 Y575	K385-M389 VanDerWaalsContact O-CB 3.31Å; K385-M389 WeakPolarHBondContact O-CB 3.41Å; K385-M389 WeakPolarHBondContact O-CG 3.5Å; K385-M389 PolarHBondContact O-N 3.14Å; I386-M389 PolarHBondContact O-N 3.11Å; M389-Y392 PolarHBondContact O-N 3.24Å; M389-R393 WeakPolarHBondContact O-CB 3.47Å; M389-R393 PolarHBondContact O-N 3.31Å; M389-Y575 HydrophobicContact CB-CE2 4.09Å
390	L	74.2	Confident	72.9	Confident	29 Å²	29	96.2 Å²	96.2	15%	0.152	45%	0.453	C	S	.	.	H	α-helix	trans	-66.1	-38.3	172.8	-74.1	172.2	0	0	0	111.6	I386 E387 R394 K571 Q574	I386-L390 HydrophobicContact CG2-CD1 3.87Å; I386-L390 HydrophobicContact CG2-CG 4.34Å; I386-L390 WeakPolarHBondContact O-CB 3.29Å; I386-L390 VanDerWaalsContact O-CG 3.29Å; I386-L390 WeakPolarHBondContact O-CG 3.45Å; I386-L390 PolarHBondContact O-N 3.18Å; E387-L390 PolarHBondContact O-N 2.94Å; L390-R394 WeakPolarHBondContact O-CB 3.32Å; L390-R394 PolarHBondContact O-N 3.05Å; L390-K571 HydrophobicContact CD1-CB 4.27Å; L390-K571 HydrophobicContact CD1-CG 4.48Å; L390-Q574 HydrophobicContact CD2-CG 4.26Å
391	F	76.4	Confident	71.6	Confident	122 Å²	122	98 Å²	98	54%	0.535	47%	0.467	S	S	.	.	H	α-helix	trans	-64.3	-45.5	173.3	-179.2	-95	0	0	0	111.7	E387 R394 H395	E387-F391 VanDerWaalsContact O-CB 3.28Å; E387-F391 WeakPolarHBondContact O-CB 3.06Å; E387-F391 PolarHBondContact O-N 2.89Å; F391-R394 PolarHBondContact O-N 3.35Å; F391-H395 AromaticContact CD2-CD2 3.89Å; F391-H395 AromaticContact CE1-CD2 3.87Å; F391-H395 AromaticContact CE2-CD2 3.42Å; F391-H395 VanDerWaalsContact CE2-CD2 3.42Å; F391-H395 WeakPolarHBondContact CE2-CD2 3.2Å; F391-H395 AromaticContact CE2-NE2 3.43Å; F391-H395 WeakPolarHBondContact CE2-NE2 3.37Å; F391-H395 AromaticContact CZ-CD2 3.4Å; F391-H395 VanDerWaalsContact CZ-CD2 3.4Å; F391-H395 WeakPolarHBondContact CZ-CD2 3.44Å; F391-H395 AromaticContact CZ-NE2 3.59Å; F391-H395 PolarHBondContact O-N 3.05Å
392	Y	75.4	Confident	70.4	Confident	142 Å²	142	101.4 Å²	101.4	56%	0.557	49%	0.489	S	S	*	.	H	α-helix	trans	-59.9	-48.2	174.1	-179.7	-95	0	0	0	111.8	L388 M389 R394 H395 F396	L388-Y392 WeakPolarHBondContact O-CB 2.98Å; L388-Y392 PolarHBondContact O-N 3.17Å; M389-Y392 PolarHBondContact O-N 3.24Å; Y392-R394 VanDerWaalsContact C-N 3.28Å; Y392-R394 PolarHBondContact O-N 2.88Å; Y392-H395 PolarHBondContact O-N 2.67Å; Y392-F396 HydrophobicContact CD2-CB 4.37Å; Y392-F396 AromaticContact CD2-CD2 3.81Å; Y392-F396 HydrophobicContact CD2-CD2 3.81Å; Y392-F396 HydrophobicContact CD2-CG 4.44Å; Y392-F396 HydrophobicContact CE1-CB 4.48Å; Y392-F396 HydrophobicContact CE2-CB 3.99Å; Y392-F396 AromaticContact CE2-CD2 3.93Å; Y392-F396 HydrophobicContact CE2-CD2 3.93Å; Y392-F396 HydrophobicContact CE2-CG 4.17Å; Y392-F396 PolarHBondContact O-N 2.94Å
393	R	74.6	Confident	69.4	Low	56 Å²	56	94.1 Å²	94.1	21%	0.211	46%	0.459	C	S	.	.	H	α-helix	trans	-59.3	-38.2	176.9	-154.4	-176.2	-168.1	-171.9	4	111.2	M389 G397 D400 M577 F579	M389-R393 WeakPolarHBondContact O-CB 3.47Å; M389-R393 PolarHBondContact O-N 3.31Å; R393-G397 VanDerWaalsContact O-CA 3.22Å; R393-G397 WeakPolarHBondContact O-CA 3.42Å; R393-G397 PolarHBondContact O-N 2.96Å; R393-D400 IonicContact NH2-OD1 2.64Å; R393-D400 PolarHBondContact NH2-OD1 3.46Å; R393-D400 VanDerWaalsContact NH2-OD1 3.11Å; R393-D400 IonicContact NH2-OD2 2.87Å; R393-D400 PolarHBondContact NH2-OD2 3.47Å; R393-D400 VanDerWaalsContact NH2-OD2 3.14Å; R393-M577 PolarHBondContact NH1-O 2.85Å; R393-F579 HydrophobicContact CB-CE2 4.44Å; R393-F579 HydrophobicContact CG-CD2 3.6Å; R393-F579 HydrophobicContact CG-CE2 3.84Å; R393-F579 HydrophobicContact CG-CG 4.19Å; R393-F579 WeakPolarHBondContact O-CE2 3.12Å; R393-F579 WeakPolarHBondContact O-CZ 3.49Å
394	R	72.1	Confident	68.5	Low	184 Å²	184	97.6 Å²	97.6	69%	0.694	47%	0.466	S	S	*	.	H	α-helix	trans	-66	-41.8	176.3	-178.3	178.2	-68.6	179.8	-2.4	113.6	L390 F391 Y392	L390-R394 WeakPolarHBondContact O-CB 3.32Å; L390-R394 PolarHBondContact O-N 3.05Å; F391-R394 PolarHBondContact O-N 3.35Å; Y392-R394 VanDerWaalsContact C-N 3.28Å; Y392-R394 PolarHBondContact O-N 2.88Å
395	H	71.7	Confident	67.7	Low	113 Å²	113	99.5 Å²	99.5	52%	0.523	49%	0.485	S	S	.	.	H	α-helix	trans	-89.4	-29.3	-175.9	-84.6	-79.8	0	0	0	114.7	F391 Y392	F391-H395 AromaticContact CD2-CD2 3.89Å; F391-H395 AromaticContact CE1-CD2 3.87Å; F391-H395 AromaticContact CE2-CD2 3.42Å; F391-H395 VanDerWaalsContact CE2-CD2 3.42Å; F391-H395 WeakPolarHBondContact CE2-CD2 3.2Å; F391-H395 AromaticContact CE2-NE2 3.43Å; F391-H395 WeakPolarHBondContact CE2-NE2 3.37Å; F391-H395 AromaticContact CZ-CD2 3.4Å; F391-H395 VanDerWaalsContact CZ-CD2 3.4Å; F391-H395 WeakPolarHBondContact CZ-CD2 3.44Å; F391-H395 AromaticContact CZ-NE2 3.59Å; F391-H395 PolarHBondContact O-N 3.05Å; Y392-H395 PolarHBondContact O-N 2.67Å
396	F	69.6	Low	67.8	Low	148 Å²	148	96.9 Å²	96.9	65%	0.649	47%	0.473	S	S	*	.	H	α-helix	trans	-128.2	7.9	-171.4	-59.5	-76.2	0	0	0	113.8	Y392	Y392-F396 HydrophobicContact CD2-CB 4.37Å; Y392-F396 AromaticContact CD2-CD2 3.81Å; Y392-F396 HydrophobicContact CD2-CD2 3.81Å; Y392-F396 HydrophobicContact CD2-CG 4.44Å; Y392-F396 HydrophobicContact CE1-CB 4.48Å; Y392-F396 HydrophobicContact CE2-CB 3.99Å; Y392-F396 AromaticContact CE2-CD2 3.93Å; Y392-F396 HydrophobicContact CE2-CD2 3.93Å; Y392-F396 HydrophobicContact CE2-CG 4.17Å; Y392-F396 PolarHBondContact O-N 2.94Å
397	G	62.3	Low	68.1	Low	13 Å²	13	97.8 Å²	97.8	13%	0.134	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-71.1	125.5	178	0	0	0	0	0	113.9	R393 R581	R393-G397 VanDerWaalsContact O-CA 3.22Å; R393-G397 WeakPolarHBondContact O-CA 3.42Å; R393-G397 PolarHBondContact O-N 2.96Å; G397-R581 PolarHBondContact O-NH2 3.24Å
398	S	59.2	Low	68.5	Low	87 Å²	87	95.9 Å²	95.9	61%	0.608	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-76.7	158.6	150.6	57.1	0	0	0	0	110	F579	S398-F579 WeakPolarHBondContact O-CD1 3.19Å
399	E	59.9	Low	69.1	Low	92 Å²	92	91.1 Å²	91.1	43%	0.43	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-70	153	172.1	-147.9	146.4	-171.6	0	0	110.5	V401 R580	E399-V401 PolarHBondContact O-N 2.04Å; E399-R580 IonicContact OE1-NH1 2.75Å
400	D	59.7	Low	69.9	Low	51 Å²	51	87.4 Å²	87.4	27%	0.273	43%	0.425	S	S	.	.			trans	-73.6	97.5	-173.3	-67.2	-17.6	0	0	0	109.9	R393 D402 G403 R490 P578 F579	R393-D400 IonicContact NH2-OD1 2.64Å; R393-D400 PolarHBondContact NH2-OD1 3.46Å; R393-D400 VanDerWaalsContact NH2-OD1 3.11Å; R393-D400 IonicContact NH2-OD2 2.87Å; R393-D400 PolarHBondContact NH2-OD2 3.47Å; R393-D400 VanDerWaalsContact NH2-OD2 3.14Å; D400-D402 VanDerWaalsContact C-N 3.26Å; D400-D402 PolarHBondContact O-N 3.29Å; D400-D402 VanDerWaalsContact O-N 3.16Å; D400-G403 PolarHBondContact O-N 3.31Å; D400-R490 IonicContact OD2-NH2 3.54Å; D400-P578 WeakPolarHBondContact OD2-CA 3.42Å; D400-F579 PolarHBondContact OD2-N 3.05Å
401	V	56.4	Low	70.7	Confident	106 Å²	106	86.4 Å²	86.4	64%	0.642	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-58.5	-28.4	-170.6	-174.9	0	0	0	0	114.3	E399 G403	E399-V401 PolarHBondContact O-N 2.04Å; V401-G403 PolarHBondContact O-N 2.68Å
402	D	56.3	Low	71.4	Confident	168 Å²	168	80.6 Å²	80.6	90%	0.898	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-62.6	-0	178.3	-64.3	-35.4	0	0	0	114.5	D400	D400-D402 VanDerWaalsContact C-N 3.26Å; D400-D402 PolarHBondContact O-N 3.29Å; D400-D402 VanDerWaalsContact O-N 3.16Å
403	G	56.3	Low	72	Confident	9 Å²	9	74.3 Å²	74.3	9%	0.093	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-124.7	9.9	-169.1	0	0	0	0	0	117.3	D400 V401 N405 K406 K489	D400-G403 PolarHBondContact O-N 3.31Å; V401-G403 PolarHBondContact O-N 2.68Å; G403-N405 VanDerWaalsContact C-N 3.26Å; G403-N405 PolarHBondContact O-N 2.87Å; G403-K406 PolarHBondContact O-N 2.79Å; G403-K406 VanDerWaalsContact O-N 3.09Å; G403-K489 VanDerWaalsContact O-CE 3.31Å; G403-K489 WeakPolarHBondContact O-CE 3.49Å
404	E	57.9	Low	72.6	Confident	170 Å²	170	73.3 Å²	73.3	79%	0.794	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-32.5	-175.3	-68.5	-166.4	152.6	0	0	113.9
405	N	62.8	Low	72.9	Confident	165 Å²	165	65.6 Å²	65.6	88%	0.882	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	16.3	178.1	-69.4	-27.1	0	0	0	114.1	G403	G403-N405 VanDerWaalsContact C-N 3.26Å; G403-N405 PolarHBondContact O-N 2.87Å
406	K	80.9	Confident	72.9	Confident	51 Å²	51	66.5 Å²	66.5	22%	0.222	34%	0.343	C	S	.	.			trans	-114.1	113.5	-178.8	-66.4	-152.5	177.9	-146.4	0	112.3	G403 Y408 D486 Q487 S488 K489	G403-K406 PolarHBondContact O-N 2.79Å; G403-K406 VanDerWaalsContact O-N 3.09Å; K406-Y408 VanDerWaalsContact C-N 3.27Å; K406-Y408 PolarHBondContact O-N 2.82Å; K406-D486 VanDerWaalsContact CD-O 3.31Å; K406-D486 WeakPolarHBondContact CD-O 3.44Å; K406-D486 WeakPolarHBondContact CE-O 3.36Å; K406-D486 PolarHBondContact NZ-O 3.16Å; K406-D486 IonicContact NZ-OD1 3.93Å; K406-D486 PolarHBondContact NZ-OD1 2.82Å; K406-Q487 CarbonylContact C-O 3.58Å; K406-S488 WeakPolarHBondContact CD-O 3.37Å; K406-S488 PolarHBondContact NZ-O 3.37Å; K406-K489 HydrophobicContact CB-CG 3.79Å; K406-K489 HydrophobicContact CD-CG 4.32Å
407	D	80.5	Confident	72.9	Confident	81 Å²	81	59.7 Å²	59.7	43%	0.433	31%	0.314	S	S	.	.	S	Bend	trans	-61.3	-25.8	-175.6	-75.1	-68.4	0	0	0	115.1	K448 Q487	D407-K448 VanDerWaalsContact O-CD 3.26Å; D407-K448 WeakPolarHBondContact O-CD 3.33Å; D407-K448 VanDerWaalsContact O-CE 3.26Å; D407-K448 WeakPolarHBondContact O-CE 3.33Å; D407-K448 PolarHBondContact O-NZ 3.01Å; D407-Q487 HydrophobicContact CB-CB 4.43Å; D407-Q487 PolarHBondContact N-O 3.13Å; D407-Q487 VanDerWaalsContact N-O 3.13Å; D407-Q487 PolarHBondContact OD2-NE2 2.84Å
408	Y	84.8	Confident	73.1	Confident	47 Å²	47	63.5 Å²	63.5	18%	0.184	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-126.9	141.7	-172.5	-60.8	-86.4	0	0	0	111.9	K406 K448 L449 F450 Q487 S488 K489	K406-Y408 VanDerWaalsContact C-N 3.27Å; K406-Y408 PolarHBondContact O-N 2.82Å; Y408-K448 HydrophobicContact CD1-CD 4.27Å; Y408-K448 HydrophobicContact CD1-CG 3.93Å; Y408-K448 HydrophobicContact CE1-CD 4.45Å; Y408-K448 VanDerWaalsContact CE1-CE 3.45Å; Y408-K448 HydrophobicContact CE1-CG 4.31Å; Y408-L449 WeakPolarHBondContact CD1-O 3.23Å; Y408-F450 HydrophobicContact CD1-CB 3.74Å; Y408-F450 HydrophobicContact CD1-CD2 4.41Å; Y408-F450 HydrophobicContact CD2-CB 4.27Å; Y408-F450 HydrophobicContact CD2-CD2 4.43Å; Y408-F450 HydrophobicContact CE1-CB 4.06Å; Y408-F450 AromaticContact CE1-CD2 3.9Å; Y408-F450 HydrophobicContact CE1-CD2 3.9Å; Y408-F450 AromaticContact CE2-CD2 3.94Å; Y408-F450 HydrophobicContact CE2-CD2 3.94Å; Y408-F450 HydrophobicContact CG-CB 3.87Å; Y408-F450 AromaticContact CZ-CD2 3.66Å; Y408-Q487 HydrophobicContact CD2-CB 4.2Å; Y408-Q487 PolarHBondContact N-O 3.07Å; Y408-S488 CarbonylContact O-C 3.55Å; Y408-S488 WeakPolarHBondContact O-CA 3.41Å; Y408-K489 WeakPolarHBondContact O-CG 3.39Å; Y408-K489 PolarHBondContact O-N 2.84Å
409	D	87	Confident	73.2	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.005	33%	0.328	C	S	.	.	S	Bend	trans	-78.1	-28.5	178	-64.4	-50.2	0	0	0	111.7	Y447 K448 K489 R490 P578 R580	D409-Y447 HydrophobicContact CB-CD1 3.81Å; D409-Y447 HydrophobicContact CB-CG 4.48Å; D409-K448 PolarHBondContact N-O 2.85Å; D409-K448 PolarHBondContact OD2-N 2.95Å; D409-K489 IonicContact OD1-NZ 3.63Å; D409-K489 PolarHBondContact OD1-NZ 3.26Å; D409-R490 PolarHBondContact O-N 3.43Å; D409-P578 HydrophobicContact CB-CG 4.29Å; D409-P578 WeakPolarHBondContact O-CG 3.32Å; D409-R580 IonicContact OD1-CZ 3.65Å; D409-R580 IonicContact OD1-NE 3.37Å; D409-R580 IonicContact OD1-NH2 3.04Å; D409-R580 IonicContact OD2-CZ 2.78Å; D409-R580 VanDerWaalsContact OD2-CZ 3.28Å; D409-R580 IonicContact OD2-NE 3.79Å; D409-R580 PolarHBondContact OD2-NE 3.07Å; D409-R580 IonicContact OD2-NH2 3.36Å; D409-R580 PolarHBondContact OD2-NH2 3.12Å
410	A	90.4	Very high	73	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	145.3	166.7	0	0	0	0	0	114	L449 F450 R490 I492 M577	A410-L449 HydrophobicContact CB-CD2 3.86Å; A410-L449 CarbonylContact O-C 3.56Å; A410-L449 WeakPolarHBondContact O-CA 3.46Å; A410-F450 PolarHBondContact O-N 2.9Å; A410-R490 CarbonylContact C-O 3.48Å; A410-R490 VanDerWaalsContact CA-O 3.28Å; A410-R490 WeakPolarHBondContact CA-O 3.42Å; A410-R490 HydrophobicContact CB-CB 3.94Å; A410-I492 HydrophobicContact CB-CD1 3.63Å; A410-I492 HydrophobicContact CB-CG1 3.93Å; A410-M577 HydrophobicContact CB-CE 4.04Å; A410-M577 HydrophobicContact CB-SD 4.31Å
411	Y	90.6	Very high	73	Confident	8 Å²	8	70.3 Å²	70.3	3%	0.031	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	135.2	163.2	-175.9	-79.9	0	0	0	109.5	F450 P452 V481 C484 V485 S488 R490 L491 I492	Y411-F450 HydrophobicContact CD2-CB 4.43Å; Y411-F450 AromaticContact CD2-CD1 3.51Å; Y411-F450 HydrophobicContact CD2-CD1 3.51Å; Y411-F450 HydrophobicContact CD2-CE1 4.22Å; Y411-F450 HydrophobicContact CD2-CG 4.32Å; Y411-F450 AromaticContact CE2-CD1 3.51Å; Y411-F450 HydrophobicContact CE2-CD1 3.51Å; Y411-F450 AromaticContact CE2-CE1 3.77Å; Y411-F450 HydrophobicContact CE2-CE1 3.77Å; Y411-F450 HydrophobicContact CG-CD1 4.48Å; Y411-P452 HydrophobicContact CE1-CG 4.2Å; Y411-P452 HydrophobicContact CE2-CG 4.16Å; Y411-P452 VanDerWaalsContact OH-CG 3.23Å; Y411-P452 WeakPolarHBondContact OH-CG 3.01Å; Y411-V481 HydrophobicContact CE2-CG1 4.46Å; Y411-V481 WeakPolarHBondContact OH-CG1 3.29Å; Y411-C484 HydrophobicContact CD2-CB 4.27Å; Y411-C484 HydrophobicContact CE2-CB 4.15Å; Y411-V485 HydrophobicContact CD1-CG2 4.01Å; Y411-V485 HydrophobicContact CD2-CB 4.38Å; Y411-V485 HydrophobicContact CD2-CG2 3.52Å; Y411-V485 HydrophobicContact CE1-CG2 4.1Å; Y411-V485 HydrophobicContact CE2-CG2 3.61Å; Y411-V485 HydrophobicContact CG-CG2 3.73Å; Y411-S488 PolarHBondContact N-OG 2.84Å; Y411-R490 PolarHBondContact N-O 2.86Å; Y411-L491 HydrophobicContact CD1-CD1 3.52Å; Y411-L491 HydrophobicContact CE1-CD1 4.32Å; Y411-L491 HydrophobicContact CG-CD1 4.18Å; Y411-I492 PolarHBondContact O-N 3.44Å
412	L	90.9	Very high	73.2	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.005	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	116.6	176.9	-171.5	66.4	0	0	0	111.6	Y414 L437 P438 F450 I451 P452 I492 V494	L412-Y414 HydrophobicContact CD2-CD1 4.18Å; L412-Y414 HydrophobicContact CD2-CE1 4.35Å; L412-Y414 HydrophobicContact CG-CD1 4.04Å; L412-L437 HydrophobicContact CD1-CD2 3.95Å; L412-P438 HydrophobicContact CD2-CG 3.92Å; L412-F450 PolarHBondContact N-O 3.47Å; L412-I451 HydrophobicContact CB-CG1 4.36Å; L412-I451 HydrophobicContact CD2-CD1 4.34Å; L412-I451 HydrophobicContact CD2-CG1 4.25Å; L412-P452 WeakPolarHBondContact O-CD 3.41Å; L412-I492 HydrophobicContact CD1-CB 3.86Å; L412-I492 HydrophobicContact CD1-CG2 3.61Å; L412-V494 HydrophobicContact CD1-CG2 3.75Å
413	S	88.8	Confident	73.5	Confident	10 Å²	10	63.7 Å²	63.7	7%	0.07	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	123.3	175.2	-169.9	0	0	0	0	111.3	I492 V494 Y499	S413-I492 PolarHBondContact N-O 3.05Å; S413-V494 PolarHBondContact O-N 2.91Å; S413-Y499 PolarHBondContact OG-OH 2.74Å
414	Y	85.6	Confident	73.6	Confident	34 Å²	34	71.7 Å²	71.7	13%	0.133	36%	0.359	C	S	.	.			trans	-151.9	176	176.8	64.2	-83.9	0	0	0	108.7	L412 L434 I451 D453	L412-Y414 HydrophobicContact CD2-CD1 4.18Å; L412-Y414 HydrophobicContact CD2-CE1 4.35Å; L412-Y414 HydrophobicContact CG-CD1 4.04Å; Y414-L434 HydrophobicContact CD2-CD2 3.6Å; Y414-L434 HydrophobicContact CE2-CD2 3.31Å; Y414-I451 HydrophobicContact CE1-CG2 4.05Å; Y414-D453 WeakPolarHBondContact CE2-OD2 3.48Å; Y414-D453 VanDerWaalsContact OH-CB 3.32Å; Y414-D453 WeakPolarHBondContact OH-CB 3.4Å; Y414-D453 PolarHBondContact OH-OD2 2.82Å
415	T	80.3	Confident	73.7	Confident	22 Å²	22	71 Å²	71	14%	0.135	36%	0.356	C	S	.	.			trans	-120.4	120.6	174.1	45.9	0	0	0	0	110.4	Y499	T415-Y499 HydrophobicContact CG2-CD2 3.68Å; T415-Y499 HydrophobicContact CG2-CE2 4.29Å; T415-Y499 HydrophobicContact CG2-CG 4.38Å; T415-Y499 WeakPolarHBondContact OG1-CA 3.39Å; T415-Y499 PolarHBondContact OG1-N 2.71Å
416	K	71.7	Confident	73.9	Confident	132 Å²	132	64.1 Å²	64.1	57%	0.574	32%	0.32	S	S	*	.			trans	-67.2	137.6	172.3	-165.3	178.9	-163.5	157.5	0	111.3	D453 R502	K416-D453 WeakPolarHBondContact CD-OD2 3.47Å; K416-D453 IonicContact NZ-OD2 3.91Å; K416-R502 PolarHBondContact O-NH1 2.91Å
417	V	69.3	Low	73.4	Confident	6 Å²	6	69.2 Å²	69.2	4%	0.036	34%	0.338	C	S	.	.			trans	-137.7	132.4	175.9	-178	0	0	0	0	109.1	Q421 W422 N498	V417-Q421 HydrophobicContact CG1-CB 4.09Å; V417-W422 PolarHBondContact O-NE1 2.91Å; V417-W422 VanDerWaalsContact O-NE1 3.1Å; V417-N498 HydrophobicContact CG2-CB 3.69Å
418	D	65.8	Low	73.3	Confident	92 Å²	92	70 Å²	70	49%	0.492	34%	0.339	S	S	.	.			trans	-60.8	140.9	-177.4	-53.8	-68.3	0	0	0	112.2	D420 Q421 W422	D418-D420 PolarHBondContact O-N 2.78Å; D418-Q421 PolarHBondContact O-N 3.09Å; D418-Q421 VanDerWaalsContact O-N 3.11Å; D418-W422 PolarHBondContact O-NE1 2.88Å
419	P	61.1	Low	73.2	Confident	86 Å²	86	68.7 Å²	68.7	56%	0.558	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-54.8	-30.5	-175.1	-28.5	36.2	0	0	0	114.9	Q421 W422	P419-Q421 PolarHBondContact O-N 2.86Å; P419-W422 HydrophobicContact CG-CZ2 4.41Å; P419-W422 WeakPolarHBondContact O-CB 3.43Å; P419-W422 PolarHBondContact O-N 2.9Å
420	D	56.3	Low	72.9	Confident	163 Å²	163	68.7 Å²	68.7	87%	0.872	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-70.6	-9.4	-176.3	-56.8	-32	0	0	0	113.6	D418	D418-D420 PolarHBondContact O-N 2.78Å
421	Q	58.4	Low	72.6	Confident	125 Å²	125	74.9 Å²	74.9	58%	0.584	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-102.4	3.4	178	-62	-177.5	18	0	0	113.5	V417 D418 P419	V417-Q421 HydrophobicContact CG1-CB 4.09Å; D418-Q421 PolarHBondContact O-N 3.09Å; D418-Q421 VanDerWaalsContact O-N 3.11Å; P419-Q421 PolarHBondContact O-N 2.86Å
422	W	62.4	Low	72.4	Confident	75 Å²	75	74.5 Å²	74.5	28%	0.284	36%	0.356	S	S	.	.			trans	-80.7	125	-171.6	-65.4	0.9	0	0	0	113.6	V417 D418 P419 R427 E430	V417-W422 PolarHBondContact O-NE1 2.91Å; V417-W422 VanDerWaalsContact O-NE1 3.1Å; D418-W422 PolarHBondContact O-NE1 2.88Å; P419-W422 HydrophobicContact CG-CZ2 4.41Å; P419-W422 WeakPolarHBondContact O-CB 3.43Å; P419-W422 PolarHBondContact O-N 2.9Å; W422-R427 HydrophobicContact CB-CB 4.37Å; W422-R427 HydrophobicContact CE3-CB 4.02Å; W422-R427 HydrophobicContact CE3-CG 3.67Å; W422-R427 HydrophobicContact CZ3-CG 4.05Å; W422-E430 HydrophobicContact CZ2-CB 4.45Å
423	S	62.2	Low	72.1	Confident	60 Å²	60	74.4 Å²	74.4	42%	0.42	36%	0.356	S	S	.	.			trans	-75.5	164.2	160.3	91.5	0	0	0	0	111	E425 T426 R427	S423-E425 VanDerWaalsContact C-N 3.32Å; S423-E425 PolarHBondContact O-N 3.21Å; S423-T426 PolarHBondContact O-N 2.88Å; S423-T426 WeakPolarHBondContact OG-CB 3.19Å; S423-T426 PolarHBondContact OG-N 2.87Å; S423-T426 PolarHBondContact OG-OG1 2.94Å; S423-R427 WeakPolarHBondContact O-CB 3.48Å; S423-R427 PolarHBondContact O-N 3.15Å
424	Q	59	Low	71.9	Confident	176 Å²	176	76.7 Å²	76.7	82%	0.822	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-34.6	-176.9	-175	170.8	-18.5	0	0	113.5
425	E	59.9	Low	71.8	Confident	156 Å²	156	79.5 Å²	79.5	73%	0.729	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-45.7	176.5	-62.1	-179	152.8	0	0	110.5	S423 R427 E428 E429	S423-E425 VanDerWaalsContact C-N 3.32Å; S423-E425 PolarHBondContact O-N 3.21Å; E425-R427 PolarHBondContact O-N 3.19Å; E425-E428 PolarHBondContact O-N 3.07Å; E425-E429 PolarHBondContact O-N 2.82Å
426	T	65.5	Low	72.1	Confident	21 Å²	21	80.4 Å²	80.4	13%	0.129	39%	0.385	C	S	.	.	H	α-helix	trans	-53.6	-38.5	174.6	-50.6	0	0	0	0	111.9	S423 E428 E429 E430 N498	S423-T426 PolarHBondContact O-N 2.88Å; S423-T426 WeakPolarHBondContact OG-CB 3.19Å; S423-T426 PolarHBondContact OG-N 2.87Å; S423-T426 PolarHBondContact OG-OG1 2.94Å; T426-E428 VanDerWaalsContact C-N 3.28Å; T426-E428 PolarHBondContact O-N 2.83Å; T426-E429 PolarHBondContact O-N 3.33Å; T426-E430 HydrophobicContact CG2-CG 3.84Å; T426-E430 WeakPolarHBondContact O-CG 3.47Å; T426-E430 PolarHBondContact O-N 3.06Å; T426-N498 WeakPolarHBondContact CG2-ND2 3.06Å
427	R	71.4	Confident	72.9	Confident	158 Å²	158	74.1 Å²	74.1	60%	0.596	36%	0.357	S	S	*	.	H	α-helix	trans	-62.2	-28.9	178.2	179.2	169.7	-177.3	-169.2	0.7	113.7	W422 S423 E425 R431	W422-R427 HydrophobicContact CB-CB 4.37Å; W422-R427 HydrophobicContact CE3-CB 4.02Å; W422-R427 HydrophobicContact CE3-CG 3.67Å; W422-R427 HydrophobicContact CZ3-CG 4.05Å; S423-R427 WeakPolarHBondContact O-CB 3.48Å; S423-R427 PolarHBondContact O-N 3.15Å; E425-R427 PolarHBondContact O-N 3.19Å; R427-R431 WeakPolarHBondContact O-CB 3.48Å; R427-R431 PolarHBondContact O-N 3.12Å
428	E	78.4	Confident	73.8	Confident	97 Å²	97	74.3 Å²	74.3	45%	0.453	36%	0.359	S	S	.	.	H	α-helix	trans	-78.8	-34.4	175.1	-62.5	-162.5	158.7	0	0	112	E425 T426 F432 W557 P560	E425-E428 PolarHBondContact O-N 3.07Å; T426-E428 VanDerWaalsContact C-N 3.28Å; T426-E428 PolarHBondContact O-N 2.83Å; E428-F432 WeakPolarHBondContact O-CB 3.47Å; E428-F432 PolarHBondContact O-N 2.85Å; E428-W557 HydrophobicContact CB-CH2 4.32Å; E428-P560 WeakPolarHBondContact OE2-CD 3.22Å; E428-P560 WeakPolarHBondContact OE2-CG 3.08Å
429	E	81.8	Confident	74.8	Confident	20 Å²	20	73.4 Å²	73.4	9%	0.093	35%	0.354	C	S	.	.	H	α-helix	trans	-76.9	-47.3	-177.6	-64	178.7	152.4	0	0	112.5	E425 T426 R431 F432 A433 T496 P497 C530 A531 W557	E425-E429 PolarHBondContact O-N 2.82Å; T426-E429 PolarHBondContact O-N 3.33Å; E429-R431 VanDerWaalsContact C-N 3.3Å; E429-R431 PolarHBondContact O-N 2.91Å; E429-F432 WeakPolarHBondContact O-CB 3.23Å; E429-F432 PolarHBondContact O-N 3.22Å; E429-A433 PolarHBondContact O-N 2.95Å; E429-T496 HydrophobicContact CB-CG2 4.43Å; E429-P497 WeakPolarHBondContact OE2-CD 3.35Å; E429-P497 VanDerWaalsContact OE2-CG 3.26Å; E429-P497 WeakPolarHBondContact OE2-CG 3.34Å; E429-C530 HydrophobicContact CB-CB 4.22Å; E429-C530 HydrophobicContact CG-CB 4.03Å; E429-A531 WeakPolarHBondContact OE1-CA 3.46Å; E429-A531 WeakPolarHBondContact OE1-CB 3.4Å; E429-A531 PolarHBondContact OE1-N 2.97Å; E429-W557 HydrophobicContact CG-CZ3 3.82Å
430	E	81.6	Confident	76.1	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-64.3	-38.1	174.1	-61.7	-60.4	160.6	0	0	110.4	W422 T426 F432 A433 L434 T496 N498	W422-E430 HydrophobicContact CZ2-CB 4.45Å; T426-E430 HydrophobicContact CG2-CG 3.84Å; T426-E430 WeakPolarHBondContact O-CG 3.47Å; T426-E430 PolarHBondContact O-N 3.06Å; E430-F432 VanDerWaalsContact C-N 3.35Å; E430-F432 PolarHBondContact O-N 3.26Å; E430-A433 PolarHBondContact O-N 2.8Å; E430-L434 HydrophobicContact CB-CD1 4.46Å; E430-L434 VanDerWaalsContact O-CB 3.28Å; E430-L434 WeakPolarHBondContact O-CB 3.12Å; E430-L434 VanDerWaalsContact O-CG 3.22Å; E430-L434 WeakPolarHBondContact O-CG 3.27Å; E430-L434 PolarHBondContact O-N 2.64Å; E430-T496 VanDerWaalsContact OE1-CB 3.25Å; E430-T496 WeakPolarHBondContact OE1-CB 3.49Å; E430-T496 PolarHBondContact OE1-OG1 3.45Å; E430-N498 WeakPolarHBondContact OE1-CB 3.38Å; E430-N498 PolarHBondContact OE1-ND2 2.92Å
431	R	83.1	Confident	77.6	Confident	129 Å²	129	62.6 Å²	62.6	49%	0.487	29%	0.292	S	S	.	.	H	α-helix	trans	-64.3	-38.4	172.9	-173.7	175.9	-167.7	-148.8	-8.1	112.4	R427 E429 E435 I436	R427-R431 WeakPolarHBondContact O-CB 3.48Å; R427-R431 PolarHBondContact O-N 3.12Å; E429-R431 VanDerWaalsContact C-N 3.3Å; E429-R431 PolarHBondContact O-N 2.91Å; R431-E435 HydrophobicContact CG-CB 4.35Å; R431-E435 HydrophobicContact CG-CG 4.25Å; R431-E435 IonicContact CZ-OE2 3.46Å; R431-E435 VanDerWaalsContact CZ-OE2 3.23Å; R431-E435 IonicContact NE-OE1 3.53Å; R431-E435 PolarHBondContact NE-OE1 3Å; R431-E435 IonicContact NE-OE2 2.72Å; R431-E435 PolarHBondContact NE-OE2 2.93Å; R431-E435 IonicContact NH2-OE2 3.23Å; R431-E435 PolarHBondContact NH2-OE2 2.96Å; R431-E435 WeakPolarHBondContact O-CB 3.45Å; R431-E435 PolarHBondContact O-N 3.24Å; R431-I436 PolarHBondContact O-N 2.91Å
432	F	87.6	Confident	79	Confident	0 Å²	0	59 Å²	59	0%	0	28%	0.275	C	S	.	.	I	π-helix	trans	-63.2	-43.9	173.2	166.5	-100.3	0	0	0	111.5	E428 E429 E430 I436 L437 V494 I528 W557 F569 W570	E428-F432 WeakPolarHBondContact O-CB 3.47Å; E428-F432 PolarHBondContact O-N 2.85Å; E429-F432 WeakPolarHBondContact O-CB 3.23Å; E429-F432 PolarHBondContact O-N 3.22Å; E430-F432 VanDerWaalsContact C-N 3.35Å; E430-F432 PolarHBondContact O-N 3.26Å; F432-I436 HydrophobicContact CD2-CB 4.12Å; F432-I436 HydrophobicContact CD2-CG2 4.28Å; F432-I436 PolarHBondContact O-N 3.33Å; F432-L437 HydrophobicContact CE1-CB 4.42Å; F432-L437 HydrophobicContact CE1-CD2 4.34Å; F432-L437 HydrophobicContact CE2-CB 4.1Å; F432-L437 HydrophobicContact CZ-CB 3.97Å; F432-L437 HydrophobicContact CZ-CD1 4.09Å; F432-L437 HydrophobicContact CZ-CD2 4.27Å; F432-L437 HydrophobicContact CZ-CG 4.35Å; F432-L437 VanDerWaalsContact O-CB 3.24Å; F432-L437 WeakPolarHBondContact O-CB 3.41Å; F432-L437 PolarHBondContact O-N 2.79Å; F432-V494 HydrophobicContact CE1-CG1 4.49Å; F432-I528 HydrophobicContact CE1-CG2 3.97Å; F432-I528 HydrophobicContact CZ-CG2 4.42Å; F432-W557 HydrophobicContact CB-CH2 4.16Å; F432-W557 HydrophobicContact CB-CZ2 3.73Å; F432-W557 HydrophobicContact CD1-CD2 4.23Å; F432-W557 HydrophobicContact CD1-CG 4.29Å; F432-W557 AromaticContact CD2-CD1 3.85Å; F432-W557 AromaticContact CD2-CE2 3.8Å; F432-W557 HydrophobicContact CD2-CZ2 4.18Å; F432-W557 AromaticContact CD2-NE1 3.3Å; F432-W557 VanDerWaalsContact CD2-NE1 3.3Å; F432-W557 AromaticContact CE1-CD1 4Å; F432-W557 HydrophobicContact CE1-CG 4.2Å; F432-W557 AromaticContact CE2-CD1 3.62Å; F432-W557 AromaticContact CE2-NE1 3.53Å; F432-W557 HydrophobicContact CG-CD2 4.24Å; F432-W557 AromaticContact CG-CE2 3.67Å; F432-W557 AromaticContact CG-CZ2 3.9Å; F432-W557 HydrophobicContact CG-CZ2 3.9Å; F432-W557 AromaticContact CG-NE1 3.65Å; F432-W557 AromaticContact CZ-CD1 3.72Å; F432-W557 HydrophobicContact CZ-CG 4.34Å; F432-F569 HydrophobicContact CE1-CZ 4.47Å; F432-F569 HydrophobicContact CE2-CE1 4.08Å; F432-F569 HydrophobicContact CE2-CZ 4.25Å; F432-F569 AromaticContact CZ-CE1 3.88Å; F432-F569 HydrophobicContact CZ-CE1 3.88Å; F432-F569 AromaticContact CZ-CZ 3.61Å; F432-F569 HydrophobicContact CZ-CZ 3.61Å; F432-W570 HydrophobicContact CE2-CH2 4.17Å; F432-W570 HydrophobicContact CE2-CZ2 4.31Å
433	A	85.1	Confident	80.1	Confident	0 Å²	0	62 Å²	62	0%	0	29%	0.291	C	S	.	.	I	π-helix	trans	-66.4	-41.1	179.5	0	0	0	0	0	113.6	E429 E430 P438 V494 T496	E429-A433 PolarHBondContact O-N 2.95Å; E430-A433 PolarHBondContact O-N 2.8Å; A433-P438 WeakPolarHBondContact O-CD 3.21Å; A433-V494 HydrophobicContact CB-CB 4.38Å; A433-V494 HydrophobicContact CB-CG1 3.75Å; A433-T496 HydrophobicContact CB-CG2 4.25Å
434	L	83.2	Confident	81.1	Confident	58 Å²	58	63.8 Å²	63.8	30%	0.304	29%	0.292	S	S	.	.	I	π-helix	trans	-92.6	-40.4	-171	-64	170.6	0	0	0	114.2	Y414 E430	Y414-L434 HydrophobicContact CD2-CD2 3.6Å; Y414-L434 HydrophobicContact CE2-CD2 3.31Å; E430-L434 HydrophobicContact CB-CD1 4.46Å; E430-L434 VanDerWaalsContact O-CB 3.28Å; E430-L434 WeakPolarHBondContact O-CB 3.12Å; E430-L434 VanDerWaalsContact O-CG 3.22Å; E430-L434 WeakPolarHBondContact O-CG 3.27Å; E430-L434 PolarHBondContact O-N 2.64Å
435	E	83.4	Confident	82.3	Confident	93 Å²	93	56.5 Å²	56.5	44%	0.435	26%	0.257	S	S	.	.	I	π-helix	trans	-99.5	-60.4	-179	-64.2	176.3	-157.1	0	0	111.1	R431 D439	R431-E435 HydrophobicContact CG-CB 4.35Å; R431-E435 HydrophobicContact CG-CG 4.25Å; R431-E435 IonicContact CZ-OE2 3.46Å; R431-E435 VanDerWaalsContact CZ-OE2 3.23Å; R431-E435 IonicContact NE-OE1 3.53Å; R431-E435 PolarHBondContact NE-OE1 3Å; R431-E435 IonicContact NE-OE2 2.72Å; R431-E435 PolarHBondContact NE-OE2 2.93Å; R431-E435 IonicContact NH2-OE2 3.23Å; R431-E435 PolarHBondContact NH2-OE2 2.96Å; R431-E435 WeakPolarHBondContact O-CB 3.45Å; R431-E435 PolarHBondContact O-N 3.24Å; E435-D439 VanDerWaalsContact O-CB 3.31Å; E435-D439 WeakPolarHBondContact O-CB 3.48Å; E435-D439 PolarHBondContact O-N 2.9Å; E435-D439 VanDerWaalsContact O-N 3.11Å
436	I	86.4	Confident	83.4	Confident	40 Å²	40	51.3 Å²	51.3	21%	0.205	25%	0.246	C	C	.	.	I	π-helix	trans	-75.5	-40.7	-159.9	-52.4	178.3	0	0	0	112	R431 F432 V440 N563 W570	R431-I436 PolarHBondContact O-N 2.91Å; F432-I436 HydrophobicContact CD2-CB 4.12Å; F432-I436 HydrophobicContact CD2-CG2 4.28Å; F432-I436 PolarHBondContact O-N 3.33Å; I436-V440 HydrophobicContact CG2-CG2 4.32Å; I436-V440 WeakPolarHBondContact O-CB 3.42Å; I436-V440 VanDerWaalsContact O-CG2 3.29Å; I436-V440 WeakPolarHBondContact O-CG2 3.43Å; I436-V440 PolarHBondContact O-N 3.22Å; I436-V440 VanDerWaalsContact O-N 3.09Å; I436-N563 WeakPolarHBondContact CD1-ND2 3.4Å; I436-W570 HydrophobicContact CG2-CZ2 4.31Å
437	L	89.3	Confident	84.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-68.6	-47.7	-178.5	178.4	65.3	0	0	0	112.6	L412 F432 L441 I492 V494 I528 W570 L573	L412-L437 HydrophobicContact CD1-CD2 3.95Å; F432-L437 HydrophobicContact CE1-CB 4.42Å; F432-L437 HydrophobicContact CE1-CD2 4.34Å; F432-L437 HydrophobicContact CE2-CB 4.1Å; F432-L437 HydrophobicContact CZ-CB 3.97Å; F432-L437 HydrophobicContact CZ-CD1 4.09Å; F432-L437 HydrophobicContact CZ-CD2 4.27Å; F432-L437 HydrophobicContact CZ-CG 4.35Å; F432-L437 VanDerWaalsContact O-CB 3.24Å; F432-L437 WeakPolarHBondContact O-CB 3.41Å; F432-L437 PolarHBondContact O-N 2.79Å; L437-L441 HydrophobicContact CD1-CD1 3.64Å; L437-L441 HydrophobicContact CD1-CG 4.17Å; L437-L441 HydrophobicContact CG-CD1 4.07Å; L437-L441 WeakPolarHBondContact O-CB 3.41Å; L437-L441 WeakPolarHBondContact O-CG 3.34Å; L437-L441 PolarHBondContact O-N 2.9Å; L437-I492 HydrophobicContact CD2-CG2 4.42Å; L437-V494 HydrophobicContact CD2-CG2 3.52Å; L437-I528 HydrophobicContact CD1-CD1 4.16Å; L437-I528 HydrophobicContact CD2-CD1 3.76Å; L437-W570 HydrophobicContact CD1-CH2 4.13Å; L437-W570 HydrophobicContact CD1-CZ3 3.96Å; L437-L573 HydrophobicContact CD1-CD2 3.84Å
438	P	87.9	Confident	85.2	Confident	10 Å²	10	47.6 Å²	47.6	7%	0.065	23%	0.232	C	C	.	.	H	α-helix	trans	-58.6	-51.7	170.3	-27.3	37.4	0	0	0	112.8	L412 A433 V440 L441 E442 L449 I451	L412-P438 HydrophobicContact CD2-CG 3.92Å; A433-P438 WeakPolarHBondContact O-CD 3.21Å; P438-V440 VanDerWaalsContact C-N 3.33Å; P438-V440 PolarHBondContact O-N 2.84Å; P438-L441 PolarHBondContact O-N 2.98Å; P438-E442 WeakPolarHBondContact O-CB 3.17Å; P438-E442 WeakPolarHBondContact O-CG 3.41Å; P438-E442 PolarHBondContact O-N 3.04Å; P438-L449 HydrophobicContact CB-CD1 4.49Å; P438-I451 HydrophobicContact CB-CD1 3.89Å; P438-I451 HydrophobicContact CG-CD1 3.99Å
439	D	87.1	Confident	85.7	Confident	73 Å²	73	43.1 Å²	43.1	39%	0.39	21%	0.211	S	C	.	.	H	α-helix	trans	-59.5	-41.4	-175	-96	17.8	0	0	0	112.8	E435 K443	E435-D439 VanDerWaalsContact O-CB 3.31Å; E435-D439 WeakPolarHBondContact O-CB 3.48Å; E435-D439 PolarHBondContact O-N 2.9Å; E435-D439 VanDerWaalsContact O-N 3.11Å; D439-K443 HydrophobicContact CB-CD 4.26Å; D439-K443 WeakPolarHBondContact O-CA 3.37Å; D439-K443 WeakPolarHBondContact O-CB 3.38Å; D439-K443 PolarHBondContact O-N 2.77Å; D439-K443 VanDerWaalsContact OD1-CE 3.28Å; D439-K443 WeakPolarHBondContact OD1-CE 3.46Å; D439-K443 IonicContact OD1-NZ 2.79Å; D439-K443 PolarHBondContact OD1-NZ 2.71Å; D439-K443 IonicContact OD2-NZ 2.83Å; D439-K443 PolarHBondContact OD2-NZ 2.72Å
440	V	88.3	Confident	86	Confident	20 Å²	20	42.3 Å²	42.3	12%	0.121	21%	0.207	C	C	.	.	I	π-helix	trans	-72.6	-39.3	179.5	173.1	0	0	0	0	111.5	I436 P438 H444 Y445 L565 W570	I436-V440 HydrophobicContact CG2-CG2 4.32Å; I436-V440 WeakPolarHBondContact O-CB 3.42Å; I436-V440 VanDerWaalsContact O-CG2 3.29Å; I436-V440 WeakPolarHBondContact O-CG2 3.43Å; I436-V440 PolarHBondContact O-N 3.22Å; I436-V440 VanDerWaalsContact O-N 3.09Å; P438-V440 VanDerWaalsContact C-N 3.33Å; P438-V440 PolarHBondContact O-N 2.84Å; V440-H444 HydrophobicContact CG1-CB 4.41Å; V440-H444 WeakPolarHBondContact O-CB 3.39Å; V440-H444 PolarHBondContact O-N 2.78Å; V440-Y445 HydrophobicContact CG1-CD2 3.82Å; V440-Y445 HydrophobicContact CG1-CE2 3.51Å; V440-Y445 WeakPolarHBondContact O-CD2 3.36Å; V440-Y445 PolarHBondContact O-N 2.77Å; V440-Y445 VanDerWaalsContact O-N 3.08Å; V440-L565 HydrophobicContact CG1-CD2 3.71Å; V440-L565 HydrophobicContact CG2-CD2 4.05Å; V440-W570 HydrophobicContact CB-CH2 3.57Å; V440-W570 HydrophobicContact CB-CZ2 3.99Å; V440-W570 HydrophobicContact CB-CZ3 3.89Å; V440-W570 HydrophobicContact CG1-CD2 4.03Å; V440-W570 HydrophobicContact CG1-CE3 3.73Å; V440-W570 HydrophobicContact CG1-CH2 3.61Å; V440-W570 HydrophobicContact CG1-CZ2 3.88Å; V440-W570 HydrophobicContact CG1-CZ3 3.52Å; V440-W570 HydrophobicContact CG2-CH2 3.98Å; V440-W570 HydrophobicContact CG2-CZ2 3.92Å
441	L	88.7	Confident	86.2	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.01	21%	0.21	C	C	.	.	I	π-helix	trans	-70.4	-44.6	178.8	-72.7	174.2	0	0	0	112.4	L437 P438 Y445 G446 Y447 L449 I492 L573 M577	L437-L441 HydrophobicContact CD1-CD1 3.64Å; L437-L441 HydrophobicContact CD1-CG 4.17Å; L437-L441 HydrophobicContact CG-CD1 4.07Å; L437-L441 WeakPolarHBondContact O-CB 3.41Å; L437-L441 WeakPolarHBondContact O-CG 3.34Å; L437-L441 PolarHBondContact O-N 2.9Å; P438-L441 PolarHBondContact O-N 2.98Å; L441-Y445 HydrophobicContact CD2-CD2 4.3Å; L441-Y445 CarbonylContact O-C 3.55Å; L441-G446 PolarHBondContact O-N 3.49Å; L441-G446 VanDerWaalsContact O-N 3.15Å; L441-Y447 HydrophobicContact CD2-CD2 3.87Å; L441-Y447 HydrophobicContact CD2-CE2 4.3Å; L441-Y447 PolarHBondContact O-N 3.34Å; L441-L449 HydrophobicContact CB-CD1 3.99Å; L441-L449 HydrophobicContact CB-CD2 4.42Å; L441-L449 HydrophobicContact CB-CG 4.43Å; L441-L449 HydrophobicContact CD1-CD1 4.12Å; L441-L449 HydrophobicContact CD1-CD2 4.23Å; L441-I492 HydrophobicContact CD1-CD1 3.87Å; L441-L573 HydrophobicContact CD2-CD2 4.07Å; L441-L573 HydrophobicContact CD2-CG 4.47Å; L441-M577 HydrophobicContact CD2-CE 4.4Å
442	E	87.4	Confident	86.1	Confident	49 Å²	49	37.6 Å²	37.6	23%	0.229	19%	0.192	C	C	.	.	I	π-helix	trans	-76.7	-55.7	-179.5	-62	-171.7	146.8	0	0	111.6	P438 G446 Y447 L449 R454	P438-E442 WeakPolarHBondContact O-CB 3.17Å; P438-E442 WeakPolarHBondContact O-CG 3.41Å; P438-E442 PolarHBondContact O-N 3.04Å; E442-G446 VanDerWaalsContact O-CA 3.32Å; E442-G446 WeakPolarHBondContact O-CA 3.45Å; E442-G446 PolarHBondContact O-N 2.58Å; E442-Y447 WeakPolarHBondContact CA-O 3.4Å; E442-L449 HydrophobicContact CG-CB 4.33Å; E442-L449 HydrophobicContact CG-CD1 3.95Å; E442-L449 HydrophobicContact CG-CG 3.89Å; E442-R454 VanDerWaalsContact CD-NH1 3.32Å; E442-R454 IonicContact OE1-CZ 3.96Å; E442-R454 IonicContact OE1-NH1 3.22Å; E442-R454 PolarHBondContact OE1-NH1 2.77Å; E442-R454 IonicContact OE1-NH2 2.69Å; E442-R454 PolarHBondContact OE1-NH2 3.5Å; E442-R454 IonicContact OE2-CZ 2.69Å; E442-R454 IonicContact OE2-NH1 3.84Å; E442-R454 PolarHBondContact OE2-NH1 2.93Å; E442-R454 IonicContact OE2-NH2 2.67Å
443	K	85.1	Confident	85.4	Confident	140 Å²	140	41.7 Å²	41.7	61%	0.609	21%	0.214	S	C	*	.	I	π-helix	trans	-84.7	-29.6	-169.9	-55.5	166.7	177.1	163.3	0	114.2	D439	D439-K443 HydrophobicContact CB-CD 4.26Å; D439-K443 WeakPolarHBondContact O-CA 3.37Å; D439-K443 WeakPolarHBondContact O-CB 3.38Å; D439-K443 PolarHBondContact O-N 2.77Å; D439-K443 VanDerWaalsContact OD1-CE 3.28Å; D439-K443 WeakPolarHBondContact OD1-CE 3.46Å; D439-K443 IonicContact OD1-NZ 2.79Å; D439-K443 PolarHBondContact OD1-NZ 2.71Å; D439-K443 IonicContact OD2-NZ 2.83Å; D439-K443 PolarHBondContact OD2-NZ 2.72Å
444	H	83.2	Confident	85.1	Confident	96 Å²	96	47.4 Å²	47.4	44%	0.444	24%	0.236	S	C	.	.	I	π-helix	trans	-102.1	-30.5	-177.3	-170.9	66.4	0	0	0	113.8	V440	V440-H444 HydrophobicContact CG1-CB 4.41Å; V440-H444 WeakPolarHBondContact O-CB 3.39Å; V440-H444 PolarHBondContact O-N 2.78Å
445	Y	83.1	Confident	84.9	Confident	23 Å²	23	47 Å²	47	9%	0.09	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-11.3	177.8	-64.7	-55.7	0	0	0	115	V440 L441 Y447 W570	V440-Y445 HydrophobicContact CG1-CD2 3.82Å; V440-Y445 HydrophobicContact CG1-CE2 3.51Å; V440-Y445 WeakPolarHBondContact O-CD2 3.36Å; V440-Y445 PolarHBondContact O-N 2.77Å; V440-Y445 VanDerWaalsContact O-N 3.08Å; L441-Y445 HydrophobicContact CD2-CD2 4.3Å; L441-Y445 CarbonylContact O-C 3.55Å; Y445-Y447 HydrophobicContact CG-CE2 4.42Å; Y445-W570 HydrophobicContact CE2-CE3 4.07Å
446	G	82.9	Confident	84.5	Confident	48 Å²	48	43.8 Å²	43.8	50%	0.495	22%	0.22	S	C	.	.			trans	75.5	21.9	174.8	0	0	0	0	0	114.8	L441 E442	L441-G446 PolarHBondContact O-N 3.49Å; L441-G446 VanDerWaalsContact O-N 3.15Å; E442-G446 VanDerWaalsContact O-CA 3.32Å; E442-G446 WeakPolarHBondContact O-CA 3.45Å; E442-G446 PolarHBondContact O-N 2.58Å
447	Y	87.7	Confident	83.5	Confident	12 Å²	12	48.9 Å²	48.9	5%	0.047	25%	0.246	C	C	.	.			trans	-81.4	137.2	176.3	-69.2	-64.2	0	0	0	111.5	D409 L441 E442 Y445 L449 M577 P578 R580	D409-Y447 HydrophobicContact CB-CD1 3.81Å; D409-Y447 HydrophobicContact CB-CG 4.48Å; L441-Y447 HydrophobicContact CD2-CD2 3.87Å; L441-Y447 HydrophobicContact CD2-CE2 4.3Å; L441-Y447 PolarHBondContact O-N 3.34Å; E442-Y447 WeakPolarHBondContact CA-O 3.4Å; Y445-Y447 HydrophobicContact CG-CE2 4.42Å; Y447-L449 PolarHBondContact O-N 3.22Å; Y447-M577 HydrophobicContact CD1-CE 3.76Å; Y447-M577 HydrophobicContact CD2-CE 3.7Å; Y447-M577 HydrophobicContact CE1-CB 4.21Å; Y447-M577 HydrophobicContact CE1-CE 4.04Å; Y447-M577 HydrophobicContact CE2-CB 4.05Å; Y447-M577 HydrophobicContact CE2-CE 3.99Å; Y447-M577 HydrophobicContact CE2-CG 4.24Å; Y447-M577 HydrophobicContact CG-CE 3.58Å; Y447-M577 WeakPolarHBondContact OH-CB 3.47Å; Y447-P578 VanDerWaalsContact CE1-O 3.29Å; Y447-P578 WeakPolarHBondContact CE1-O 3.43Å; Y447-P578 PolarHBondContact OH-O 3.46Å; Y447-R580 HydrophobicContact CD1-CG 3.77Å; Y447-R580 HydrophobicContact CE1-CB 4.17Å; Y447-R580 HydrophobicContact CE1-CG 3.68Å
448	K	87.8	Confident	82	Confident	89 Å²	89	53.8 Å²	53.8	39%	0.387	28%	0.278	S	S	.	.			trans	-87	104.7	171.8	-175.7	-179.6	163.6	-153.3	0	109.5	D407 Y408 D409	D407-K448 VanDerWaalsContact O-CD 3.26Å; D407-K448 WeakPolarHBondContact O-CD 3.33Å; D407-K448 VanDerWaalsContact O-CE 3.26Å; D407-K448 WeakPolarHBondContact O-CE 3.33Å; D407-K448 PolarHBondContact O-NZ 3.01Å; Y408-K448 HydrophobicContact CD1-CD 4.27Å; Y408-K448 HydrophobicContact CD1-CG 3.93Å; Y408-K448 HydrophobicContact CE1-CD 4.45Å; Y408-K448 VanDerWaalsContact CE1-CE 3.45Å; Y408-K448 HydrophobicContact CE1-CG 4.31Å; D409-K448 PolarHBondContact N-O 2.85Å; D409-K448 PolarHBondContact OD2-N 2.95Å
449	L	88.3	Confident	80.3	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	156.2	177	-57.7	-176.7	0	0	0	111.9	Y408 A410 P438 L441 E442 Y447 I451	Y408-L449 WeakPolarHBondContact CD1-O 3.23Å; A410-L449 HydrophobicContact CB-CD2 3.86Å; A410-L449 CarbonylContact O-C 3.56Å; A410-L449 WeakPolarHBondContact O-CA 3.46Å; P438-L449 HydrophobicContact CB-CD1 4.49Å; L441-L449 HydrophobicContact CB-CD1 3.99Å; L441-L449 HydrophobicContact CB-CD2 4.42Å; L441-L449 HydrophobicContact CB-CG 4.43Å; L441-L449 HydrophobicContact CD1-CD1 4.12Å; L441-L449 HydrophobicContact CD1-CD2 4.23Å; E442-L449 HydrophobicContact CG-CB 4.33Å; E442-L449 HydrophobicContact CG-CD1 3.95Å; E442-L449 HydrophobicContact CG-CG 3.89Å; Y447-L449 PolarHBondContact O-N 3.22Å; L449-I451 HydrophobicContact CB-CG1 4.29Å
450	F	88.3	Confident	78.8	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.018	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	122.3	160.3	-174.5	-91.9	0	0	0	109.8	Y408 A410 Y411 L412 P452 D455 L456 C484	Y408-F450 HydrophobicContact CD1-CB 3.74Å; Y408-F450 HydrophobicContact CD1-CD2 4.41Å; Y408-F450 HydrophobicContact CD2-CB 4.27Å; Y408-F450 HydrophobicContact CD2-CD2 4.43Å; Y408-F450 HydrophobicContact CE1-CB 4.06Å; Y408-F450 AromaticContact CE1-CD2 3.9Å; Y408-F450 HydrophobicContact CE1-CD2 3.9Å; Y408-F450 AromaticContact CE2-CD2 3.94Å; Y408-F450 HydrophobicContact CE2-CD2 3.94Å; Y408-F450 HydrophobicContact CG-CB 3.87Å; Y408-F450 AromaticContact CZ-CD2 3.66Å; A410-F450 PolarHBondContact O-N 2.9Å; Y411-F450 HydrophobicContact CD2-CB 4.43Å; Y411-F450 AromaticContact CD2-CD1 3.51Å; Y411-F450 HydrophobicContact CD2-CD1 3.51Å; Y411-F450 HydrophobicContact CD2-CE1 4.22Å; Y411-F450 HydrophobicContact CD2-CG 4.32Å; Y411-F450 AromaticContact CE2-CD1 3.51Å; Y411-F450 HydrophobicContact CE2-CD1 3.51Å; Y411-F450 AromaticContact CE2-CE1 3.77Å; Y411-F450 HydrophobicContact CE2-CE1 3.77Å; Y411-F450 HydrophobicContact CG-CD1 4.48Å; L412-F450 PolarHBondContact N-O 3.47Å; F450-P452 HydrophobicContact CD1-CG 4.41Å; F450-P452 HydrophobicContact CE1-CG 4.15Å; F450-D455 HydrophobicContact CD2-CB 3.7Å; F450-D455 HydrophobicContact CE2-CB 3.56Å; F450-D455 HydrophobicContact CG-CB 4.45Å; F450-D455 HydrophobicContact CZ-CB 4.2Å; F450-L456 HydrophobicContact CZ-CB 3.92Å; F450-L456 HydrophobicContact CZ-CD1 4.1Å; F450-C484 HydrophobicContact CD1-CB 3.9Å; F450-C484 HydrophobicContact CD2-CB 4.37Å; F450-C484 HydrophobicContact CE1-CB 3.62Å; F450-C484 HydrophobicContact CE2-CB 4.14Å; F450-C484 HydrophobicContact CG-CB 4.25Å; F450-C484 HydrophobicContact CZ-CB 3.75Å; F450-C484 WeakPolarHBondContact CZ-SG 3.44Å
451	I	86.4	Confident	76.6	Confident	13 Å²	13	62.4 Å²	62.4	7%	0.067	35%	0.35	C	S	.	.			trans	-120.5	109.3	-177.3	-62.8	-176.1	0	0	0	108	L412 Y414 P438 L449 D453 R454 D455	L412-I451 HydrophobicContact CB-CG1 4.36Å; L412-I451 HydrophobicContact CD2-CD1 4.34Å; L412-I451 HydrophobicContact CD2-CG1 4.25Å; Y414-I451 HydrophobicContact CE1-CG2 4.05Å; P438-I451 HydrophobicContact CB-CD1 3.89Å; P438-I451 HydrophobicContact CG-CD1 3.99Å; L449-I451 HydrophobicContact CB-CG1 4.29Å; I451-D453 PolarHBondContact O-N 2.88Å; I451-R454 HydrophobicContact CB-CB 4.17Å; I451-R454 HydrophobicContact CG2-CB 4Å; I451-R454 PolarHBondContact O-N 2.77Å; I451-D455 PolarHBondContact N-OD2 3.06Å; I451-D455 WeakPolarHBondContact O-CB 3.32Å; I451-D455 PolarHBondContact O-N 3.41Å
452	P	80.8	Confident	74.5	Confident	17 Å²	17	70.5 Å²	70.5	11%	0.11	39%	0.392	C	S	.	.	H	α-helix	trans	-54	-44.7	-171.7	-30.5	36.7	0	0	0	115	Y411 L412 F450 R454 L456	Y411-P452 HydrophobicContact CE1-CG 4.2Å; Y411-P452 HydrophobicContact CE2-CG 4.16Å; Y411-P452 VanDerWaalsContact OH-CG 3.23Å; Y411-P452 WeakPolarHBondContact OH-CG 3.01Å; L412-P452 WeakPolarHBondContact O-CD 3.41Å; F450-P452 HydrophobicContact CD1-CG 4.41Å; F450-P452 HydrophobicContact CE1-CG 4.15Å; P452-R454 PolarHBondContact O-N 3Å; P452-R454 VanDerWaalsContact O-N 3.08Å; P452-L456 VanDerWaalsContact O-CB 3.23Å; P452-L456 WeakPolarHBondContact O-CB 3.22Å; P452-L456 PolarHBondContact O-N 2.69Å
453	D	72.8	Confident	72	Confident	86 Å²	86	74.5 Å²	74.5	46%	0.46	42%	0.421	S	S	.	.	H	α-helix	trans	-66.5	-10.3	180	-65.5	-20.7	0	0	0	114.6	Y414 K416 I451	Y414-D453 WeakPolarHBondContact CE2-OD2 3.48Å; Y414-D453 VanDerWaalsContact OH-CB 3.32Å; Y414-D453 WeakPolarHBondContact OH-CB 3.4Å; Y414-D453 PolarHBondContact OH-OD2 2.82Å; K416-D453 WeakPolarHBondContact CD-OD2 3.47Å; K416-D453 IonicContact NZ-OD2 3.91Å; I451-D453 PolarHBondContact O-N 2.88Å
454	R	79.7	Confident	70.1	Confident	120 Å²	120	75.8 Å²	75.8	45%	0.453	43%	0.434	S	S	.	.	H	α-helix	trans	-116.2	-45.4	-175.2	-173.9	-172.5	70.3	-173.5	-4.9	112.1	E442 I451 P452	E442-R454 VanDerWaalsContact CD-NH1 3.32Å; E442-R454 IonicContact OE1-CZ 3.96Å; E442-R454 IonicContact OE1-NH1 3.22Å; E442-R454 PolarHBondContact OE1-NH1 2.77Å; E442-R454 IonicContact OE1-NH2 2.69Å; E442-R454 PolarHBondContact OE1-NH2 3.5Å; E442-R454 IonicContact OE2-CZ 2.69Å; E442-R454 IonicContact OE2-NH1 3.84Å; E442-R454 PolarHBondContact OE2-NH1 2.93Å; E442-R454 IonicContact OE2-NH2 2.67Å; I451-R454 HydrophobicContact CB-CB 4.17Å; I451-R454 HydrophobicContact CG2-CB 4Å; I451-R454 PolarHBondContact O-N 2.77Å; P452-R454 PolarHBondContact O-N 3Å; P452-R454 VanDerWaalsContact O-N 3.08Å
455	D	78.2	Confident	68	Low	49 Å²	49	80.1 Å²	80.1	26%	0.262	45%	0.454	S	S	.	.	H	α-helix	trans	-104.6	-13.7	-164.6	-56	-35.4	0	0	0	112.8	F450 I451 I457	F450-D455 HydrophobicContact CD2-CB 3.7Å; F450-D455 HydrophobicContact CE2-CB 3.56Å; F450-D455 HydrophobicContact CG-CB 4.45Å; F450-D455 HydrophobicContact CZ-CB 4.2Å; I451-D455 PolarHBondContact N-OD2 3.06Å; I451-D455 WeakPolarHBondContact O-CB 3.32Å; I451-D455 PolarHBondContact O-N 3.41Å; D455-I457 PolarHBondContact O-N 2.85Å
456	L	75.6	Confident	66	Low	27 Å²	27	87.5 Å²	87.5	14%	0.141	49%	0.489	C	S	.	.			trans	-90.1	93.5	176.6	-169.8	69.5	0	0	0	111.1	F450 P452 P458 Y477 D480	F450-L456 HydrophobicContact CZ-CB 3.92Å; F450-L456 HydrophobicContact CZ-CD1 4.1Å; P452-L456 VanDerWaalsContact O-CB 3.23Å; P452-L456 WeakPolarHBondContact O-CB 3.22Å; P452-L456 PolarHBondContact O-N 2.69Å; L456-P458 WeakPolarHBondContact O-CD 3.48Å; L456-Y477 HydrophobicContact CD2-CD2 3.75Å; L456-Y477 HydrophobicContact CD2-CE2 3.55Å; L456-D480 HydrophobicContact CD1-CB 4.02Å
457	I	65.3	Low	64.6	Low	146 Å²	146	95.7 Å²	95.7	75%	0.749	51%	0.507	S	S	*	.			trans	-71.8	120.4	167	-58.4	173.5	0	0	0	108	D455 T459	D455-I457 PolarHBondContact O-N 2.85Å; I457-T459 PolarHBondContact O-N 2.87Å; I457-T459 VanDerWaalsContact O-N 3.13Å
458	P	58.3	Low	62.6	Low	104 Å²	104	103.6 Å²	103.6	68%	0.675	54%	0.544	S	S	*	.			trans	-66.9	114.3	-178.9	-21.7	34.3	0	0	0	111.6	L456 G460	L456-P458 WeakPolarHBondContact O-CD 3.48Å; P458-G460 PolarHBondContact O-N 2.88Å
459	T	52.3	Low	61	Low	115 Å²	115	102.3 Å²	102.3	71%	0.706	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	16.6	-173.3	-32.3	0	0	0	0	114.5	I457 D480	I457-T459 PolarHBondContact O-N 2.87Å; I457-T459 VanDerWaalsContact O-N 3.13Å; T459-D480 PolarHBondContact OG1-OD2 2.76Å
460	G	55.7	Low	59.4	Low	63 Å²	63	108.9 Å²	108.9	65%	0.649	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	15.7	-169.1	0	0	0	0	0	116.3	P458	P458-G460 PolarHBondContact O-N 2.88Å
461	S	41.4	Very low	58	Low	106 Å²	106	114.4 Å²	114.4	74%	0.741	61%	0.611	S	S	*	*			trans	-121.3	98.3	180	-164.3	0	0	0	0	112.7
462	L	44.5	Very low	56.7	Low	171 Å²	171	123 Å²	123	90%	0.895	64%	0.643	S	S	*	*	S	Bend	trans	-176.5	31.1	137.8	-101.7	171	0	0	0	115.4
463	T	35.7	Very low	55.8	Low	134 Å²	134	127.6 Å²	127.6	82%	0.822	67%	0.665	S	S	*	*			trans	-125.6	105	162	50.9	0	0	0	0	110	E465	T463-E465 PolarHBondContact O-N 3.37Å
464	N	43.8	Very low	55.4	Low	167 Å²	167	130 Å²	130	89%	0.893	67%	0.672	S	S	*	*			trans	-69.4	109.9	165	-77.3	-18.6	0	0	0	108.7
465	E	39.8	Very low	54.8	Low	186 Å²	186	125.8 Å²	125.8	87%	0.869	67%	0.666	S	S	*	*			trans	-171.9	144.8	138.9	-108	164.3	-142.1	0	0	113	T463	T463-E465 PolarHBondContact O-N 3.37Å
466	H	41.3	Very low	54.4	Low	179 Å²	179	125.8 Å²	125.8	83%	0.829	67%	0.672	S	S	*	*			trans	51.5	98.1	165.8	-109.2	78.2	0	0	0	121.2	Q468	H466-Q468 PolarHBondContact O-N 3.21Å; H466-Q468 VanDerWaalsContact O-N 3.08Å
467	Y	52.8	Low	54.5	Low	220 Å²	220	129.5 Å²	129.5	86%	0.863	69%	0.685	S	S	*	*	S	Bend	trans	-28.2	97.7	146.4	178.7	-92.8	0	0	0	114.9
468	Q	46.2	Very low	55.1	Low	178 Å²	178	124.3 Å²	124.3	83%	0.832	66%	0.659	S	S	*	*			trans	-175.5	41.3	151.2	-162.5	96.9	48.1	0	0	113.9	H466	H466-Q468 PolarHBondContact O-N 3.21Å; H466-Q468 VanDerWaalsContact O-N 3.08Å
469	D	53.6	Low	56	Low	62 Å²	62	126.3 Å²	126.3	33%	0.332	66%	0.659	S	S	.	*			trans	-154.5	54.9	179.8	-145	-18.9	0	0	0	119	T471 R472 L473	D469-T471 PolarHBondContact O-N 2.94Å; D469-R472 PolarHBondContact O-N 2.92Å; D469-R472 WeakPolarHBondContact OD1-CB 3.46Å; D469-R472 WeakPolarHBondContact OD1-CG 3.3Å; D469-R472 PolarHBondContact OD1-N 3.26Å; D469-R472 WeakPolarHBondContact OD2-CD 3.27Å; D469-R472 WeakPolarHBondContact OD2-CG 3.4Å; D469-R472 IonicContact OD2-CZ 2.79Å; D469-R472 IonicContact OD2-NE 2.78Å; D469-R472 PolarHBondContact OD2-NE 2.92Å; D469-R472 IonicContact OD2-NH1 3.33Å; D469-R472 PolarHBondContact OD2-NH1 3.1Å; D469-L473 PolarHBondContact O-N 2.88Å
470	D	55.4	Low	57.4	Low	140 Å²	140	122.2 Å²	122.2	75%	0.749	63%	0.633	S	S	*	*	H	α-helix	trans	-61.2	-25.7	170.2	-58.6	-46.3	0	0	0	112.6	L473 F474	D470-L473 PolarHBondContact O-N 2.87Å; D470-F474 PolarHBondContact O-N 3.05Å
471	T	59.3	Low	58.7	Low	120 Å²	120	119.2 Å²	119.2	74%	0.736	60%	0.602	S	S	*	*	H	α-helix	trans	-68.4	-45.9	-179	-50.4	0	0	0	0	112.1	D469 L473 F474 G475	D469-T471 PolarHBondContact O-N 2.94Å; T471-L473 VanDerWaalsContact C-N 3.34Å; T471-F474 PolarHBondContact O-N 2.99Å; T471-G475 PolarHBondContact O-N 3.15Å
472	R	58.6	Low	60.8	Low	194 Å²	194	114.4 Å²	114.4	73%	0.732	57%	0.568	S	S	*	*	H	α-helix	trans	-67.7	-33.8	173.9	-76	-169.3	-173.1	120.4	-7.9	112.3	D469 F474 G475 A476	D469-R472 PolarHBondContact O-N 2.92Å; D469-R472 WeakPolarHBondContact OD1-CB 3.46Å; D469-R472 WeakPolarHBondContact OD1-CG 3.3Å; D469-R472 PolarHBondContact OD1-N 3.26Å; D469-R472 WeakPolarHBondContact OD2-CD 3.27Å; D469-R472 WeakPolarHBondContact OD2-CG 3.4Å; D469-R472 IonicContact OD2-CZ 2.79Å; D469-R472 IonicContact OD2-NE 2.78Å; D469-R472 PolarHBondContact OD2-NE 2.92Å; D469-R472 IonicContact OD2-NH1 3.33Å; D469-R472 PolarHBondContact OD2-NH1 3.1Å; R472-F474 VanDerWaalsContact C-N 3.34Å; R472-F474 PolarHBondContact O-N 3.01Å; R472-G475 PolarHBondContact O-N 3.49Å; R472-A476 WeakPolarHBondContact O-CB 3.45Å; R472-A476 PolarHBondContact O-N 3.44Å
473	L	61.6	Low	62.6	Low	112 Å²	112	111 Å²	111	59%	0.586	54%	0.544	S	S	*	.	H	α-helix	trans	-61.8	-43.6	176.7	-165.1	73.9	0	0	0	111.3	D469 D470 T471 Y477	D469-L473 PolarHBondContact O-N 2.88Å; D470-L473 PolarHBondContact O-N 2.87Å; T471-L473 VanDerWaalsContact C-N 3.34Å; L473-Y477 PolarHBondContact O-N 2.88Å
474	F	64.4	Low	65	Low	138 Å²	138	104.9 Å²	104.9	61%	0.605	51%	0.506	S	S	*	.	H	α-helix	trans	-68.2	-37.2	175.2	-169.4	-108.6	0	0	0	112.8	D470 T471 R472 Y477 I478	D470-F474 PolarHBondContact O-N 3.05Å; T471-F474 PolarHBondContact O-N 2.99Å; R472-F474 VanDerWaalsContact C-N 3.34Å; R472-F474 PolarHBondContact O-N 3.01Å; F474-Y477 PolarHBondContact O-N 2.04Å; F474-I478 HydrophobicContact CD1-CD1 3.91Å; F474-I478 HydrophobicContact CE1-CD1 3.49Å; F474-I478 VanDerWaalsContact CE1-CD1 3.49Å; F474-I478 HydrophobicContact CZ-CD1 3.92Å; F474-I478 PolarHBondContact O-N 3.38Å
475	G	67.5	Low	67.1	Low	30 Å²	30	97 Å²	97	31%	0.309	46%	0.464	S	S	.	.	H	α-helix	trans	-61.2	-49.9	173.7	0	0	0	0	0	112.9	T471 R472 Y477 I478 E479	T471-G475 PolarHBondContact O-N 3.15Å; R472-G475 PolarHBondContact O-N 3.49Å; G475-Y477 VanDerWaalsContact C-N 3.31Å; G475-Y477 PolarHBondContact O-N 2.92Å; G475-I478 PolarHBondContact O-N 2.79Å; G475-I478 VanDerWaalsContact O-N 3.11Å; G475-E479 PolarHBondContact O-N 3.21Å
476	A	69.9	Low	69.3	Low	49 Å²	49	90.6 Å²	90.6	41%	0.405	44%	0.435	S	S	.	.	H	α-helix	trans	-59.9	-39.8	178.3	0	0	0	0	0	112.3	R472 I478 E479 D480	R472-A476 WeakPolarHBondContact O-CB 3.45Å; R472-A476 PolarHBondContact O-N 3.44Å; A476-I478 PolarHBondContact O-N 2.87Å; A476-E479 PolarHBondContact O-N 2.75Å; A476-D480 WeakPolarHBondContact O-CB 3.48Å; A476-D480 PolarHBondContact O-N 3.29Å
477	Y	77.1	Confident	71.4	Confident	106 Å²	106	84.5 Å²	84.5	42%	0.416	41%	0.408	S	S	.	.	H	α-helix	trans	-60.2	-42.1	174.1	174.5	-94.7	0	0	0	112.5	L456 L473 F474 G475 V481 I507	L456-Y477 HydrophobicContact CD2-CD2 3.75Å; L456-Y477 HydrophobicContact CD2-CE2 3.55Å; L473-Y477 PolarHBondContact O-N 2.88Å; F474-Y477 PolarHBondContact O-N 2.04Å; G475-Y477 VanDerWaalsContact C-N 3.31Å; G475-Y477 PolarHBondContact O-N 2.92Å; Y477-V481 HydrophobicContact CD1-CG2 4.48Å; Y477-V481 HydrophobicContact CE1-CG2 4.06Å; Y477-V481 HydrophobicContact CE2-CG2 4.33Å; Y477-V481 WeakPolarHBondContact O-CB 3.05Å; Y477-V481 WeakPolarHBondContact O-CG2 3.41Å; Y477-V481 PolarHBondContact O-N 3.25Å; Y477-I507 HydrophobicContact CE1-CD1 4.41Å
478	I	77.6	Confident	73.2	Confident	36 Å²	36	74 Å²	74	19%	0.185	37%	0.367	C	S	.	.	H	α-helix	trans	-68.3	-40.6	177.7	-71.2	175.2	0	0	0	111.4	F474 G475 A476 V481 A482 I507 E511	F474-I478 HydrophobicContact CD1-CD1 3.91Å; F474-I478 HydrophobicContact CE1-CD1 3.49Å; F474-I478 VanDerWaalsContact CE1-CD1 3.49Å; F474-I478 HydrophobicContact CZ-CD1 3.92Å; F474-I478 PolarHBondContact O-N 3.38Å; G475-I478 PolarHBondContact O-N 2.79Å; G475-I478 VanDerWaalsContact O-N 3.11Å; A476-I478 PolarHBondContact O-N 2.87Å; I478-V481 PolarHBondContact O-N 3.47Å; I478-A482 WeakPolarHBondContact O-CB 3.12Å; I478-A482 PolarHBondContact O-N 3.24Å; I478-I507 HydrophobicContact CG1-CD1 4.12Å; I478-E511 HydrophobicContact CG2-CB 3.96Å; I478-E511 HydrophobicContact CG2-CG 3.48Å; I478-E511 VanDerWaalsContact CG2-CG 3.48Å
479	E	78.1	Confident	75.2	Confident	147 Å²	147	67.4 Å²	67.4	69%	0.687	34%	0.335	S	S	*	.	H	α-helix	trans	-64.4	-42.8	176.3	-71.2	-177.2	178.9	0	0	112.2	G475 A476 A482 R483	G475-E479 PolarHBondContact O-N 3.21Å; A476-E479 PolarHBondContact O-N 2.75Å; E479-A482 PolarHBondContact O-N 2.84Å; E479-R483 WeakPolarHBondContact O-CB 3.48Å; E479-R483 PolarHBondContact O-N 2.87Å
480	D	80.4	Confident	77	Confident	29 Å²	29	66.4 Å²	66.4	16%	0.155	33%	0.326	C	S	.	.	H	α-helix	trans	-66.9	-37.1	175.3	-90.9	-29	0	0	0	112.2	L456 T459 A476 R483 C484	L456-D480 HydrophobicContact CD1-CB 4.02Å; T459-D480 PolarHBondContact OG1-OD2 2.76Å; A476-D480 WeakPolarHBondContact O-CB 3.48Å; A476-D480 PolarHBondContact O-N 3.29Å; D480-R483 WeakPolarHBondContact O-CB 3.31Å; D480-R483 PolarHBondContact O-N 2.97Å; D480-R483 IonicContact OD1-CZ 2.65Å; D480-R483 IonicContact OD1-NE 3.92Å; D480-R483 PolarHBondContact OD1-NE 2.83Å; D480-R483 IonicContact OD1-NH2 2.73Å; D480-R483 PolarHBondContact OD1-NH2 3.05Å; D480-C484 PolarHBondContact O-N 2.92Å; D480-C484 PolarHBondContact O-SG 3.31Å; D480-C484 VanDerWaalsContact O-SG 3.32Å
481	V	84.4	Confident	78.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.5	-46.8	171.1	164.4	0	0	0	0	111.2	Y411 Y477 I478 R483 C484 V485 I507 L514	Y411-V481 HydrophobicContact CE2-CG1 4.46Å; Y411-V481 WeakPolarHBondContact OH-CG1 3.29Å; Y477-V481 HydrophobicContact CD1-CG2 4.48Å; Y477-V481 HydrophobicContact CE1-CG2 4.06Å; Y477-V481 HydrophobicContact CE2-CG2 4.33Å; Y477-V481 WeakPolarHBondContact O-CB 3.05Å; Y477-V481 WeakPolarHBondContact O-CG2 3.41Å; Y477-V481 PolarHBondContact O-N 3.25Å; I478-V481 PolarHBondContact O-N 3.47Å; V481-R483 VanDerWaalsContact C-N 3.27Å; V481-R483 PolarHBondContact O-N 3.07Å; V481-C484 PolarHBondContact O-N 3.08Å; V481-V485 HydrophobicContact CG1-CG2 4.37Å; V481-V485 WeakPolarHBondContact O-CG2 3.31Å; V481-V485 PolarHBondContact O-N 2.62Å; V481-I507 HydrophobicContact CB-CD1 4.17Å; V481-I507 HydrophobicContact CG1-CD1 3.78Å; V481-I507 HydrophobicContact CG2-CD1 4.39Å; V481-L514 HydrophobicContact CG1-CD1 4.44Å
482	A	83.9	Confident	80.3	Confident	4 Å²	4	54 Å²	54	3%	0.033	26%	0.256	C	S	.	.	H	α-helix	trans	-60.5	-38.3	178.1	0	0	0	0	0	112	I478 E479 D486 L514	I478-A482 WeakPolarHBondContact O-CB 3.12Å; I478-A482 PolarHBondContact O-N 3.24Å; E479-A482 PolarHBondContact O-N 2.84Å; A482-D486 WeakPolarHBondContact O-CB 3.43Å; A482-D486 PolarHBondContact O-N 3.47Å; A482-D486 VanDerWaalsContact O-N 3.08Å; A482-L514 HydrophobicContact CB-CD2 4.35Å; A482-L514 HydrophobicContact CB-CG 4.12Å
483	R	84.1	Confident	81.9	Confident	101 Å²	101	44.9 Å²	44.9	38%	0.381	22%	0.222	S	C	.	.	H	α-helix	trans	-63.1	-46.5	172.9	-179.6	178.8	61.8	75.8	-10	112.4	E479 D480 V481 D486 Q487	E479-R483 WeakPolarHBondContact O-CB 3.48Å; E479-R483 PolarHBondContact O-N 2.87Å; D480-R483 WeakPolarHBondContact O-CB 3.31Å; D480-R483 PolarHBondContact O-N 2.97Å; D480-R483 IonicContact OD1-CZ 2.65Å; D480-R483 IonicContact OD1-NE 3.92Å; D480-R483 PolarHBondContact OD1-NE 2.83Å; D480-R483 IonicContact OD1-NH2 2.73Å; D480-R483 PolarHBondContact OD1-NH2 3.05Å; V481-R483 VanDerWaalsContact C-N 3.27Å; V481-R483 PolarHBondContact O-N 3.07Å; R483-D486 PolarHBondContact O-N 2.78Å; R483-Q487 WeakPolarHBondContact O-CG 3.45Å; R483-Q487 PolarHBondContact O-N 2.71Å
484	C	86	Confident	83.2	Confident	4 Å²	4	39.6 Å²	39.6	3%	0.027	19%	0.194	C	C	.	.	H	α-helix	trans	-71.4	-30.4	-179.1	-68.7	0	0	0	0	113.5	Y411 F450 D480 V481 S488	Y411-C484 HydrophobicContact CD2-CB 4.27Å; Y411-C484 HydrophobicContact CE2-CB 4.15Å; F450-C484 HydrophobicContact CD1-CB 3.9Å; F450-C484 HydrophobicContact CD2-CB 4.37Å; F450-C484 HydrophobicContact CE1-CB 3.62Å; F450-C484 HydrophobicContact CE2-CB 4.14Å; F450-C484 HydrophobicContact CG-CB 4.25Å; F450-C484 HydrophobicContact CZ-CB 3.75Å; F450-C484 WeakPolarHBondContact CZ-SG 3.44Å; D480-C484 PolarHBondContact O-N 2.92Å; D480-C484 PolarHBondContact O-SG 3.31Å; D480-C484 VanDerWaalsContact O-SG 3.32Å; V481-C484 PolarHBondContact O-N 3.08Å; C484-S488 PolarHBondContact O-N 2.84Å; C484-S488 PolarHBondContact O-OG 2.89Å
485	V	86.9	Confident	84.3	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-66.7	-41.9	169.3	175.1	0	0	0	0	110.6	Y411 V481 S488 F508 L514 M517 I523	Y411-V485 HydrophobicContact CD1-CG2 4.01Å; Y411-V485 HydrophobicContact CD2-CB 4.38Å; Y411-V485 HydrophobicContact CD2-CG2 3.52Å; Y411-V485 HydrophobicContact CE1-CG2 4.1Å; Y411-V485 HydrophobicContact CE2-CG2 3.61Å; Y411-V485 HydrophobicContact CG-CG2 3.73Å; V481-V485 HydrophobicContact CG1-CG2 4.37Å; V481-V485 WeakPolarHBondContact O-CG2 3.31Å; V481-V485 PolarHBondContact O-N 2.62Å; V485-S488 WeakPolarHBondContact O-CB 3.42Å; V485-S488 PolarHBondContact O-N 2.68Å; V485-F508 HydrophobicContact CG2-CE1 4.25Å; V485-L514 HydrophobicContact CB-CD2 3.71Å; V485-L514 HydrophobicContact CG1-CD2 3.7Å; V485-L514 HydrophobicContact CG2-CD2 3.86Å; V485-M517 HydrophobicContact CG1-CE 4.04Å; V485-I523 HydrophobicContact CG1-CD1 3.78Å; V485-I523 WeakPolarHBondContact O-CD1 3.47Å
486	D	86	Confident	85.2	Confident	52 Å²	52	31.8 Å²	31.8	28%	0.278	15%	0.151	S	C	.	.	H	α-helix	trans	-66.5	-37.2	175.8	-166	8.5	0	0	0	112.1	K406 A482 R483 S488 R513 M517	K406-D486 VanDerWaalsContact CD-O 3.31Å; K406-D486 WeakPolarHBondContact CD-O 3.44Å; K406-D486 WeakPolarHBondContact CE-O 3.36Å; K406-D486 PolarHBondContact NZ-O 3.16Å; K406-D486 IonicContact NZ-OD1 3.93Å; K406-D486 PolarHBondContact NZ-OD1 2.82Å; A482-D486 WeakPolarHBondContact O-CB 3.43Å; A482-D486 PolarHBondContact O-N 3.47Å; A482-D486 VanDerWaalsContact O-N 3.08Å; R483-D486 PolarHBondContact O-N 2.78Å; D486-S488 PolarHBondContact O-N 2.84Å; D486-R513 IonicContact OD2-CZ 2.69Å; D486-R513 IonicContact OD2-NE 3.75Å; D486-R513 IonicContact OD2-NH2 3.28Å; D486-R513 PolarHBondContact OD2-NH2 2.9Å; D486-M517 HydrophobicContact CB-SD 4.35Å
487	Q	86.5	Confident	85.7	Confident	52 Å²	52	30.7 Å²	30.7	24%	0.243	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	0	170.8	-71.4	177.5	-82.2	0	0	114.3	K406 D407 Y408 R483	K406-Q487 CarbonylContact C-O 3.58Å; D407-Q487 HydrophobicContact CB-CB 4.43Å; D407-Q487 PolarHBondContact N-O 3.13Å; D407-Q487 VanDerWaalsContact N-O 3.13Å; D407-Q487 PolarHBondContact OD2-NE2 2.84Å; Y408-Q487 HydrophobicContact CD2-CB 4.2Å; Y408-Q487 PolarHBondContact N-O 3.07Å; R483-Q487 WeakPolarHBondContact O-CG 3.45Å; R483-Q487 PolarHBondContact O-N 2.71Å
488	S	89.4	Confident	85.8	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.128	C	C	.	.	B	Isolated β-bridge	trans	-109.3	138.2	-177.1	-62.1	0	0	0	0	113.9	K406 Y408 Y411 C484 V485 D486	K406-S488 WeakPolarHBondContact CD-O 3.37Å; K406-S488 PolarHBondContact NZ-O 3.37Å; Y408-S488 CarbonylContact O-C 3.55Å; Y408-S488 WeakPolarHBondContact O-CA 3.41Å; Y411-S488 PolarHBondContact N-OG 2.84Å; C484-S488 PolarHBondContact O-N 2.84Å; C484-S488 PolarHBondContact O-OG 2.89Å; V485-S488 WeakPolarHBondContact O-CB 3.42Å; V485-S488 PolarHBondContact O-N 2.68Å; D486-S488 PolarHBondContact O-N 2.84Å
489	K	88.4	Confident	86.1	Confident	39 Å²	39	25.5 Å²	25.5	17%	0.17	12%	0.12	C	C	.	.	S	Bend	trans	-75.9	-20.4	178.6	-61.5	173	-164.4	162.6	0	113.7	G403 K406 Y408 D409 P578	G403-K489 VanDerWaalsContact O-CE 3.31Å; G403-K489 WeakPolarHBondContact O-CE 3.49Å; K406-K489 HydrophobicContact CB-CG 3.79Å; K406-K489 HydrophobicContact CD-CG 4.32Å; Y408-K489 WeakPolarHBondContact O-CG 3.39Å; Y408-K489 PolarHBondContact O-N 2.84Å; D409-K489 IonicContact OD1-NZ 3.63Å; D409-K489 PolarHBondContact OD1-NZ 3.26Å; K489-P578 HydrophobicContact CB-CG 3.94Å; K489-P578 HydrophobicContact CD-CB 4.36Å; K489-P578 HydrophobicContact CD-CG 4.31Å
490	R	91.1	Very high	86.4	Confident	40 Å²	40	18.5 Å²	18.5	15%	0.151	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	158.4	174.8	-56.8	-65.7	179.1	-95.5	-3.1	110.2	D400 D409 A410 Y411 K524 I526 E576 M577 P578	D400-R490 IonicContact OD2-NH2 3.54Å; D409-R490 PolarHBondContact O-N 3.43Å; A410-R490 CarbonylContact C-O 3.48Å; A410-R490 VanDerWaalsContact CA-O 3.28Å; A410-R490 WeakPolarHBondContact CA-O 3.42Å; A410-R490 HydrophobicContact CB-CB 3.94Å; Y411-R490 PolarHBondContact N-O 2.86Å; R490-K524 WeakPolarHBondContact CA-O 3.44Å; R490-I526 HydrophobicContact CB-CD1 4.43Å; R490-I526 HydrophobicContact CG-CD1 4.34Å; R490-E576 PolarHBondContact NE-O 3.21Å; R490-M577 HydrophobicContact CG-SD 4.28Å; R490-P578 HydrophobicContact CG-CG 3.86Å
491	L	91.6	Very high	86.4	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	116.2	166.9	173.3	58.2	0	0	0	108.8	Y411 I493 F508 L518 I523 K524 V525 I526	Y411-L491 HydrophobicContact CD1-CD1 3.52Å; Y411-L491 HydrophobicContact CE1-CD1 4.32Å; Y411-L491 HydrophobicContact CG-CD1 4.18Å; L491-I493 HydrophobicContact CD1-CG1 4.24Å; L491-I493 HydrophobicContact CD2-CD1 4.09Å; L491-I493 HydrophobicContact CD2-CG1 4.35Å; L491-I493 HydrophobicContact CG-CD1 4.25Å; L491-I493 HydrophobicContact CG-CG1 4Å; L491-F508 HydrophobicContact CD1-CE1 4.1Å; L491-F508 HydrophobicContact CD1-CZ 3.97Å; L491-F508 HydrophobicContact CD2-CD1 4.12Å; L491-F508 HydrophobicContact CD2-CE1 3.75Å; L491-F508 HydrophobicContact CD2-CZ 4.12Å; L491-L518 HydrophobicContact CD2-CD2 4.07Å; L491-I523 HydrophobicContact CB-CD1 3.87Å; L491-I523 HydrophobicContact CB-CG1 4.12Å; L491-K524 PolarHBondContact N-O 2.84Å; L491-K524 VanDerWaalsContact N-O 3.09Å; L491-V525 HydrophobicContact CB-CG2 4.4Å; L491-V525 HydrophobicContact CD2-CG2 4.36Å; L491-V525 HydrophobicContact CG-CG1 4.49Å; L491-V525 CarbonylContact O-C 3.57Å; L491-V525 WeakPolarHBondContact O-CA 3.06Å; L491-I526 PolarHBondContact O-N 2.87Å
492	I	93	Very high	86.1	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	124	172.9	-58.5	169.6	0	0	0	107.9	A410 Y411 L412 S413 L437 L441 V494 I526 I528 M577	A410-I492 HydrophobicContact CB-CD1 3.63Å; A410-I492 HydrophobicContact CB-CG1 3.93Å; Y411-I492 PolarHBondContact O-N 3.44Å; L412-I492 HydrophobicContact CD1-CB 3.86Å; L412-I492 HydrophobicContact CD1-CG2 3.61Å; S413-I492 PolarHBondContact N-O 3.05Å; L437-I492 HydrophobicContact CD2-CG2 4.42Å; L441-I492 HydrophobicContact CD1-CD1 3.87Å; I492-V494 HydrophobicContact CG2-CG2 4.25Å; I492-I526 WeakPolarHBondContact CA-O 3.34Å; I492-I526 HydrophobicContact CG1-CB 4.25Å; I492-I526 HydrophobicContact CG1-CD1 4.37Å; I492-I528 HydrophobicContact CG2-CD1 3.77Å; I492-I528 HydrophobicContact CG2-CG1 4.33Å; I492-M577 HydrophobicContact CD1-CE 4.5Å; I492-M577 HydrophobicContact CD1-SD 4.05Å
493	I	91.3	Very high	86	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.01	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	119.1	174.9	-62.5	172	0	0	0	108.2	L491 M495 Y499 F508 V525 I526 L527 I528	L491-I493 HydrophobicContact CD1-CG1 4.24Å; L491-I493 HydrophobicContact CD2-CD1 4.09Å; L491-I493 HydrophobicContact CD2-CG1 4.35Å; L491-I493 HydrophobicContact CG-CD1 4.25Å; L491-I493 HydrophobicContact CG-CG1 4Å; I493-M495 HydrophobicContact CG2-CG 4.16Å; I493-Y499 HydrophobicContact CG2-CE1 3.63Å; I493-Y499 HydrophobicContact CG2-CE2 4.5Å; I493-Y499 WeakPolarHBondContact CG2-OH 3.3Å; I493-F508 HydrophobicContact CD1-CD2 4.43Å; I493-F508 HydrophobicContact CD1-CE2 4.22Å; I493-F508 HydrophobicContact CG1-CE2 4.47Å; I493-V525 HydrophobicContact CD1-CG1 4.02Å; I493-V525 HydrophobicContact CG1-CG1 4.45Å; I493-I526 PolarHBondContact N-O 3.15Å; I493-L527 HydrophobicContact CB-CD1 3.62Å; I493-L527 HydrophobicContact CD1-CD1 4.45Å; I493-L527 HydrophobicContact CG2-CD1 3.6Å; I493-I528 PolarHBondContact O-N 3.38Å
494	V	90.4	Very high	85.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	105.9	-179.7	-168.5	0	0	0	0	109.6	L412 S413 F432 A433 L437 I492 T496	L412-V494 HydrophobicContact CD1-CG2 3.75Å; S413-V494 PolarHBondContact O-N 2.91Å; F432-V494 HydrophobicContact CE1-CG1 4.49Å; A433-V494 HydrophobicContact CB-CB 4.38Å; A433-V494 HydrophobicContact CB-CG1 3.75Å; L437-V494 HydrophobicContact CD2-CG2 3.52Å; I492-V494 HydrophobicContact CG2-CG2 4.25Å; V494-T496 HydrophobicContact CG1-CG2 4.36Å; V494-T496 PolarHBondContact O-N 3.29Å
495	M	87.2	Confident	85.7	Confident	3 Å²	3	28.2 Å²	28.2	2%	0.015	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	86.4	-179.2	-59.2	-162.2	-53.9	0	0	110.7	I493 Y499 L527 I528 E529 C530 L533 V542	I493-M495 HydrophobicContact CG2-CG 4.16Å; M495-Y499 HydrophobicContact CG-CD1 4.29Å; M495-L527 HydrophobicContact CE-CD1 4.08Å; M495-L527 HydrophobicContact CE-CD2 3.69Å; M495-L527 HydrophobicContact CE-CG 3.72Å; M495-L527 HydrophobicContact CG-CD1 3.7Å; M495-L527 HydrophobicContact CG-CG 4.29Å; M495-L527 HydrophobicContact SD-CD1 3.57Å; M495-L527 VanDerWaalsContact SD-CD1 3.57Å; M495-L527 HydrophobicContact SD-CD2 3.98Å; M495-L527 HydrophobicContact SD-CG 3.92Å; M495-I528 PolarHBondContact N-O 3.43Å; M495-E529 HydrophobicContact CE-CG 3.38Å; M495-C530 PolarHBondContact O-N 2.7Å; M495-L533 HydrophobicContact CB-CD1 3.78Å; M495-L533 HydrophobicContact CE-CD1 3.81Å; M495-V542 HydrophobicContact CE-CG1 3.91Å; M495-V542 HydrophobicContact SD-CG1 3.35Å; M495-V542 WeakPolarHBondContact SD-CG1 3.42Å
496	T	84.9	Confident	85.5	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.006	15%	0.149	C	C	.	.			trans	-78.5	161.2	159.3	77.1	0	0	0	0	109.9	E429 E430 A433 V494 N498 Y499 V500	E429-T496 HydrophobicContact CB-CG2 4.43Å; E430-T496 VanDerWaalsContact OE1-CB 3.25Å; E430-T496 WeakPolarHBondContact OE1-CB 3.49Å; E430-T496 PolarHBondContact OE1-OG1 3.45Å; A433-T496 HydrophobicContact CB-CG2 4.25Å; V494-T496 HydrophobicContact CG1-CG2 4.36Å; V494-T496 PolarHBondContact O-N 3.29Å; T496-N498 PolarHBondContact O-N 2.78Å; T496-N498 PolarHBondContact OG1-N 2.63Å; T496-Y499 WeakPolarHBondContact O-CB 3.42Å; T496-Y499 PolarHBondContact O-N 2.81Å; T496-Y499 VanDerWaalsContact O-N 3.16Å; T496-Y499 PolarHBondContact OG1-N 2.63Å; T496-V500 PolarHBondContact O-N 2.87Å
497	P	81.4	Confident	85.3	Confident	26 Å²	26	29.3 Å²	29.3	17%	0.169	14%	0.144	C	C	.	.	H	α-helix	trans	-52.8	-38.1	171.9	-30.9	38.4	0	0	0	113.4	E429 V500 V501 A531 L533 I536	E429-P497 WeakPolarHBondContact OE2-CD 3.35Å; E429-P497 VanDerWaalsContact OE2-CG 3.26Å; E429-P497 WeakPolarHBondContact OE2-CG 3.34Å; P497-V500 PolarHBondContact O-N 3.15Å; P497-V501 WeakPolarHBondContact O-CG2 3.43Å; P497-V501 PolarHBondContact O-N 3Å; P497-A531 HydrophobicContact CG-CB 4.05Å; P497-L533 HydrophobicContact CG-CD2 4.32Å; P497-I536 HydrophobicContact CB-CD1 3.76Å; P497-I536 HydrophobicContact CG-CD1 4.09Å
498	N	79.2	Confident	85.1	Confident	33 Å²	33	26.9 Å²	26.9	18%	0.176	13%	0.133	C	C	.	.	H	α-helix	trans	-68	-40.4	178.2	-66.4	-52.7	0	0	0	112.4	V417 T426 E430 T496 V500 V501 R502	V417-N498 HydrophobicContact CG2-CB 3.69Å; T426-N498 WeakPolarHBondContact CG2-ND2 3.06Å; E430-N498 WeakPolarHBondContact OE1-CB 3.38Å; E430-N498 PolarHBondContact OE1-ND2 2.92Å; T496-N498 PolarHBondContact O-N 2.78Å; T496-N498 PolarHBondContact OG1-N 2.63Å; N498-V500 PolarHBondContact O-N 2.77Å; N498-V501 PolarHBondContact O-N 3.42Å; N498-R502 WeakPolarHBondContact O-CB 3.36Å; N498-R502 WeakPolarHBondContact O-CG 3.47Å; N498-R502 PolarHBondContact O-N 3.44Å
499	Y	84.6	Confident	84.7	Confident	1 Å²	1	30.3 Å²	30.3	0%	0.004	15%	0.149	C	C	.	.	H	α-helix	trans	-56.3	-37.6	174	-170.9	-90.1	0	0	0	111.2	S413 T415 I493 M495 T496 R503 G504 W505	S413-Y499 PolarHBondContact OG-OH 2.74Å; T415-Y499 HydrophobicContact CG2-CD2 3.68Å; T415-Y499 HydrophobicContact CG2-CE2 4.29Å; T415-Y499 HydrophobicContact CG2-CG 4.38Å; T415-Y499 WeakPolarHBondContact OG1-CA 3.39Å; T415-Y499 PolarHBondContact OG1-N 2.71Å; I493-Y499 HydrophobicContact CG2-CE1 3.63Å; I493-Y499 HydrophobicContact CG2-CE2 4.5Å; I493-Y499 WeakPolarHBondContact CG2-OH 3.3Å; M495-Y499 HydrophobicContact CG-CD1 4.29Å; T496-Y499 WeakPolarHBondContact O-CB 3.42Å; T496-Y499 PolarHBondContact O-N 2.81Å; T496-Y499 VanDerWaalsContact O-N 3.16Å; T496-Y499 PolarHBondContact OG1-N 2.63Å; Y499-R503 PolarHBondContact O-N 3.03Å; Y499-G504 VanDerWaalsContact CZ-C 3.44Å; Y499-G504 PolarHBondContact O-N 3.48Å; Y499-G504 PolarHBondContact OH-O 3.38Å; Y499-W505 HydrophobicContact CD1-CE3 4.44Å; Y499-W505 HydrophobicContact CE1-CB 4.06Å; Y499-W505 HydrophobicContact CE1-CE3 4.25Å; Y499-W505 WeakPolarHBondContact OH-CA 3.43Å; Y499-W505 PolarHBondContact OH-N 2.87Å
500	V	83.1	Confident	84.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-75.3	-47.8	178.3	179.4	0	0	0	0	112.6	T496 P497 N498 R502 R503 W505 L533 I536 V542	T496-V500 PolarHBondContact O-N 2.87Å; P497-V500 PolarHBondContact O-N 3.15Å; N498-V500 PolarHBondContact O-N 2.77Å; V500-R502 VanDerWaalsContact C-N 3.3Å; V500-R502 PolarHBondContact O-N 2.78Å; V500-R503 PolarHBondContact O-N 3.05Å; V500-W505 HydrophobicContact CB-CZ3 4.35Å; V500-W505 HydrophobicContact CG1-CH2 4.48Å; V500-W505 HydrophobicContact CG1-CZ3 4.15Å; V500-W505 HydrophobicContact CG2-CZ3 4.47Å; V500-L533 HydrophobicContact CG2-CD1 4.45Å; V500-L533 HydrophobicContact CG2-CD2 4.2Å; V500-I536 HydrophobicContact CB-CG2 4.42Å; V500-I536 HydrophobicContact CG1-CG2 4.01Å; V500-V542 HydrophobicContact CG1-CG2 4.07Å; V500-V542 HydrophobicContact CG2-CG2 4.22Å
501	V	80.3	Confident	83.9	Confident	88 Å²	88	34.7 Å²	34.7	53%	0.533	18%	0.175	S	C	.	.	H	α-helix	trans	-62.4	-37.1	179.2	171.8	0	0	0	0	111.9	P497 N498 I536	P497-V501 WeakPolarHBondContact O-CG2 3.43Å; P497-V501 PolarHBondContact O-N 3Å; N498-V501 PolarHBondContact O-N 3.42Å; V501-I536 HydrophobicContact CG2-CG2 3.76Å
502	R	79.5	Confident	83.5	Confident	121 Å²	121	38.3 Å²	38.3	46%	0.457	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	3.3	178.9	-62.9	-175.9	177.4	-160.3	-1.9	114.1	K416 N498 V500 G504	K416-R502 PolarHBondContact O-NH1 2.91Å; N498-R502 WeakPolarHBondContact O-CB 3.36Å; N498-R502 WeakPolarHBondContact O-CG 3.47Å; N498-R502 PolarHBondContact O-N 3.44Å; V500-R502 VanDerWaalsContact C-N 3.3Å; V500-R502 PolarHBondContact O-N 2.78Å; R502-G504 VanDerWaalsContact C-N 3.34Å; R502-G504 PolarHBondContact O-N 2.83Å
503	R	82.2	Confident	83.2	Confident	112 Å²	112	44.3 Å²	44.3	42%	0.423	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	49.2	-173.9	-67.6	-176.6	168.3	148.3	-6.7	113.1	Y499 V500 W505 S506 E541	Y499-R503 PolarHBondContact O-N 3.03Å; V500-R503 PolarHBondContact O-N 3.05Å; R503-W505 HydrophobicContact CB-CH2 4.4Å; R503-W505 HydrophobicContact CB-CZ2 4.21Å; R503-W505 HydrophobicContact CG-CH2 3.99Å; R503-W505 HydrophobicContact CG-CZ2 3.84Å; R503-W505 PolarHBondContact O-N 2.8Å; R503-S506 VanDerWaalsContact O-CB 3.28Å; R503-S506 WeakPolarHBondContact O-CB 3.49Å; R503-S506 PolarHBondContact O-N 2.8Å; R503-S506 PolarHBondContact O-OG 2.85Å; R503-E541 IonicContact CZ-OE1 3.99Å; R503-E541 IonicContact CZ-OE2 2.91Å; R503-E541 IonicContact NE-OE1 2.68Å; R503-E541 IonicContact NE-OE2 3.22Å; R503-E541 PolarHBondContact NE-OE2 3.28Å; R503-E541 VanDerWaalsContact NH2-CD 3.34Å; R503-E541 IonicContact NH2-OE1 3.45Å; R503-E541 PolarHBondContact NH2-OE1 2.7Å; R503-E541 IonicContact NH2-OE2 3.97Å; R503-E541 PolarHBondContact NH2-OE2 3.46Å
504	G	80.2	Confident	82.9	Confident	18 Å²	18	44.3 Å²	44.3	19%	0.186	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-57.8	-24	-176.4	0	0	0	0	0	114.6	Y499 R502 S506	Y499-G504 VanDerWaalsContact CZ-C 3.44Å; Y499-G504 PolarHBondContact O-N 3.48Å; Y499-G504 PolarHBondContact OH-O 3.38Å; R502-G504 VanDerWaalsContact C-N 3.34Å; R502-G504 PolarHBondContact O-N 2.83Å; G504-S506 VanDerWaalsContact C-N 3.31Å; G504-S506 PolarHBondContact O-N 2.86Å
505	W	83.6	Confident	82.7	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.008	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-76.1	-13	176.8	69.9	80.5	0	0	0	114.6	Y499 V500 R503 I507 F508 E509 N538 E541 V542 L545	Y499-W505 HydrophobicContact CD1-CE3 4.44Å; Y499-W505 HydrophobicContact CE1-CB 4.06Å; Y499-W505 HydrophobicContact CE1-CE3 4.25Å; Y499-W505 WeakPolarHBondContact OH-CA 3.43Å; Y499-W505 PolarHBondContact OH-N 2.87Å; V500-W505 HydrophobicContact CB-CZ3 4.35Å; V500-W505 HydrophobicContact CG1-CH2 4.48Å; V500-W505 HydrophobicContact CG1-CZ3 4.15Å; V500-W505 HydrophobicContact CG2-CZ3 4.47Å; R503-W505 HydrophobicContact CB-CH2 4.4Å; R503-W505 HydrophobicContact CB-CZ2 4.21Å; R503-W505 HydrophobicContact CG-CH2 3.99Å; R503-W505 HydrophobicContact CG-CZ2 3.84Å; R503-W505 PolarHBondContact O-N 2.8Å; W505-I507 PolarHBondContact O-N 3.24Å; W505-I507 VanDerWaalsContact O-N 3.07Å; W505-F508 HydrophobicContact CB-CD2 4.38Å; W505-F508 WeakPolarHBondContact O-CB 3.47Å; W505-F508 VanDerWaalsContact O-CD2 3.3Å; W505-F508 WeakPolarHBondContact O-CD2 3.31Å; W505-F508 PolarHBondContact O-N 3.13Å; W505-E509 VanDerWaalsContact CD1-OE2 3.31Å; W505-E509 PolarHBondContact NE1-OE1 3.32Å; W505-E509 PolarHBondContact NE1-OE2 3.47Å; W505-N538 HydrophobicContact CH2-CB 4.13Å; W505-E541 HydrophobicContact CH2-CB 4.23Å; W505-E541 HydrophobicContact CZ2-CB 3.61Å; W505-V542 HydrophobicContact CE3-CG2 3.92Å; W505-V542 HydrophobicContact CH2-CG2 3.6Å; W505-V542 HydrophobicContact CZ2-CG2 4.4Å; W505-V542 HydrophobicContact CZ3-CG2 3.29Å; W505-L545 HydrophobicContact CB-CD2 3.6Å; W505-L545 HydrophobicContact CD2-CD2 4.5Å; W505-L545 HydrophobicContact CG-CD2 3.68Å
506	S	81.4	Confident	82.7	Confident	42 Å²	42	52.5 Å²	52.5	29%	0.294	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-58.8	-28.7	-167.6	53	0	0	0	0	113.7	R503 G504 F508 E509 L510	R503-S506 VanDerWaalsContact O-CB 3.28Å; R503-S506 WeakPolarHBondContact O-CB 3.49Å; R503-S506 PolarHBondContact O-N 2.8Å; R503-S506 PolarHBondContact O-OG 2.85Å; G504-S506 VanDerWaalsContact C-N 3.31Å; G504-S506 PolarHBondContact O-N 2.86Å; S506-F508 PolarHBondContact O-N 3.47Å; S506-E509 PolarHBondContact O-N 3.4Å; S506-L510 WeakPolarHBondContact O-CD1 2.99Å; S506-L510 PolarHBondContact O-N 2.83Å
507	I	81.6	Confident	82.8	Confident	35 Å²	35	52.7 Å²	52.7	18%	0.179	26%	0.258	C	S	.	.	H	α-helix	trans	-55.3	-34.4	172.1	-170.6	160.5	0	0	0	113.2	Y477 I478 V481 W505 E509 E511 L514	Y477-I507 HydrophobicContact CE1-CD1 4.41Å; I478-I507 HydrophobicContact CG1-CD1 4.12Å; V481-I507 HydrophobicContact CB-CD1 4.17Å; V481-I507 HydrophobicContact CG1-CD1 3.78Å; V481-I507 HydrophobicContact CG2-CD1 4.39Å; W505-I507 PolarHBondContact O-N 3.24Å; W505-I507 VanDerWaalsContact O-N 3.07Å; I507-E509 VanDerWaalsContact C-N 3.31Å; I507-E509 PolarHBondContact O-N 3.11Å; I507-E511 WeakPolarHBondContact O-CB 3.32Å; I507-E511 PolarHBondContact O-N 2.75Å; I507-L514 HydrophobicContact CG1-CD1 4.07Å
508	F	83.4	Confident	83.1	Confident	1 Å²	1	51.7 Å²	51.7	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-80.3	-8.9	178	-52.1	-73.4	0	0	0	113.9	V485 L491 I493 W505 S506 L514 R515 L518	V485-F508 HydrophobicContact CG2-CE1 4.25Å; L491-F508 HydrophobicContact CD1-CE1 4.1Å; L491-F508 HydrophobicContact CD1-CZ 3.97Å; L491-F508 HydrophobicContact CD2-CD1 4.12Å; L491-F508 HydrophobicContact CD2-CE1 3.75Å; L491-F508 HydrophobicContact CD2-CZ 4.12Å; I493-F508 HydrophobicContact CD1-CD2 4.43Å; I493-F508 HydrophobicContact CD1-CE2 4.22Å; I493-F508 HydrophobicContact CG1-CE2 4.47Å; W505-F508 HydrophobicContact CB-CD2 4.38Å; W505-F508 WeakPolarHBondContact O-CB 3.47Å; W505-F508 VanDerWaalsContact O-CD2 3.3Å; W505-F508 WeakPolarHBondContact O-CD2 3.31Å; W505-F508 PolarHBondContact O-N 3.13Å; S506-F508 PolarHBondContact O-N 3.47Å; F508-L514 HydrophobicContact CD1-CB 4.24Å; F508-L514 HydrophobicContact CD1-CD1 3.84Å; F508-L514 HydrophobicContact CD1-CD2 4.09Å; F508-L514 HydrophobicContact CD1-CG 4.29Å; F508-L514 HydrophobicContact CE1-CD1 4.29Å; F508-L514 HydrophobicContact CE1-CD2 4.32Å; F508-R515 WeakPolarHBondContact O-CA 3.44Å; F508-R515 VanDerWaalsContact O-CB 3.29Å; F508-R515 WeakPolarHBondContact O-CB 3.36Å; F508-R515 PolarHBondContact O-N 3.17Å; F508-L518 HydrophobicContact CB-CD1 3.83Å
509	E	80.8	Confident	83.5	Confident	71 Å²	71	53.6 Å²	53.6	33%	0.332	26%	0.264	S	S	.	.	H	α-helix	trans	-102	-41.2	176.4	-65	179.7	148.8	0	0	111.5	W505 S506 I507 L545	W505-E509 VanDerWaalsContact CD1-OE2 3.31Å; W505-E509 PolarHBondContact NE1-OE1 3.32Å; W505-E509 PolarHBondContact NE1-OE2 3.47Å; S506-E509 PolarHBondContact O-N 3.4Å; I507-E509 VanDerWaalsContact C-N 3.31Å; I507-E509 PolarHBondContact O-N 3.11Å; E509-L545 HydrophobicContact CG-CD1 4.19Å
510	L	79.5	Confident	83.6	Confident	135 Å²	135	55.6 Å²	55.6	71%	0.707	28%	0.278	S	S	*	.	H	α-helix	trans	-71.7	-41.6	178.3	-83.9	83.3	0	0	0	112.3	S506	S506-L510 WeakPolarHBondContact O-CD1 2.99Å; S506-L510 PolarHBondContact O-N 2.83Å
511	E	83.4	Confident	83.6	Confident	36 Å²	36	56.5 Å²	56.5	17%	0.168	29%	0.287	C	S	.	.	S	Bend	trans	-83.1	127.5	179.3	-155.4	-65.5	107.8	0	0	110.6	I478 I507 R513 L514 R515	I478-E511 HydrophobicContact CG2-CB 3.96Å; I478-E511 HydrophobicContact CG2-CG 3.48Å; I478-E511 VanDerWaalsContact CG2-CG 3.48Å; I507-E511 WeakPolarHBondContact O-CB 3.32Å; I507-E511 PolarHBondContact O-N 2.75Å; E511-R513 VanDerWaalsContact CD-N 3.25Å; E511-R513 PolarHBondContact OE1-N 3.36Å; E511-R513 WeakPolarHBondContact OE2-CA 3.5Å; E511-R513 VanDerWaalsContact OE2-CB 3.25Å; E511-R513 WeakPolarHBondContact OE2-CB 3.42Å; E511-R513 PolarHBondContact OE2-N 2.95Å; E511-L514 HydrophobicContact CB-CB 4.34Å; E511-L514 HydrophobicContact CB-CD1 4.06Å; E511-L514 HydrophobicContact CB-CG 4.37Å; E511-L514 PolarHBondContact OE2-N 2.8Å; E511-R515 VanDerWaalsContact O-CB 3.3Å; E511-R515 WeakPolarHBondContact O-CB 3.34Å; E511-R515 PolarHBondContact O-N 2.93Å
512	T	83.4	Confident	83.9	Confident	78 Å²	78	58.6 Å²	58.6	48%	0.479	29%	0.292	S	S	.	.	H	α-helix	trans	-71.5	-36.2	-171.2	62.5	0	0	0	0	115.1	N516	T512-N516 VanDerWaalsContact O-CB 3.23Å; T512-N516 WeakPolarHBondContact O-CB 3.29Å; T512-N516 PolarHBondContact O-N 3.25Å; T512-N516 PolarHBondContact O-ND2 3.42Å; T512-N516 PolarHBondContact O-OD1 2.94Å
513	R	84.9	Confident	84.2	Confident	125 Å²	125	53 Å²	53	47%	0.472	27%	0.271	S	S	.	.	H	α-helix	trans	-72.5	-46.9	178.7	176.8	-174.7	-178.4	166.1	0.4	110.5	D486 E511 N516 M517	D486-R513 IonicContact OD2-CZ 2.69Å; D486-R513 IonicContact OD2-NE 3.75Å; D486-R513 IonicContact OD2-NH2 3.28Å; D486-R513 PolarHBondContact OD2-NH2 2.9Å; E511-R513 VanDerWaalsContact CD-N 3.25Å; E511-R513 PolarHBondContact OE1-N 3.36Å; E511-R513 WeakPolarHBondContact OE2-CA 3.5Å; E511-R513 VanDerWaalsContact OE2-CB 3.25Å; E511-R513 WeakPolarHBondContact OE2-CB 3.42Å; E511-R513 PolarHBondContact OE2-N 2.95Å; R513-N516 PolarHBondContact O-N 2.83Å; R513-M517 HydrophobicContact CG-CE 4.4Å; R513-M517 WeakPolarHBondContact O-CG 3.28Å; R513-M517 PolarHBondContact O-N 3.5Å
514	L	86.4	Confident	84.5	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-52.9	-55	170.4	-72.4	179.8	0	0	0	111	V481 A482 V485 I507 F508 E511 N516 M517 L518	V481-L514 HydrophobicContact CG1-CD1 4.44Å; A482-L514 HydrophobicContact CB-CD2 4.35Å; A482-L514 HydrophobicContact CB-CG 4.12Å; V485-L514 HydrophobicContact CB-CD2 3.71Å; V485-L514 HydrophobicContact CG1-CD2 3.7Å; V485-L514 HydrophobicContact CG2-CD2 3.86Å; I507-L514 HydrophobicContact CG1-CD1 4.07Å; F508-L514 HydrophobicContact CD1-CB 4.24Å; F508-L514 HydrophobicContact CD1-CD1 3.84Å; F508-L514 HydrophobicContact CD1-CD2 4.09Å; F508-L514 HydrophobicContact CD1-CG 4.29Å; F508-L514 HydrophobicContact CE1-CD1 4.29Å; F508-L514 HydrophobicContact CE1-CD2 4.32Å; E511-L514 HydrophobicContact CB-CB 4.34Å; E511-L514 HydrophobicContact CB-CD1 4.06Å; E511-L514 HydrophobicContact CB-CG 4.37Å; E511-L514 PolarHBondContact OE2-N 2.8Å; L514-N516 VanDerWaalsContact C-N 3.3Å; L514-N516 PolarHBondContact O-N 3.34Å; L514-M517 HydrophobicContact CD2-CE 3.76Å; L514-M517 PolarHBondContact O-N 2.92Å; L514-L518 WeakPolarHBondContact O-CG 3.28Å; L514-L518 PolarHBondContact O-N 3.15Å
515	R	85.6	Confident	85.1	Confident	90 Å²	90	49.4 Å²	49.4	34%	0.34	25%	0.253	S	S	.	.	H	α-helix	trans	-59.4	-40.4	179.3	-166.1	-163.8	64.5	-119	-12	112.3	F508 E511 L518 V519	F508-R515 WeakPolarHBondContact O-CA 3.44Å; F508-R515 VanDerWaalsContact O-CB 3.29Å; F508-R515 WeakPolarHBondContact O-CB 3.36Å; F508-R515 PolarHBondContact O-N 3.17Å; E511-R515 VanDerWaalsContact O-CB 3.3Å; E511-R515 WeakPolarHBondContact O-CB 3.34Å; E511-R515 PolarHBondContact O-N 2.93Å; R515-L518 PolarHBondContact O-N 2.6Å; R515-V519 WeakPolarHBondContact O-CG2 3.14Å; R515-V519 PolarHBondContact O-N 3.18Å
516	N	86.7	Confident	85.5	Confident	86 Å²	86	49.3 Å²	49.3	46%	0.46	25%	0.252	S	S	.	.	H	α-helix	trans	-66.4	-42.5	178.4	-71.9	-3.9	0	0	0	111.8	T512 R513 L514 L518 V519 S520	T512-N516 VanDerWaalsContact O-CB 3.23Å; T512-N516 WeakPolarHBondContact O-CB 3.29Å; T512-N516 PolarHBondContact O-N 3.25Å; T512-N516 PolarHBondContact O-ND2 3.42Å; T512-N516 PolarHBondContact O-OD1 2.94Å; R513-N516 PolarHBondContact O-N 2.83Å; L514-N516 VanDerWaalsContact C-N 3.3Å; L514-N516 PolarHBondContact O-N 3.34Å; N516-L518 VanDerWaalsContact C-N 3.26Å; N516-L518 PolarHBondContact O-N 2.93Å; N516-V519 PolarHBondContact O-N 3.43Å; N516-V519 VanDerWaalsContact O-N 3.15Å; N516-S520 WeakPolarHBondContact O-CB 3.47Å; N516-S520 PolarHBondContact O-N 2.82Å; N516-S520 PolarHBondContact O-OG 2.86Å; N516-S520 VanDerWaalsContact O-OG 3.06Å
517	M	86.8	Confident	86	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.025	24%	0.239	C	C	.	.	H	α-helix	trans	-59.4	-34.9	175.7	-72.9	-170.9	-67.3	0	0	112.9	V485 D486 R513 L514 S520 G521 E522 I523	V485-M517 HydrophobicContact CG1-CE 4.04Å; D486-M517 HydrophobicContact CB-SD 4.35Å; R513-M517 HydrophobicContact CG-CE 4.4Å; R513-M517 WeakPolarHBondContact O-CG 3.28Å; R513-M517 PolarHBondContact O-N 3.5Å; L514-M517 HydrophobicContact CD2-CE 3.76Å; L514-M517 PolarHBondContact O-N 2.92Å; M517-S520 WeakPolarHBondContact CA-OG 3.38Å; M517-S520 PolarHBondContact O-OG 2.97Å; M517-G521 PolarHBondContact O-N 3.16Å; M517-E522 HydrophobicContact CB-CB 4.31Å; M517-E522 HydrophobicContact CG-CB 4.28Å; M517-E522 PolarHBondContact O-N 3.1Å; M517-E522 VanDerWaalsContact O-N 3.16Å; M517-I523 HydrophobicContact CB-CG2 4.13Å
518	L	89.1	Confident	86.5	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-68.6	-38.4	175.7	-65.9	-178.8	0	0	0	113	L491 F508 L514 R515 N516 I523 V525 L545 I549 K550	L491-L518 HydrophobicContact CD2-CD2 4.07Å; F508-L518 HydrophobicContact CB-CD1 3.83Å; L514-L518 WeakPolarHBondContact O-CG 3.28Å; L514-L518 PolarHBondContact O-N 3.15Å; R515-L518 PolarHBondContact O-N 2.6Å; N516-L518 VanDerWaalsContact C-N 3.26Å; N516-L518 PolarHBondContact O-N 2.93Å; L518-I523 HydrophobicContact CD2-CG2 4.3Å; L518-V525 HydrophobicContact CD2-CG2 3.49Å; L518-V525 VanDerWaalsContact CD2-CG2 3.49Å; L518-L545 HydrophobicContact CD1-CD1 4.44Å; L518-I549 HydrophobicContact CB-CG1 4.19Å; L518-I549 HydrophobicContact CD1-CG1 4.17Å; L518-I549 HydrophobicContact CD2-CG1 4.2Å; L518-I549 HydrophobicContact CD2-CG2 4.45Å; L518-I549 HydrophobicContact CG-CG1 4.43Å; L518-K550 PolarHBondContact O-N 3Å
519	V	88.1	Confident	86.7	Confident	74 Å²	74	46.1 Å²	46.1	45%	0.448	23%	0.232	S	C	.	.	H	α-helix	trans	-81.8	-38.5	-177.8	173.9	0	0	0	0	111.8	R515 N516 G521 T548 K550	R515-V519 WeakPolarHBondContact O-CG2 3.14Å; R515-V519 PolarHBondContact O-N 3.18Å; N516-V519 PolarHBondContact O-N 3.43Å; N516-V519 VanDerWaalsContact O-N 3.15Å; V519-G521 VanDerWaalsContact C-N 3.3Å; V519-T548 HydrophobicContact CG2-CG2 3.6Å; V519-K550 WeakPolarHBondContact O-CB 3.25Å; V519-K550 WeakPolarHBondContact O-CD 3.31Å
520	S	86.6	Confident	86.7	Confident	42 Å²	42	43 Å²	43	29%	0.294	22%	0.219	S	C	.	.	H	α-helix	trans	-71.2	-28.5	174.6	67.6	0	0	0	0	112.1	N516 M517 E522 K550	N516-S520 WeakPolarHBondContact O-CB 3.47Å; N516-S520 PolarHBondContact O-N 2.82Å; N516-S520 PolarHBondContact O-OG 2.86Å; N516-S520 VanDerWaalsContact O-OG 3.06Å; M517-S520 WeakPolarHBondContact CA-OG 3.38Å; M517-S520 PolarHBondContact O-OG 2.97Å; S520-E522 WeakPolarHBondContact CB-OE1 3.33Å; S520-E522 VanDerWaalsContact OG-CG 3.28Å; S520-E522 WeakPolarHBondContact OG-CG 3.45Å; S520-E522 PolarHBondContact OG-N 3.14Å; S520-E522 PolarHBondContact OG-OE1 2.95Å; S520-K550 WeakPolarHBondContact O-CD 3.08Å; S520-K550 WeakPolarHBondContact O-CE 3.46Å; S520-K550 PolarHBondContact O-NZ 3.37Å
521	G	83.1	Confident	86.4	Confident	19 Å²	19	38 Å²	38	20%	0.196	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	12.4	-178.3	0	0	0	0	0	114.3	M517 V519 I523 T551	M517-G521 PolarHBondContact O-N 3.16Å; V519-G521 VanDerWaalsContact C-N 3.3Å; G521-I523 PolarHBondContact O-N 3.25Å; G521-T551 WeakPolarHBondContact CA-OG1 3.42Å; G521-T551 PolarHBondContact O-OG1 3.01Å
522	E	85.1	Confident	85.8	Confident	133 Å²	133	43.4 Å²	43.4	62%	0.621	22%	0.222	S	C	*	.	S	Bend	trans	-55.3	-30	178.1	-78.6	157.5	-119.8	0	0	113.3	M517 S520	M517-E522 HydrophobicContact CB-CB 4.31Å; M517-E522 HydrophobicContact CG-CB 4.28Å; M517-E522 PolarHBondContact O-N 3.1Å; M517-E522 VanDerWaalsContact O-N 3.16Å; S520-E522 WeakPolarHBondContact CB-OE1 3.33Å; S520-E522 VanDerWaalsContact OG-CG 3.28Å; S520-E522 WeakPolarHBondContact OG-CG 3.45Å; S520-E522 PolarHBondContact OG-N 3.14Å; S520-E522 PolarHBondContact OG-OE1 2.95Å
523	I	85.9	Confident	85	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.015	20%	0.2	C	C	.	.	S	Bend	trans	-120.1	125.8	171.8	-165.6	162.6	0	0	0	110.8	V485 L491 M517 L518 G521 T551	V485-I523 HydrophobicContact CG1-CD1 3.78Å; V485-I523 WeakPolarHBondContact O-CD1 3.47Å; L491-I523 HydrophobicContact CB-CD1 3.87Å; L491-I523 HydrophobicContact CB-CG1 4.12Å; M517-I523 HydrophobicContact CB-CG2 4.13Å; L518-I523 HydrophobicContact CD2-CG2 4.3Å; G521-I523 PolarHBondContact O-N 3.25Å; I523-T551 PolarHBondContact O-OG1 3.02Å
524	K	89.8	Confident	83.9	Confident	54 Å²	54	42.3 Å²	42.3	24%	0.235	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	129.5	174.6	179.9	-175.2	177	-171.6	0	109.9	R490 L491 T551 E576	R490-K524 WeakPolarHBondContact CA-O 3.44Å; L491-K524 PolarHBondContact N-O 2.84Å; L491-K524 VanDerWaalsContact N-O 3.09Å; K524-T551 WeakPolarHBondContact CG-O 3.45Å; K524-E576 WeakPolarHBondContact CE-OE2 3.36Å; K524-E576 PolarHBondContact NZ-O 3.46Å; K524-E576 IonicContact NZ-OE2 3.62Å; K524-E576 PolarHBondContact NZ-OE2 3.38Å
525	V	91.2	Very high	82.7	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	134.7	-175.5	-172	0	0	0	0	111.3	L491 I493 L518 I549 T551 L552 T553	L491-V525 HydrophobicContact CB-CG2 4.4Å; L491-V525 HydrophobicContact CD2-CG2 4.36Å; L491-V525 HydrophobicContact CG-CG1 4.49Å; L491-V525 CarbonylContact O-C 3.57Å; L491-V525 WeakPolarHBondContact O-CA 3.06Å; I493-V525 HydrophobicContact CD1-CG1 4.02Å; I493-V525 HydrophobicContact CG1-CG1 4.45Å; L518-V525 HydrophobicContact CD2-CG2 3.49Å; L518-V525 VanDerWaalsContact CD2-CG2 3.49Å; V525-I549 HydrophobicContact CB-CG2 3.91Å; V525-I549 HydrophobicContact CG1-CD1 4.36Å; V525-I549 HydrophobicContact CG2-CD1 4.5Å; V525-I549 HydrophobicContact CG2-CG2 3.53Å; V525-T551 PolarHBondContact N-O 3.21Å; V525-L552 HydrophobicContact CB-CD1 4.17Å; V525-L552 HydrophobicContact CG1-CD1 4.11Å; V525-T553 PolarHBondContact O-N 3.2Å; V525-T553 PolarHBondContact O-OG1 3.4Å
526	I	93.4	Very high	82	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	108.2	174	-59.2	168	0	0	0	107.5	R490 L491 I492 I493 I528 I555 L573 E576 M577	R490-I526 HydrophobicContact CB-CD1 4.43Å; R490-I526 HydrophobicContact CG-CD1 4.34Å; L491-I526 PolarHBondContact O-N 2.87Å; I492-I526 WeakPolarHBondContact CA-O 3.34Å; I492-I526 HydrophobicContact CG1-CB 4.25Å; I492-I526 HydrophobicContact CG1-CD1 4.37Å; I493-I526 PolarHBondContact N-O 3.15Å; I526-I528 HydrophobicContact CG2-CG1 4.25Å; I526-I555 HydrophobicContact CG2-CD1 3.82Å; I526-I555 HydrophobicContact CG2-CG1 4.38Å; I526-L573 HydrophobicContact CD1-CD1 4.36Å; I526-L573 HydrophobicContact CG2-CD1 3.67Å; I526-E576 HydrophobicContact CD1-CB 4Å; I526-E576 HydrophobicContact CG1-CB 4.12Å; I526-M577 HydrophobicContact CD1-CG 4.14Å; I526-M577 HydrophobicContact CD1-SD 3.73Å
527	L	91.1	Very high	80.7	Confident	4 Å²	4	46.7 Å²	46.7	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	113.1	-175.4	-168.8	67.3	0	0	0	109.5	I493 M495 K546 L552 T553 V554 I555	I493-L527 HydrophobicContact CB-CD1 3.62Å; I493-L527 HydrophobicContact CD1-CD1 4.45Å; I493-L527 HydrophobicContact CG2-CD1 3.6Å; M495-L527 HydrophobicContact CE-CD1 4.08Å; M495-L527 HydrophobicContact CE-CD2 3.69Å; M495-L527 HydrophobicContact CE-CG 3.72Å; M495-L527 HydrophobicContact CG-CD1 3.7Å; M495-L527 HydrophobicContact CG-CG 4.29Å; M495-L527 HydrophobicContact SD-CD1 3.57Å; M495-L527 VanDerWaalsContact SD-CD1 3.57Å; M495-L527 HydrophobicContact SD-CD2 3.98Å; M495-L527 HydrophobicContact SD-CG 3.92Å; L527-K546 HydrophobicContact CD2-CD 3.79Å; L527-K546 HydrophobicContact CD2-CG 3.58Å; L527-L552 HydrophobicContact CB-CD1 3.78Å; L527-L552 HydrophobicContact CD2-CD1 4.15Å; L527-T553 PolarHBondContact N-O 3.26Å; L527-V554 HydrophobicContact CB-CG2 4.41Å; L527-V554 HydrophobicContact CD2-CG2 4.3Å; L527-V554 WeakPolarHBondContact O-CA 3.4Å; L527-I555 PolarHBondContact O-N 3.46Å
528	I	91.4	Very high	79.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	108.9	-175.3	-55.5	178.3	0	0	0	109.5	F432 L437 I492 I493 M495 I526 I555 W557 F569 L573	F432-I528 HydrophobicContact CE1-CG2 3.97Å; F432-I528 HydrophobicContact CZ-CG2 4.42Å; L437-I528 HydrophobicContact CD1-CD1 4.16Å; L437-I528 HydrophobicContact CD2-CD1 3.76Å; I492-I528 HydrophobicContact CG2-CD1 3.77Å; I492-I528 HydrophobicContact CG2-CG1 4.33Å; I493-I528 PolarHBondContact O-N 3.38Å; M495-I528 PolarHBondContact N-O 3.43Å; I526-I528 HydrophobicContact CG2-CG1 4.25Å; I528-I555 WeakPolarHBondContact CA-O 3.43Å; I528-W557 HydrophobicContact CG2-CB 4.28Å; I528-F569 HydrophobicContact CD1-CZ 4.42Å; I528-F569 HydrophobicContact CG2-CE2 4.01Å; I528-F569 HydrophobicContact CG2-CZ 4.11Å; I528-L573 HydrophobicContact CD1-CD1 4.43Å
529	E	88.9	Confident	79.3	Confident	8 Å²	8	50.2 Å²	50.2	4%	0.037	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	115.9	175.4	-73.7	176.9	175.8	0	0	109.4	M495 L533 K546 V554 I555 K556 W557	M495-E529 HydrophobicContact CE-CG 3.38Å; E529-L533 HydrophobicContact CG-CD1 4.26Å; E529-K546 IonicContact OE1-NZ 2.82Å; E529-K546 PolarHBondContact OE1-NZ 3.16Å; E529-V554 HydrophobicContact CG-CG1 4.04Å; E529-I555 PolarHBondContact N-O 2.76Å; E529-K556 HydrophobicContact CB-CG 4.24Å; E529-K556 WeakPolarHBondContact OE2-CE 3.31Å; E529-K556 WeakPolarHBondContact OE2-CG 3.12Å; E529-K556 IonicContact OE2-NZ 2.94Å; E529-K556 PolarHBondContact OE2-NZ 2.82Å; E529-W557 PolarHBondContact O-N 2.84Å
530	C	81.2	Confident	78.9	Confident	6 Å²	6	55 Å²	55	4%	0.041	29%	0.289	C	S	.	.			trans	-90.2	-40.6	-177.7	-60.5	0	0	0	0	113.4	E429 M495 W557	E429-C530 HydrophobicContact CB-CB 4.22Å; E429-C530 HydrophobicContact CG-CB 4.03Å; M495-C530 PolarHBondContact O-N 2.7Å; C530-W557 HydrophobicContact CB-CE3 4.15Å
531	A	72.6	Confident	78.6	Confident	30 Å²	30	56 Å²	56	25%	0.248	29%	0.289	C	S	.	.	S	Bend	trans	-109	174.2	-179.2	0	0	0	0	0	112.9	E429 P497 L533	E429-A531 WeakPolarHBondContact OE1-CA 3.46Å; E429-A531 WeakPolarHBondContact OE1-CB 3.4Å; E429-A531 PolarHBondContact OE1-N 2.97Å; P497-A531 HydrophobicContact CG-CB 4.05Å; A531-L533 HydrophobicContact CB-CD2 3.89Å; A531-L533 HydrophobicContact CB-CG 4.2Å; A531-L533 PolarHBondContact O-N 2.93Å
532	E	70.4	Confident	78.6	Confident	149 Å²	149	55.1 Å²	55.1	70%	0.696	28%	0.28	S	S	*	.			trans	-78	74.1	156.6	-175.4	144.6	-141.4	0	0	110	R534	E532-R534 HydrophobicContact CG-CB 4.26Å; E532-R534 HydrophobicContact CG-CG 4.36Å; E532-R534 PolarHBondContact O-N 2.6Å; E532-R534 WeakPolarHBondContact OE1-CD 3.15Å; E532-R534 IonicContact OE1-CZ 2.96Å; E532-R534 IonicContact OE1-NE 3.08Å; E532-R534 IonicContact OE1-NH1 2.68Å; E532-R534 PolarHBondContact OE1-NH1 2.7Å
533	L	67.8	Low	78.5	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-58.7	-4.9	-174.1	-60.6	166.3	0	0	0	115.5	M495 P497 V500 E529 A531 G535 I536 Y539	M495-L533 HydrophobicContact CB-CD1 3.78Å; M495-L533 HydrophobicContact CE-CD1 3.81Å; P497-L533 HydrophobicContact CG-CD2 4.32Å; V500-L533 HydrophobicContact CG2-CD1 4.45Å; V500-L533 HydrophobicContact CG2-CD2 4.2Å; E529-L533 HydrophobicContact CG-CD1 4.26Å; A531-L533 HydrophobicContact CB-CD2 3.89Å; A531-L533 HydrophobicContact CB-CG 4.2Å; A531-L533 PolarHBondContact O-N 2.93Å; L533-G535 PolarHBondContact O-N 3.32Å; L533-G535 VanDerWaalsContact O-N 3.1Å; L533-I536 HydrophobicContact CB-CD1 4.27Å; L533-I536 HydrophobicContact CD2-CD1 3.57Å; L533-I536 PolarHBondContact O-N 2.85Å; L533-I536 VanDerWaalsContact O-N 3.12Å; L533-Y539 HydrophobicContact CB-CD2 3.59Å; L533-Y539 HydrophobicContact CB-CE2 3.5Å; L533-Y539 VanDerWaalsContact CB-CE2 3.5Å; L533-Y539 HydrophobicContact CD1-CE2 4.32Å; L533-Y539 VanDerWaalsContact O-CD2 3.32Å; L533-Y539 WeakPolarHBondContact O-CD2 3.18Å
534	R	61.4	Low	78.4	Confident	176 Å²	176	54.2 Å²	54.2	66%	0.664	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-61.9	-17.1	-173.3	-74.4	174.2	164.8	167.9	-16.6	115.5	E532 Y539	E532-R534 HydrophobicContact CG-CB 4.26Å; E532-R534 HydrophobicContact CG-CG 4.36Å; E532-R534 PolarHBondContact O-N 2.6Å; E532-R534 WeakPolarHBondContact OE1-CD 3.15Å; E532-R534 IonicContact OE1-CZ 2.96Å; E532-R534 IonicContact OE1-NE 3.08Å; E532-R534 IonicContact OE1-NH1 2.68Å; E532-R534 PolarHBondContact OE1-NH1 2.7Å; R534-Y539 HydrophobicContact CG-CE1 4.38Å
535	G	60.7	Low	78.1	Confident	80 Å²	80	52.2 Å²	52.2	83%	0.825	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-98.3	-0.6	177.8	0	0	0	0	0	115.1	L533	L533-G535 PolarHBondContact O-N 3.32Å; L533-G535 VanDerWaalsContact O-N 3.1Å
536	I	69.9	Low	77.9	Confident	42 Å²	42	53.2 Å²	53.2	22%	0.215	28%	0.281	C	S	.	.	S	Bend	trans	-91.9	143.1	-171.2	-55	174.7	0	0	0	110.3	P497 V500 V501 L533 Y539	P497-I536 HydrophobicContact CB-CD1 3.76Å; P497-I536 HydrophobicContact CG-CD1 4.09Å; V500-I536 HydrophobicContact CB-CG2 4.42Å; V500-I536 HydrophobicContact CG1-CG2 4.01Å; V501-I536 HydrophobicContact CG2-CG2 3.76Å; L533-I536 HydrophobicContact CB-CD1 4.27Å; L533-I536 HydrophobicContact CD2-CD1 3.57Å; L533-I536 PolarHBondContact O-N 2.85Å; L533-I536 VanDerWaalsContact O-N 3.12Å; I536-Y539 WeakPolarHBondContact O-CB 3.25Å; I536-Y539 PolarHBondContact O-N 2.73Å
537	M	60.8	Low	77.5	Confident	148 Å²	148	61.1 Å²	61.1	73%	0.729	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	149.2	172.6	-59.3	-155.3	-52.5	0	0	110.9	Y539	M537-Y539 PolarHBondContact O-N 2.86Å
538	N	69.3	Low	77.2	Confident	51 Å²	51	63.9 Å²	63.9	27%	0.273	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	3.7	-177.7	-48.4	-17	0	0	0	116.1	W505 Q540 E541 V542	W505-N538 HydrophobicContact CH2-CB 4.13Å; N538-Q540 PolarHBondContact O-N 2.93Å; N538-Q540 VanDerWaalsContact O-N 3.09Å; N538-E541 WeakPolarHBondContact CB-OE2 3.22Å; N538-E541 WeakPolarHBondContact O-CB 3.4Å; N538-E541 PolarHBondContact O-N 2.04Å; N538-V542 PolarHBondContact O-N 3.46Å
539	Y	77.6	Confident	77	Confident	31 Å²	31	64.4 Å²	64.4	12%	0.122	34%	0.337	C	S	.	.	H	α-helix	trans	-57.9	-26.3	176.7	-172.8	-96.4	0	0	0	114.1	L533 R534 I536 M537 E541 V542 E543 K546	L533-Y539 HydrophobicContact CB-CD2 3.59Å; L533-Y539 HydrophobicContact CB-CE2 3.5Å; L533-Y539 VanDerWaalsContact CB-CE2 3.5Å; L533-Y539 HydrophobicContact CD1-CE2 4.32Å; L533-Y539 VanDerWaalsContact O-CD2 3.32Å; L533-Y539 WeakPolarHBondContact O-CD2 3.18Å; R534-Y539 HydrophobicContact CG-CE1 4.38Å; I536-Y539 WeakPolarHBondContact O-CB 3.25Å; I536-Y539 PolarHBondContact O-N 2.73Å; M537-Y539 PolarHBondContact O-N 2.86Å; Y539-E541 VanDerWaalsContact C-N 3.31Å; Y539-E541 PolarHBondContact O-N 3.2Å; Y539-V542 WeakPolarHBondContact O-CB 3.46Å; Y539-V542 PolarHBondContact O-N 3.5Å; Y539-E543 HydrophobicContact CD1-CG 4.12Å; Y539-E543 HydrophobicContact CE1-CG 3.53Å; Y539-E543 VanDerWaalsContact CE1-OE1 3.24Å; Y539-E543 WeakPolarHBondContact CE1-OE1 3.17Å; Y539-E543 PolarHBondContact O-N 2.93Å; Y539-E543 VanDerWaalsContact O-N 3.13Å; Y539-E543 PolarHBondContact OH-OE1 3.31Å; Y539-K546 PolarHBondContact OH-NZ 3.23Å
540	Q	78.7	Confident	76.9	Confident	174 Å²	174	71 Å²	71	81%	0.813	37%	0.366	S	S	*	.	H	α-helix	trans	-66	-31.4	174.1	-69.2	-177.1	-22.4	0	0	113.1	N538 E543 A544	N538-Q540 PolarHBondContact O-N 2.93Å; N538-Q540 VanDerWaalsContact O-N 3.09Å; Q540-E543 PolarHBondContact O-N 2.94Å; Q540-A544 PolarHBondContact O-N 2.91Å; Q540-A544 VanDerWaalsContact O-N 3.11Å
541	E	81	Confident	77.2	Confident	64 Å²	64	72.9 Å²	72.9	30%	0.299	38%	0.377	S	S	.	.	H	α-helix	trans	-69.9	-38.1	175.1	-58.8	172.9	174.9	0	0	109.8	R503 W505 N538 Y539 E543 A544 L545	R503-E541 IonicContact CZ-OE1 3.99Å; R503-E541 IonicContact CZ-OE2 2.91Å; R503-E541 IonicContact NE-OE1 2.68Å; R503-E541 IonicContact NE-OE2 3.22Å; R503-E541 PolarHBondContact NE-OE2 3.28Å; R503-E541 VanDerWaalsContact NH2-CD 3.34Å; R503-E541 IonicContact NH2-OE1 3.45Å; R503-E541 PolarHBondContact NH2-OE1 2.7Å; R503-E541 IonicContact NH2-OE2 3.97Å; R503-E541 PolarHBondContact NH2-OE2 3.46Å; W505-E541 HydrophobicContact CH2-CB 4.23Å; W505-E541 HydrophobicContact CZ2-CB 3.61Å; N538-E541 WeakPolarHBondContact CB-OE2 3.22Å; N538-E541 WeakPolarHBondContact O-CB 3.4Å; N538-E541 PolarHBondContact O-N 2.04Å; Y539-E541 VanDerWaalsContact C-N 3.31Å; Y539-E541 PolarHBondContact O-N 3.2Å; E541-E543 PolarHBondContact O-N 3.06Å; E541-A544 WeakPolarHBondContact O-CB 3.41Å; E541-A544 PolarHBondContact O-N 2.85Å; E541-L545 PolarHBondContact O-N 3.35Å
542	V	82.5	Confident	78	Confident	1 Å²	1	73.6 Å²	73.6	1%	0.006	38%	0.377	C	S	.	.	H	α-helix	trans	-61.1	-44.2	173.5	-174.6	0	0	0	0	112	M495 V500 W505 N538 Y539 L545 K546	M495-V542 HydrophobicContact CE-CG1 3.91Å; M495-V542 HydrophobicContact SD-CG1 3.35Å; M495-V542 WeakPolarHBondContact SD-CG1 3.42Å; V500-V542 HydrophobicContact CG1-CG2 4.07Å; V500-V542 HydrophobicContact CG2-CG2 4.22Å; W505-V542 HydrophobicContact CE3-CG2 3.92Å; W505-V542 HydrophobicContact CH2-CG2 3.6Å; W505-V542 HydrophobicContact CZ2-CG2 4.4Å; W505-V542 HydrophobicContact CZ3-CG2 3.29Å; N538-V542 PolarHBondContact O-N 3.46Å; Y539-V542 WeakPolarHBondContact O-CB 3.46Å; Y539-V542 PolarHBondContact O-N 3.5Å; V542-L545 PolarHBondContact O-N 3.06Å; V542-K546 WeakPolarHBondContact O-CG 2.87Å; V542-K546 PolarHBondContact O-N 2.87Å
543	E	82.8	Confident	78.9	Confident	64 Å²	64	67.7 Å²	67.7	30%	0.299	35%	0.351	S	S	.	.	H	α-helix	trans	-67.3	-34.9	176	-67.4	-67.8	178.6	0	0	112.1	Y539 Q540 E541 K546 H547	Y539-E543 HydrophobicContact CD1-CG 4.12Å; Y539-E543 HydrophobicContact CE1-CG 3.53Å; Y539-E543 VanDerWaalsContact CE1-OE1 3.24Å; Y539-E543 WeakPolarHBondContact CE1-OE1 3.17Å; Y539-E543 PolarHBondContact O-N 2.93Å; Y539-E543 VanDerWaalsContact O-N 3.13Å; Y539-E543 PolarHBondContact OH-OE1 3.31Å; Q540-E543 PolarHBondContact O-N 2.94Å; E541-E543 PolarHBondContact O-N 3.06Å; E543-K546 PolarHBondContact O-N 2.05Å; E543-K546 IonicContact OE1-NZ 3.55Å; E543-K546 PolarHBondContact OE1-NZ 3.46Å; E543-K546 VanDerWaalsContact OE2-CD 3.29Å; E543-K546 WeakPolarHBondContact OE2-CD 3.27Å; E543-K546 WeakPolarHBondContact OE2-CE 3.03Å; E543-K546 IonicContact OE2-NZ 2.9Å; E543-K546 PolarHBondContact OE2-NZ 2.88Å; E543-H547 PolarHBondContact O-CD2 3.25Å; E543-H547 PolarHBondContact O-N 3.23Å
544	A	83.1	Confident	79.9	Confident	53 Å²	53	70.6 Å²	70.6	44%	0.438	37%	0.369	S	S	.	.	H	α-helix	trans	-63.4	-40.3	172.3	0	0	0	0	0	112.2	Q540 E541 H547 T548	Q540-A544 PolarHBondContact O-N 2.91Å; Q540-A544 VanDerWaalsContact O-N 3.11Å; E541-A544 WeakPolarHBondContact O-CB 3.41Å; E541-A544 PolarHBondContact O-N 2.85Å; A544-H547 PolarHBondContact O-N 2.88Å; A544-T548 PolarHBondContact O-N 2.87Å; A544-T548 VanDerWaalsContact O-N 3.11Å; A544-T548 PolarHBondContact O-OG1 2.86Å
545	L	84.1	Confident	81.3	Confident	11 Å²	11	62.7 Å²	62.7	6%	0.058	34%	0.339	C	S	.	.	H	α-helix	trans	-62.9	-44.2	171.7	-179.4	66.9	0	0	0	111.2	W505 E509 L518 E541 V542 H547 T548 I549	W505-L545 HydrophobicContact CB-CD2 3.6Å; W505-L545 HydrophobicContact CD2-CD2 4.5Å; W505-L545 HydrophobicContact CG-CD2 3.68Å; E509-L545 HydrophobicContact CG-CD1 4.19Å; L518-L545 HydrophobicContact CD1-CD1 4.44Å; E541-L545 PolarHBondContact O-N 3.35Å; V542-L545 PolarHBondContact O-N 3.06Å; L545-H547 VanDerWaalsContact C-N 3.25Å; L545-H547 PolarHBondContact O-N 3Å; L545-T548 WeakPolarHBondContact O-CA 3.2Å; L545-T548 WeakPolarHBondContact O-CB 3.37Å; L545-T548 PolarHBondContact O-N 3.09Å; L545-I549 HydrophobicContact CD1-CD1 4.29Å; L545-I549 HydrophobicContact CD1-CG1 4.4Å; L545-I549 HydrophobicContact CG-CD1 3.99Å; L545-I549 WeakPolarHBondContact O-CG1 3.45Å; L545-I549 PolarHBondContact O-N 3.4Å; L545-I549 VanDerWaalsContact O-N 3.14Å
546	K	86.1	Confident	82.6	Confident	22 Å²	22	64 Å²	64	10%	0.096	32%	0.323	C	S	.	.	H	α-helix	trans	-58	-37.1	175.8	-71.5	-174.1	-133.8	170.9	0	112.5	L527 E529 Y539 V542 E543 T548 L552 V554	L527-K546 HydrophobicContact CD2-CD 3.79Å; L527-K546 HydrophobicContact CD2-CG 3.58Å; E529-K546 IonicContact OE1-NZ 2.82Å; E529-K546 PolarHBondContact OE1-NZ 3.16Å; Y539-K546 PolarHBondContact OH-NZ 3.23Å; V542-K546 WeakPolarHBondContact O-CG 2.87Å; V542-K546 PolarHBondContact O-N 2.87Å; E543-K546 PolarHBondContact O-N 2.05Å; E543-K546 IonicContact OE1-NZ 3.55Å; E543-K546 PolarHBondContact OE1-NZ 3.46Å; E543-K546 VanDerWaalsContact OE2-CD 3.29Å; E543-K546 WeakPolarHBondContact OE2-CD 3.27Å; E543-K546 WeakPolarHBondContact OE2-CE 3.03Å; E543-K546 IonicContact OE2-NZ 2.9Å; E543-K546 PolarHBondContact OE2-NZ 2.88Å; K546-T548 VanDerWaalsContact C-N 3.32Å; K546-L552 HydrophobicContact CB-CD2 3.64Å; K546-L552 HydrophobicContact CD-CD2 4.41Å; K546-L552 HydrophobicContact CG-CD2 3.8Å; K546-L552 WeakPolarHBondContact O-CD2 3.43Å; K546-V554 HydrophobicContact CD-CG2 4.41Å
547	H	85.2	Confident	83.5	Confident	165 Å²	165	62.6 Å²	62.6	76%	0.764	31%	0.314	S	S	*	.	H	α-helix	trans	-74.3	-19.9	174.7	-72.5	-57	0	0	0	114.2	E543 A544 L545	E543-H547 PolarHBondContact O-CD2 3.25Å; E543-H547 PolarHBondContact O-N 3.23Å; A544-H547 PolarHBondContact O-N 2.88Å; L545-H547 VanDerWaalsContact C-N 3.25Å; L545-H547 PolarHBondContact O-N 3Å
548	T	84.7	Confident	84.6	Confident	63 Å²	63	64.8 Å²	64.8	39%	0.387	31%	0.314	S	S	.	.	H	α-helix	trans	-83.1	-28.7	178.2	-58.8	0	0	0	0	112.4	V519 A544 L545 K546 K550	V519-T548 HydrophobicContact CG2-CG2 3.6Å; A544-T548 PolarHBondContact O-N 2.87Å; A544-T548 VanDerWaalsContact O-N 3.11Å; A544-T548 PolarHBondContact O-OG1 2.86Å; L545-T548 WeakPolarHBondContact O-CA 3.2Å; L545-T548 WeakPolarHBondContact O-CB 3.37Å; L545-T548 PolarHBondContact O-N 3.09Å; K546-T548 VanDerWaalsContact C-N 3.32Å; T548-K550 PolarHBondContact O-N 2.96Å
549	I	87.7	Confident	85.1	Confident	10 Å²	10	63.2 Å²	63.2	5%	0.051	31%	0.31	C	S	.	.			trans	-82.1	115.1	-178	-59.8	164.8	0	0	0	110.9	L518 V525 L545 L552	L518-I549 HydrophobicContact CB-CG1 4.19Å; L518-I549 HydrophobicContact CD1-CG1 4.17Å; L518-I549 HydrophobicContact CD2-CG1 4.2Å; L518-I549 HydrophobicContact CD2-CG2 4.45Å; L518-I549 HydrophobicContact CG-CG1 4.43Å; V525-I549 HydrophobicContact CB-CG2 3.91Å; V525-I549 HydrophobicContact CG1-CD1 4.36Å; V525-I549 HydrophobicContact CG2-CD1 4.5Å; V525-I549 HydrophobicContact CG2-CG2 3.53Å; L545-I549 HydrophobicContact CD1-CD1 4.29Å; L545-I549 HydrophobicContact CD1-CG1 4.4Å; L545-I549 HydrophobicContact CG-CD1 3.99Å; L545-I549 WeakPolarHBondContact O-CG1 3.45Å; L545-I549 PolarHBondContact O-N 3.4Å; L545-I549 VanDerWaalsContact O-N 3.14Å; I549-L552 HydrophobicContact CB-CB 4.1Å; I549-L552 HydrophobicContact CD1-CD1 4.17Å; I549-L552 HydrophobicContact CG2-CB 3.78Å; I549-L552 HydrophobicContact CG2-CD1 4.28Å
550	K	87.4	Confident	85.2	Confident	146 Å²	146	64.7 Å²	64.7	64%	0.635	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-33.2	-175.2	178	177.1	161.8	-164	0	114.2	L518 V519 S520 T548	L518-K550 PolarHBondContact O-N 3Å; V519-K550 WeakPolarHBondContact O-CB 3.25Å; V519-K550 WeakPolarHBondContact O-CD 3.31Å; S520-K550 WeakPolarHBondContact O-CD 3.08Å; S520-K550 WeakPolarHBondContact O-CE 3.46Å; S520-K550 PolarHBondContact O-NZ 3.37Å; T548-K550 PolarHBondContact O-N 2.96Å
551	T	87.3	Confident	85.2	Confident	46 Å²	46	65.3 Å²	65.3	28%	0.282	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	45.9	-175.6	44	0	0	0	0	111.7	G521 I523 K524 V525	G521-T551 WeakPolarHBondContact CA-OG1 3.42Å; G521-T551 PolarHBondContact O-OG1 3.01Å; I523-T551 PolarHBondContact O-OG1 3.02Å; K524-T551 WeakPolarHBondContact CG-O 3.45Å; V525-T551 PolarHBondContact N-O 3.21Å
552	L	89.9	Confident	85.3	Confident	45 Å²	45	62.9 Å²	62.9	24%	0.236	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	139.6	-177.8	-176.6	63.8	0	0	0	113.1	V525 L527 K546 I549 V554	V525-L552 HydrophobicContact CB-CD1 4.17Å; V525-L552 HydrophobicContact CG1-CD1 4.11Å; L527-L552 HydrophobicContact CB-CD1 3.78Å; L527-L552 HydrophobicContact CD2-CD1 4.15Å; K546-L552 HydrophobicContact CB-CD2 3.64Å; K546-L552 HydrophobicContact CD-CD2 4.41Å; K546-L552 HydrophobicContact CG-CD2 3.8Å; K546-L552 WeakPolarHBondContact O-CD2 3.43Å; I549-L552 HydrophobicContact CB-CB 4.1Å; I549-L552 HydrophobicContact CD1-CD1 4.17Å; I549-L552 HydrophobicContact CG2-CB 3.78Å; I549-L552 HydrophobicContact CG2-CD1 4.28Å; L552-V554 HydrophobicContact CD1-CG2 4.36Å; L552-V554 HydrophobicContact CD2-CG2 3.84Å; L552-V554 HydrophobicContact CG-CG2 3.92Å
553	T	89.5	Confident	85.3	Confident	25 Å²	25	64.6 Å²	64.6	15%	0.153	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	129.7	165.5	55	0	0	0	0	109.3	V525 L527 E576	V525-T553 PolarHBondContact O-N 3.2Å; V525-T553 PolarHBondContact O-OG1 3.4Å; L527-T553 PolarHBondContact N-O 3.26Å; T553-E576 HydrophobicContact CG2-CG 4.16Å
554	V	88.8	Confident	85.3	Confident	66 Å²	66	69.4 Å²	69.4	40%	0.4	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	120.9	-176.1	-173.4	0	0	0	0	110	L527 E529 K546 L552	L527-V554 HydrophobicContact CB-CG2 4.41Å; L527-V554 HydrophobicContact CD2-CG2 4.3Å; L527-V554 WeakPolarHBondContact O-CA 3.4Å; E529-V554 HydrophobicContact CG-CG1 4.04Å; K546-V554 HydrophobicContact CD-CG2 4.41Å; L552-V554 HydrophobicContact CD1-CG2 4.36Å; L552-V554 HydrophobicContact CD2-CG2 3.84Å; L552-V554 HydrophobicContact CG-CG2 3.92Å
555	I	89.9	Confident	85.2	Confident	9 Å²	9	70.2 Å²	70.2	5%	0.046	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	118.4	-176.8	-51.5	-176.9	0	0	0	108.9	I526 L527 I528 E529 F569 Q572 L573 E576	I526-I555 HydrophobicContact CG2-CD1 3.82Å; I526-I555 HydrophobicContact CG2-CG1 4.38Å; L527-I555 PolarHBondContact O-N 3.46Å; I528-I555 WeakPolarHBondContact CA-O 3.43Å; E529-I555 PolarHBondContact N-O 2.76Å; I555-F569 HydrophobicContact CB-CE2 4.48Å; I555-F569 HydrophobicContact CG2-CD2 3.56Å; I555-F569 HydrophobicContact CG2-CE2 3.56Å; I555-Q572 HydrophobicContact CD1-CB 4.43Å; I555-Q572 HydrophobicContact CD1-CG 4.05Å; I555-Q572 HydrophobicContact CG1-CG 4.19Å; I555-L573 HydrophobicContact CD1-CB 4.15Å; I555-L573 HydrophobicContact CD1-CD1 3.96Å; I555-E576 HydrophobicContact CD1-CG 4.19Å
556	K	87.6	Confident	84.8	Confident	109 Å²	109	76.4 Å²	76.4	47%	0.474	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	112.5	178.8	-64.2	-178.3	-177.1	-83	0	110.8	E529	E529-K556 HydrophobicContact CB-CG 4.24Å; E529-K556 WeakPolarHBondContact OE2-CE 3.31Å; E529-K556 WeakPolarHBondContact OE2-CG 3.12Å; E529-K556 IonicContact OE2-NZ 2.94Å; E529-K556 PolarHBondContact OE2-NZ 2.82Å
557	W	88.7	Confident	84.8	Confident	11 Å²	11	76.4 Å²	76.4	4%	0.042	38%	0.376	C	S	.	.			trans	-71.5	154.1	160.4	-171.1	85.9	0	0	0	108.7	E428 E429 F432 I528 E529 C530 G559 N563 F569	E428-W557 HydrophobicContact CB-CH2 4.32Å; E429-W557 HydrophobicContact CG-CZ3 3.82Å; F432-W557 HydrophobicContact CB-CH2 4.16Å; F432-W557 HydrophobicContact CB-CZ2 3.73Å; F432-W557 HydrophobicContact CD1-CD2 4.23Å; F432-W557 HydrophobicContact CD1-CG 4.29Å; F432-W557 AromaticContact CD2-CD1 3.85Å; F432-W557 AromaticContact CD2-CE2 3.8Å; F432-W557 HydrophobicContact CD2-CZ2 4.18Å; F432-W557 AromaticContact CD2-NE1 3.3Å; F432-W557 VanDerWaalsContact CD2-NE1 3.3Å; F432-W557 AromaticContact CE1-CD1 4Å; F432-W557 HydrophobicContact CE1-CG 4.2Å; F432-W557 AromaticContact CE2-CD1 3.62Å; F432-W557 AromaticContact CE2-NE1 3.53Å; F432-W557 HydrophobicContact CG-CD2 4.24Å; F432-W557 AromaticContact CG-CE2 3.67Å; F432-W557 AromaticContact CG-CZ2 3.9Å; F432-W557 HydrophobicContact CG-CZ2 3.9Å; F432-W557 AromaticContact CG-NE1 3.65Å; F432-W557 AromaticContact CZ-CD1 3.72Å; F432-W557 HydrophobicContact CZ-CG 4.34Å; I528-W557 HydrophobicContact CG2-CB 4.28Å; E529-W557 PolarHBondContact O-N 2.84Å; C530-W557 HydrophobicContact CB-CE3 4.15Å; W557-G559 VanDerWaalsContact CE3-N 3.34Å; W557-G559 VanDerWaalsContact CH2-CA 3.46Å; W557-G559 VanDerWaalsContact CZ2-C 3.43Å; W557-G559 VanDerWaalsContact CZ3-CA 3.43Å; W557-N563 PolarHBondContact NE1-OD1 3.05Å; W557-F569 HydrophobicContact CB-CD2 4.26Å; W557-F569 HydrophobicContact CB-CE2 3.87Å; W557-F569 HydrophobicContact CB-CZ 4.47Å; W557-F569 HydrophobicContact CG-CE2 4.44Å
558	R	83.6	Confident	84.7	Confident	194 Å²	194	77.6 Å²	77.6	73%	0.732	38%	0.379	S	S	*	.			trans	-143.6	52.5	-171.5	-65	-166.7	-173.7	-161.4	2.3	111.1	S562	R558-S562 PolarHBondContact N-OG 2.97Å
559	G	81.6	Confident	84.9	Confident	18 Å²	18	75.1 Å²	75.1	19%	0.186	36%	0.363	C	S	.	.	S	Bend	trans	68.5	-173.8	-173.2	0	0	0	0	0	113.4	W557 K561 S562	W557-G559 VanDerWaalsContact CE3-N 3.34Å; W557-G559 VanDerWaalsContact CH2-CA 3.46Å; W557-G559 VanDerWaalsContact CZ2-C 3.43Å; W557-G559 VanDerWaalsContact CZ3-CA 3.43Å; G559-K561 PolarHBondContact O-N 3.04Å; G559-S562 PolarHBondContact O-N 3.29Å
560	P	79.6	Confident	84.9	Confident	63 Å²	63	74.6 Å²	74.6	41%	0.409	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-56.4	-18.9	-174.6	-29.3	35.9	0	0	0	115.7	E428 S562 N563	E428-P560 WeakPolarHBondContact OE2-CD 3.22Å; E428-P560 WeakPolarHBondContact OE2-CG 3.08Å; P560-S562 PolarHBondContact O-N 2.83Å; P560-N563 WeakPolarHBondContact O-CB 3.5Å; P560-N563 PolarHBondContact O-N 3.2Å
561	K	78.1	Confident	84.8	Confident	186 Å²	186	70.3 Å²	70.3	81%	0.809	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-62.9	-25.9	175.2	-65.5	177.6	-175.8	171.7	0	112.6	G559 N563	G559-K561 PolarHBondContact O-N 3.04Å; K561-N563 VanDerWaalsContact C-N 3.35Å
562	S	82.9	Confident	84.7	Confident	14 Å²	14	70.8 Å²	70.8	10%	0.098	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-71.9	-25.5	172.8	-77.3	0	0	0	0	113.4	R558 G559 P560 K564 S567 W570	R558-S562 PolarHBondContact N-OG 2.97Å; G559-S562 PolarHBondContact O-N 3.29Å; P560-S562 PolarHBondContact O-N 2.83Å; S562-K564 VanDerWaalsContact C-N 3.26Å; S562-K564 PolarHBondContact O-N 3.36Å; S562-S567 WeakPolarHBondContact O-CB 3.06Å; S562-S567 PolarHBondContact O-OG 3.36Å; S562-W570 PolarHBondContact O-NE1 3.33Å
563	N	81.8	Confident	84.6	Confident	36 Å²	36	68.7 Å²	68.7	19%	0.193	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-68.8	-19.2	-170.1	-64.4	-9.9	0	0	0	113.9	I436 W557 P560 K561 L565 W570	I436-N563 WeakPolarHBondContact CD1-ND2 3.4Å; W557-N563 PolarHBondContact NE1-OD1 3.05Å; P560-N563 WeakPolarHBondContact O-CB 3.5Å; P560-N563 PolarHBondContact O-N 3.2Å; K561-N563 VanDerWaalsContact C-N 3.35Å; N563-L565 PolarHBondContact O-N 2.93Å; N563-W570 PolarHBondContact O-NE1 3.21Å
564	K	83.4	Confident	84.5	Confident	165 Å²	165	69.5 Å²	69.5	72%	0.717	33%	0.332	S	S	*	.	S	Bend	trans	-60.7	118.7	175.7	-62.5	-169.4	176.6	-166.7	0	110.3	S562 N566 S567	S562-K564 VanDerWaalsContact C-N 3.26Å; S562-K564 PolarHBondContact O-N 3.36Å; K564-N566 PolarHBondContact O-N 2.72Å; K564-S567 WeakPolarHBondContact O-CB 3.49Å; K564-S567 PolarHBondContact O-N 3.41Å; K564-S567 PolarHBondContact O-OG 3.14Å
565	L	80.6	Confident	84.3	Confident	70 Å²	70	70.5 Å²	70.5	37%	0.366	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-34	-171.1	-62.2	170.7	0	0	0	115.3	V440 N563 S567 W570	V440-L565 HydrophobicContact CG1-CD2 3.71Å; V440-L565 HydrophobicContact CG2-CD2 4.05Å; N563-L565 PolarHBondContact O-N 2.93Å; L565-S567 VanDerWaalsContact C-N 3.26Å; L565-S567 PolarHBondContact O-N 3.23Å; L565-W570 WeakPolarHBondContact O-CB 3.3Å
566	N	77.1	Confident	84.2	Confident	141 Å²	141	71.1 Å²	71.1	75%	0.754	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	6.4	177.3	-78.7	-32.8	0	0	0	115.1	K564	K564-N566 PolarHBondContact O-N 2.72Å
567	S	85.3	Confident	84.1	Confident	23 Å²	23	66 Å²	66	16%	0.161	31%	0.309	C	S	.	.	S	Bend	trans	-69	161.7	-177.3	77	0	0	0	0	113	S562 K564 L565 F569 W570 K571	S562-S567 WeakPolarHBondContact O-CB 3.06Å; S562-S567 PolarHBondContact O-OG 3.36Å; K564-S567 WeakPolarHBondContact O-CB 3.49Å; K564-S567 PolarHBondContact O-N 3.41Å; K564-S567 PolarHBondContact O-OG 3.14Å; L565-S567 VanDerWaalsContact C-N 3.26Å; L565-S567 PolarHBondContact O-N 3.23Å; S567-F569 PolarHBondContact O-N 2.58Å; S567-F569 WeakPolarHBondContact OG-CB 3.42Å; S567-F569 PolarHBondContact OG-N 3.47Å; S567-W570 PolarHBondContact OG-N 3.25Å; S567-K571 WeakPolarHBondContact O-CG 3.36Å; S567-K571 PolarHBondContact O-N 3.39Å
568	K	83	Confident	83.9	Confident	190 Å²	190	65.5 Å²	65.5	83%	0.826	31%	0.307	S	S	*	.	H	α-helix	trans	-62.8	-24	171.7	-67.6	-172.2	175.9	-173.9	0	112.7	Q572	K568-Q572 WeakPolarHBondContact O-CB 3.11Å; K568-Q572 PolarHBondContact O-N 3.01Å
569	F	87.9	Confident	83.6	Confident	10 Å²	10	57.3 Å²	57.3	4%	0.044	28%	0.277	C	S	.	.	H	α-helix	trans	-65.6	-56.9	177.5	173.8	-94.1	0	0	0	110.8	F432 I528 I555 W557 S567 K571 Q572 L573	F432-F569 HydrophobicContact CE1-CZ 4.47Å; F432-F569 HydrophobicContact CE2-CE1 4.08Å; F432-F569 HydrophobicContact CE2-CZ 4.25Å; F432-F569 AromaticContact CZ-CE1 3.88Å; F432-F569 HydrophobicContact CZ-CE1 3.88Å; F432-F569 AromaticContact CZ-CZ 3.61Å; F432-F569 HydrophobicContact CZ-CZ 3.61Å; I528-F569 HydrophobicContact CD1-CZ 4.42Å; I528-F569 HydrophobicContact CG2-CE2 4.01Å; I528-F569 HydrophobicContact CG2-CZ 4.11Å; I555-F569 HydrophobicContact CB-CE2 4.48Å; I555-F569 HydrophobicContact CG2-CD2 3.56Å; I555-F569 HydrophobicContact CG2-CE2 3.56Å; W557-F569 HydrophobicContact CB-CD2 4.26Å; W557-F569 HydrophobicContact CB-CE2 3.87Å; W557-F569 HydrophobicContact CB-CZ 4.47Å; W557-F569 HydrophobicContact CG-CE2 4.44Å; S567-F569 PolarHBondContact O-N 2.58Å; S567-F569 WeakPolarHBondContact OG-CB 3.42Å; S567-F569 PolarHBondContact OG-N 3.47Å; F569-K571 PolarHBondContact O-N 3.48Å; F569-Q572 PolarHBondContact O-N 3.24Å; F569-L573 HydrophobicContact CE1-CD2 4.31Å; F569-L573 HydrophobicContact CZ-CD2 4.49Å; F569-L573 PolarHBondContact O-N 3.39Å
570	W	87.9	Confident	83	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-66.2	-37.4	179.7	-64.6	116.4	0	0	0	112.7	F432 I436 L437 V440 Y445 S562 N563 L565 S567 Q572 L573 Q574	F432-W570 HydrophobicContact CE2-CH2 4.17Å; F432-W570 HydrophobicContact CE2-CZ2 4.31Å; I436-W570 HydrophobicContact CG2-CZ2 4.31Å; L437-W570 HydrophobicContact CD1-CH2 4.13Å; L437-W570 HydrophobicContact CD1-CZ3 3.96Å; V440-W570 HydrophobicContact CB-CH2 3.57Å; V440-W570 HydrophobicContact CB-CZ2 3.99Å; V440-W570 HydrophobicContact CB-CZ3 3.89Å; V440-W570 HydrophobicContact CG1-CD2 4.03Å; V440-W570 HydrophobicContact CG1-CE3 3.73Å; V440-W570 HydrophobicContact CG1-CH2 3.61Å; V440-W570 HydrophobicContact CG1-CZ2 3.88Å; V440-W570 HydrophobicContact CG1-CZ3 3.52Å; V440-W570 HydrophobicContact CG2-CH2 3.98Å; V440-W570 HydrophobicContact CG2-CZ2 3.92Å; Y445-W570 HydrophobicContact CE2-CE3 4.07Å; S562-W570 PolarHBondContact O-NE1 3.33Å; N563-W570 PolarHBondContact O-NE1 3.21Å; L565-W570 WeakPolarHBondContact O-CB 3.3Å; S567-W570 PolarHBondContact OG-N 3.25Å; W570-Q572 VanDerWaalsContact C-N 3.34Å; W570-Q572 PolarHBondContact O-N 3.49Å; W570-L573 HydrophobicContact CE3-CD2 3.77Å; W570-L573 HydrophobicContact CZ3-CD2 3.68Å; W570-L573 PolarHBondContact O-N 3.29Å; W570-Q574 WeakPolarHBondContact O-CB 3.48Å; W570-Q574 PolarHBondContact O-N 3.35Å
571	K	85.6	Confident	82.2	Confident	55 Å²	55	65.3 Å²	65.3	24%	0.239	29%	0.293	C	S	.	.	H	α-helix	trans	-62.1	-37.4	174.1	-72.3	176.3	176.1	175.9	0	112.9	E387 L390 S567 F569 Y575	E387-K571 IonicContact OE1-NZ 3.98Å; E387-K571 PolarHBondContact OE1-NZ 3.41Å; L390-K571 HydrophobicContact CD1-CB 4.27Å; L390-K571 HydrophobicContact CD1-CG 4.48Å; S567-K571 WeakPolarHBondContact O-CG 3.36Å; S567-K571 PolarHBondContact O-N 3.39Å; F569-K571 PolarHBondContact O-N 3.48Å; K571-Y575 WeakPolarHBondContact O-CB 3.41Å; K571-Y575 PolarHBondContact O-N 3.25Å
572	Q	86.8	Confident	81.2	Confident	57 Å²	57	60.9 Å²	60.9	27%	0.266	28%	0.282	S	S	.	.	H	α-helix	trans	-69.6	-46.1	172.6	-167.7	71.1	40.7	0	0	110.9	I555 K568 F569 W570 Q574 Y575 E576	I555-Q572 HydrophobicContact CD1-CB 4.43Å; I555-Q572 HydrophobicContact CD1-CG 4.05Å; I555-Q572 HydrophobicContact CG1-CG 4.19Å; K568-Q572 WeakPolarHBondContact O-CB 3.11Å; K568-Q572 PolarHBondContact O-N 3.01Å; F569-Q572 PolarHBondContact O-N 3.24Å; W570-Q572 VanDerWaalsContact C-N 3.34Å; W570-Q572 PolarHBondContact O-N 3.49Å; Q572-Q574 PolarHBondContact O-N 3.18Å; Q572-Y575 WeakPolarHBondContact O-CB 3.31Å; Q572-Y575 PolarHBondContact O-N 3.37Å; Q572-Y575 VanDerWaalsContact O-N 3.09Å; Q572-E576 PolarHBondContact NE2-OE1 3.21Å; Q572-E576 WeakPolarHBondContact O-CG 3.49Å; Q572-E576 PolarHBondContact O-N 3.24Å
573	L	87.8	Confident	79.4	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-59.8	-46.3	-179.3	-175.4	61	0	0	0	111.9	L437 L441 I526 I528 I555 F569 W570 Y575 E576 M577	L437-L573 HydrophobicContact CD1-CD2 3.84Å; L441-L573 HydrophobicContact CD2-CD2 4.07Å; L441-L573 HydrophobicContact CD2-CG 4.47Å; I526-L573 HydrophobicContact CD1-CD1 4.36Å; I526-L573 HydrophobicContact CG2-CD1 3.67Å; I528-L573 HydrophobicContact CD1-CD1 4.43Å; I555-L573 HydrophobicContact CD1-CB 4.15Å; I555-L573 HydrophobicContact CD1-CD1 3.96Å; F569-L573 HydrophobicContact CE1-CD2 4.31Å; F569-L573 HydrophobicContact CZ-CD2 4.49Å; F569-L573 PolarHBondContact O-N 3.39Å; W570-L573 HydrophobicContact CE3-CD2 3.77Å; W570-L573 HydrophobicContact CZ3-CD2 3.68Å; W570-L573 PolarHBondContact O-N 3.29Å; L573-Y575 VanDerWaalsContact C-N 3.27Å; L573-Y575 PolarHBondContact O-N 3.38Å; L573-E576 PolarHBondContact O-N 3.01Å; L573-E576 VanDerWaalsContact O-N 3.15Å; L573-M577 HydrophobicContact CD1-CG 4.44Å; L573-M577 HydrophobicContact CG-CG 4.47Å; L573-M577 WeakPolarHBondContact O-CB 3.47Å; L573-M577 VanDerWaalsContact O-CG 3.25Å; L573-M577 WeakPolarHBondContact O-CG 3.36Å; L573-M577 PolarHBondContact O-N 2.97Å
574	Q	86.6	Confident	77.4	Confident	42 Å²	42	72 Å²	72	20%	0.196	34%	0.341	C	S	.	.	H	α-helix	trans	-63.7	-30	175.3	-174	174.3	49.3	0	0	113	L390 W570 Q572	L390-Q574 HydrophobicContact CD2-CG 4.26Å; W570-Q574 WeakPolarHBondContact O-CB 3.48Å; W570-Q574 PolarHBondContact O-N 3.35Å; Q572-Q574 PolarHBondContact O-N 3.18Å
575	Y	84.9	Confident	75.1	Confident	86 Å²	86	72.4 Å²	72.4	34%	0.337	35%	0.348	S	S	.	.	H	α-helix	trans	-70.8	-37	173.4	176	-88.1	0	0	0	111.9	M389 K571 Q572 L573	M389-Y575 HydrophobicContact CB-CE2 4.09Å; K571-Y575 WeakPolarHBondContact O-CB 3.41Å; K571-Y575 PolarHBondContact O-N 3.25Å; Q572-Y575 WeakPolarHBondContact O-CB 3.31Å; Q572-Y575 PolarHBondContact O-N 3.37Å; Q572-Y575 VanDerWaalsContact O-N 3.09Å; L573-Y575 VanDerWaalsContact C-N 3.27Å; L573-Y575 PolarHBondContact O-N 3.38Å
576	E	87.4	Confident	72.7	Confident	22 Å²	22	77 Å²	77	10%	0.103	37%	0.372	C	S	.	.	H	α-helix	trans	-80.5	-27.5	179.8	-55.4	-52.1	163.6	0	0	114.6	R490 K524 I526 T553 I555 Q572 L573	R490-E576 PolarHBondContact NE-O 3.21Å; K524-E576 WeakPolarHBondContact CE-OE2 3.36Å; K524-E576 PolarHBondContact NZ-O 3.46Å; K524-E576 IonicContact NZ-OE2 3.62Å; K524-E576 PolarHBondContact NZ-OE2 3.38Å; I526-E576 HydrophobicContact CD1-CB 4Å; I526-E576 HydrophobicContact CG1-CB 4.12Å; T553-E576 HydrophobicContact CG2-CG 4.16Å; I555-E576 HydrophobicContact CD1-CG 4.19Å; Q572-E576 PolarHBondContact NE2-OE1 3.21Å; Q572-E576 WeakPolarHBondContact O-CG 3.49Å; Q572-E576 PolarHBondContact O-N 3.24Å; L573-E576 PolarHBondContact O-N 3.01Å; L573-E576 VanDerWaalsContact O-N 3.15Å
577	M	85.9	Confident	70.4	Confident	1 Å²	1	76.2 Å²	76.2	1%	0.005	37%	0.372	C	S	.	.	S	Bend	trans	-65.2	165.1	178.4	-78.9	-65.6	-79.4	0	0	113.6	R393 A410 L441 Y447 R490 I492 I526 L573	R393-M577 PolarHBondContact NH1-O 2.85Å; A410-M577 HydrophobicContact CB-CE 4.04Å; A410-M577 HydrophobicContact CB-SD 4.31Å; L441-M577 HydrophobicContact CD2-CE 4.4Å; Y447-M577 HydrophobicContact CD1-CE 3.76Å; Y447-M577 HydrophobicContact CD2-CE 3.7Å; Y447-M577 HydrophobicContact CE1-CB 4.21Å; Y447-M577 HydrophobicContact CE1-CE 4.04Å; Y447-M577 HydrophobicContact CE2-CB 4.05Å; Y447-M577 HydrophobicContact CE2-CE 3.99Å; Y447-M577 HydrophobicContact CE2-CG 4.24Å; Y447-M577 HydrophobicContact CG-CE 3.58Å; Y447-M577 WeakPolarHBondContact OH-CB 3.47Å; R490-M577 HydrophobicContact CG-SD 4.28Å; I492-M577 HydrophobicContact CD1-CE 4.5Å; I492-M577 HydrophobicContact CD1-SD 4.05Å; I526-M577 HydrophobicContact CD1-CG 4.14Å; I526-M577 HydrophobicContact CD1-SD 3.73Å; L573-M577 HydrophobicContact CD1-CG 4.44Å; L573-M577 HydrophobicContact CG-CG 4.47Å; L573-M577 WeakPolarHBondContact O-CB 3.47Å; L573-M577 VanDerWaalsContact O-CG 3.25Å; L573-M577 WeakPolarHBondContact O-CG 3.36Å; L573-M577 PolarHBondContact O-N 2.97Å
578	P	84.8	Confident	67.9	Low	1 Å²	1	84.6 Å²	84.6	1%	0.006	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-60.8	158.1	173.5	-18.7	33.2	0	0	0	111.7	D400 D409 Y447 K489 R490 R580	D400-P578 WeakPolarHBondContact OD2-CA 3.42Å; D409-P578 HydrophobicContact CB-CG 4.29Å; D409-P578 WeakPolarHBondContact O-CG 3.32Å; Y447-P578 VanDerWaalsContact CE1-O 3.29Å; Y447-P578 WeakPolarHBondContact CE1-O 3.43Å; Y447-P578 PolarHBondContact OH-O 3.46Å; K489-P578 HydrophobicContact CB-CG 3.94Å; K489-P578 HydrophobicContact CD-CB 4.36Å; K489-P578 HydrophobicContact CD-CG 4.31Å; R490-P578 HydrophobicContact CG-CG 3.86Å; P578-R580 PolarHBondContact O-N 3.19Å
579	F	77.3	Confident	65.3	Low	22 Å²	22	83.9 Å²	83.9	10%	0.096	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-74	129.7	169.1	-166.6	-128.3	0	0	0	109.7	R393 S398 D400 R581	R393-F579 HydrophobicContact CB-CE2 4.44Å; R393-F579 HydrophobicContact CG-CD2 3.6Å; R393-F579 HydrophobicContact CG-CE2 3.84Å; R393-F579 HydrophobicContact CG-CG 4.19Å; R393-F579 WeakPolarHBondContact O-CE2 3.12Å; R393-F579 WeakPolarHBondContact O-CZ 3.49Å; S398-F579 WeakPolarHBondContact O-CD1 3.19Å; D400-F579 PolarHBondContact OD2-N 3.05Å; F579-R581 HydrophobicContact CE1-CG 3.75Å; F579-R581 HydrophobicContact CZ-CG 4.15Å
580	R	68.8	Low	62.7	Low	83 Å²	83	89.4 Å²	89.4	31%	0.313	45%	0.445	S	S	.	.			trans	-121.2	135.4	161	-81	-68.7	-165.7	166.8	6.3	107	E399 D409 Y447 P578 T582	E399-R580 IonicContact OE1-NH1 2.75Å; D409-R580 IonicContact OD1-CZ 3.65Å; D409-R580 IonicContact OD1-NE 3.37Å; D409-R580 IonicContact OD1-NH2 3.04Å; D409-R580 IonicContact OD2-CZ 2.78Å; D409-R580 VanDerWaalsContact OD2-CZ 3.28Å; D409-R580 IonicContact OD2-NE 3.79Å; D409-R580 PolarHBondContact OD2-NE 3.07Å; D409-R580 IonicContact OD2-NH2 3.36Å; D409-R580 PolarHBondContact OD2-NH2 3.12Å; Y447-R580 HydrophobicContact CD1-CG 3.77Å; Y447-R580 HydrophobicContact CE1-CB 4.17Å; Y447-R580 HydrophobicContact CE1-CG 3.68Å; P578-R580 PolarHBondContact O-N 3.19Å; R580-T582 PolarHBondContact O-N 3.44Å
581	R	63	Low	60	Low	166 Å²	166	94.3 Å²	94.3	63%	0.626	49%	0.485	S	S	*	.			trans	-72.6	112.8	157.3	-71.8	-177.2	177.3	168.6	2.1	106.8	G397 F579 E583	G397-R581 PolarHBondContact O-NH2 3.24Å; F579-R581 HydrophobicContact CE1-CG 3.75Å; F579-R581 HydrophobicContact CZ-CG 4.15Å; R581-E583 PolarHBondContact O-N 3.25Å
582	T	55.6	Low	57.3	Low	93 Å²	93	99.7 Å²	99.7	57%	0.571	52%	0.516	S	S	*	.			trans	-68.4	100.8	169.9	-47.1	0	0	0	0	107.6	R580	R580-T582 PolarHBondContact O-N 3.44Å
583	E	46.2	Very low	54.5	Low	171 Å²	171	103.9 Å²	103.9	80%	0.799	54%	0.54	S	S	*	.			trans	-59.1	128.8	165.2	-66.5	-170.3	145.3	0	0	108	R581 M585	R581-E583 PolarHBondContact O-N 3.25Å; E583-M585 PolarHBondContact O-N 3.33Å
584	P	39.1	Very low	51.8	Low	112 Å²	112	109.5 Å²	109.5	73%	0.727	57%	0.574	S	S	*	*			trans	-66.8	121.6	179.1	27.2	-32.5	0	0	0	108.6	L586	P584-L586 PolarHBondContact O-N 3.31Å
585	M	34.6	Very low	48.9	Very low	175 Å²	175	112.2 Å²	112.2	86%	0.862	60%	0.598	S	S	*	*			trans	-56.4	109.4	167.9	-84.7	-171	163.3	0	0	108.7	E583 T587	E583-M585 PolarHBondContact O-N 3.33Å; M585-T587 PolarHBondContact O-N 3.42Å; M585-T587 VanDerWaalsContact O-N 3.08Å
586	L	30.6	Very low	46.4	Very low	166 Å²	166	116.8 Å²	116.8	87%	0.869	62%	0.622	S	S	*	*			trans	-60.6	112.4	175.4	-81.4	162	0	0	0	108.8	P584 H588	P584-L586 PolarHBondContact O-N 3.31Å; L586-H588 PolarHBondContact O-N 3.43Å
587	T	29.3	Very low	43.5	Very low	125 Å²	125	125.3 Å²	125.3	77%	0.767	66%	0.662	S	S	*	*			trans	-58.5	129.1	165.1	42.8	0	0	0	0	108.9	M585 E589	M585-T587 PolarHBondContact O-N 3.42Å; M585-T587 VanDerWaalsContact O-N 3.08Å; T587-E589 PolarHBondContact O-N 3.14Å
588	H	33.7	Very low	40.9	Very low	198 Å²	198	128.7 Å²	128.7	92%	0.917	70%	0.698	S	S	*	*			trans	-55.5	112.2	176.1	-92.5	-80.1	0	0	0	111.6	L586	L586-H588 PolarHBondContact O-N 3.43Å
589	E	27.1	Very low	38.7	Very low	176 Å²	176	133.8 Å²	133.8	82%	0.822	73%	0.73	S	S	*	*			trans	-116.4	147.6	149.9	-75.1	-164.1	115.3	0	0	108.9	T587	T587-E589 PolarHBondContact O-N 3.14Å
590	P	34.8	Very low	36.5	Very low	126 Å²	126	142.3 Å²	142.3	82%	0.818	77%	0.768	S	S	*	*			trans	-77.7	148.5	-173	31.7	-35.4	0	0	0	112.5
591	A	30.1	Very low	34.6	Very low	102 Å²	102	141.7 Å²	141.7	84%	0.843	79%	0.788	S	S	*	*			trans	-73.3	142	178.6	0	0	0	0	0	112.8
592	L	30	Very low	33.2	Very low	169 Å²	169	141.7 Å²	141.7	89%	0.885	80%	0.795	S	S	*	*			trans	-141.3	96.9	164.1	-97.3	171.3	0	0	0	110.9
593	D	27.5	Very low	32.1	Very low	144 Å²	144	142.9 Å²	142.9	77%	0.77	80%	0.797	S	S	*	*			trans	29.3	126.7	146.6	-84.4	-3.1	0	0	0	124.1
594	V	30.1	Very low	31.3	Very low	120 Å²	120	142.3 Å²	142.3	73%	0.727	79%	0.794	S	S	*	*				90.4	123.3	123	170.2	0	0	0	0	121.4
595	S	27.2	Very low	30.9	Very low	99 Å²	99	142.2 Å²	142.2	69%	0.692	79%	0.792	S	S	*	*			trans	64.8	151	156.9	-79.3	0	0	0	0	119.5
596	E	31	Very low	30.7	Very low	182 Å²	182	140.1 Å²	140.1	85%	0.85	79%	0.788	S	S	*	*			cis	-143.6	172.9	2.2	-142.6	155.8	-134.2	0	0	112.4
597	Q	28.1	Very low	30.8	Very low	200 Å²	200	136.9 Å²	136.9	94%	0.935	78%	0.78	S	S	*	*			trans	-97.8	137.6	-174.6	-66.6	169.5	-35.2	0	0	112.7
598	G	30.7	Very low	30.8	Very low	73 Å²	73	135.8 Å²	135.8	75%	0.753	78%	0.783	S	S	*	*			trans	-159.3	135.7	169.4	0	0	0	0	0	111.2
599	P	37.9	Very low	30.7	Very low	107 Å²	107	133.3 Å²	133.3	70%	0.695	78%	0.775	S	S	*	*			trans	-121.6	171.7	-154.4	35.5	-18.3	0	0	0	116.5
600	F	30.7	Very low	30.8	Very low	201 Å²	201	130.7 Å²	130.7	88%	0.882	78%	0.777	S	S	*	*			trans	68.4	144	-177.7	-53.6	-84.4	0	0	0	113.4
601	G	29.9	Very low	30.6	Very low	71 Å²	71	133.2 Å²	133.2	73%	0.732	78%	0.78	S	S	*	*			cis	118	136.7	21.2	0	0	0	0	0	107.8
602	E	32.6	Very low	30.8	Very low	165 Å²	165	133.3 Å²	133.3	77%	0.771	78%	0.78	S	S	*	*			cis	-155.7	167.3	10.9	-104	-174.1	127.8	0	0	110.7
603	L	32.3	Very low	30.7	Very low	118 Å²	118	130.2 Å²	130.2	62%	0.618	78%	0.779	S	S	*	*			trans	44.1	123.3	141.8	-60	169.9	0	0	0	121.2
604	Q	30.6	Very low	30.9	Very low	160 Å²	160	127.8 Å²	127.8	75%	0.748	78%	0.779	S	S	*	*				79.5	151.7	119.8	-76.9	-175.2	-13.1	0	0	121.3
605	T	31	Very low	31	Very low	109 Å²	109	128.7 Å²	128.7	67%	0.669	79%	0.785	S	S	*	*			cis	-162.4	173.4	-29.4	7.1	0	0	0	0	110.9
606	V	29.3	Very low	31.2	Very low	131 Å²	131	128.6 Å²	128.6	79%	0.794	78%	0.784	S	S	*	*			trans	74.7	111.5	145.1	162.9	0	0	0	0	117.8
607	S	32.3	Very low	31.2	Very low	99 Å²	99	126.6 Å²	126.6	69%	0.692	79%	0.785	S	S	*	*			trans	-60.2	147.8	158.5	168.9	0	0	0	0	112.3
608	A	29.3	Very low	31.3	Very low	101 Å²	101	122.1 Å²	122.1	84%	0.835	78%	0.782	S	S	*	*			trans	-125.8	132.2	160	0	0	0	0	0	110.4
609	I	32.9	Very low	31.2	Very low	146 Å²	146	127.5 Å²	127.5	75%	0.749	79%	0.79	S	S	*	*			trans	-103.4	140.3	-175.8	-59.7	165	0	0	0	109.5
610	S	28.6	Very low	30.7	Very low	122 Å²	122	126.9 Å²	126.9	85%	0.853	79%	0.794	S	S	*	*			trans	-163	159.2	145.2	-88.2	0	0	0	0	112.3
611	M	31.5	Very low	30.6	Very low	179 Å²	179	123.5 Å²	123.5	88%	0.882	79%	0.79	S	S	*	*			trans	-115.3	-171.5	-173.2	-56.3	-168.9	-62.5	0	0	111.8
612	A	33	Very low	30.5	Very low	104 Å²	104	124.3 Å²	124.3	86%	0.86	79%	0.789	S	S	*	*			trans	85	145.5	170.5	0	0	0	0	0	114.9
613	A	28.7	Very low	30.4	Very low	103 Å²	103	125.6 Å²	125.6	85%	0.851	80%	0.795	S	S	*	*			cis	-148.5	174	-12.2	0	0	0	0	0	109.8
614	A	31.1	Very low	30.5	Very low	94 Å²	94	125.2 Å²	125.2	78%	0.777	80%	0.799	S	S	*	*			trans	-93.5	147.1	179.7	0	0	0	0	0	113.5
615	T	32	Very low	30.2	Very low	138 Å²	138	126.1 Å²	126.1	85%	0.847	80%	0.804	S	S	*	*			trans	-164.3	131.9	136.2	19.1	0	0	0	0	114.1
616	S	32.5	Very low	30.2	Very low	97 Å²	97	129 Å²	129	68%	0.678	81%	0.814	S	S	*	*			trans	56	107.3	135.9	-51.6	0	0	0	0	123.9
617	T	31.2	Very low	30.1	Very low	140 Å²	140	133.9 Å²	133.9	86%	0.859	82%	0.818	S	S	*	*				58.3	115.4	125.6	61	0	0	0	0	122.6
618	A	29.8	Very low	29.9	Very low	106 Å²	106	134.2 Å²	134.2	88%	0.876	82%	0.821	S	S	*	*			trans	-149.2	161.8	137.8	0	0	0	0	0	109.4
619	M	29.1	Very low	29.7	Very low	186 Å²	186	133.6 Å²	133.6	92%	0.916	81%	0.81	S	S	*	*			trans	-111.1	157.4	-170.1	-72.7	-170.7	172.8	0	0	115.2
620	A	27	Very low	29.4	Very low	94 Å²	94	135.7 Å²	135.7	78%	0.777	81%	0.814	S	S	*	*			trans	71.4	155.6	158.2	0	0	0	0	0	116.3
621	T	28.5	Very low	29.4	Very low	130 Å²	130	137.4 Å²	137.4	80%	0.798	81%	0.808	S	S	*	*			cis	-144	166	23.8	45.7	0	0	0	0	114
622	A	26.7	Very low	29.1	Very low	88 Å²	88	135.7 Å²	135.7	73%	0.727	80%	0.803	S	S	*	*			trans	58.1	110.5	148.7	0	0	0	0	0	121.5
623	H	30.3	Very low	28.7	Very low	193 Å²	193	135 Å²	135	89%	0.894	79%	0.788	S	S	*	*			trans	-135.4	126.4	143.4	-100.6	-68.1	0	0	0	109.6
624	P	34.6	Very low	28.6	Very low	109 Å²	109	139.5 Å²	139.5	71%	0.708	79%	0.785	S	S	*	*			trans	-92	152.8	170.7	35.4	-32.5	0	0	0	112.6
625	E	25.9	Very low	28.5	Very low	179 Å²	179	142.1 Å²	142.1	84%	0.836	78%	0.781	S	S	*	*			trans	41.4	128.5	151.5	-59.1	-169.1	176.7	0	0	121.7
626	L	30.6	Very low	28.2	Very low	170 Å²	170	140.8 Å²	140.8	89%	0.89	77%	0.772	S	S	*	*				-162.4	152.5	103.8	-105.8	161.5	0	0	0	113.4
627	R	25.7	Very low	27.9	Very low	233 Å²	233	142.3 Å²	142.3	88%	0.879	78%	0.778	S	S	*	*			trans	-91.5	141.5	178	-80.4	175.9	155.3	115.2	-10.4	112.1
628	S	28.9	Very low	27.6	Very low	107 Å²	107	143.5 Å²	143.5	75%	0.748	78%	0.775	S	S	*	*				172.5	128.7	121.6	43.4	0	0	0	0	108.8
629	S	25	Very low	27.5	Very low	88 Å²	88	148.1 Å²	148.1	62%	0.615	77%	0.77	S	S	*	*			cis	60.9	98	45.9	81.5	0	0	0	0	114.2
630	F	27.5	Very low	27.4	Very low	190 Å²	190	145.6 Å²	145.6	83%	0.833	76%	0.756	S	S	*	*				-170.1	164.8	105.1	-104.6	-72.9	0	0	0	112.8
631	H	27.7	Very low	27.3	Very low	157 Å²	157	148 Å²	148	73%	0.727	75%	0.749	S	S	*	*			trans	-67.8	167.2	174.5	-59.5	-100.2	0	0	0	110.7
632	N	25.2	Very low	27.1	Very low	143 Å²	143	148.9 Å²	148.9	77%	0.765	74%	0.744	S	S	*	*			cis	-166.8	149.7	47	-131.5	-29.5	0	0	0	117.3
633	T	25.6	Very low	27	Very low	90 Å²	90	152.9 Å²	152.9	55%	0.552	74%	0.741	S	S	*	*			trans	-42.2	145	165.3	-20.5	0	0	0	0	118.8
634	Y	26.3	Very low	26.8	Very low	197 Å²	197	154.8 Å²	154.8	77%	0.773	74%	0.742	S	S	*	*				136	140.3	127.8	-82.1	-61.3	0	0	0	121.1
635	H	27.6	Very low	26.3	Very low	150 Å²	150	158.7 Å²	158.7	69%	0.694	74%	0.743	S	S	*	*			trans	68.8	92.8	146.2	-77.8	-62.3	0	0	0	125.6
636	T	25.8	Very low	26.2	Very low	109 Å²	109	155.7 Å²	155.7	67%	0.669	74%	0.741	S	S	*	*				44.6	141.4	113.6	58.2	0	0	0	0	125.5
637	T	26.2	Very low	26	Very low	129 Å²	129	156.5 Å²	156.5	79%	0.791	73%	0.734	S	S	*	*			trans	88.4	109.9	142	38.3	0	0	0	0	124.9
638	M	25.5	Very low	25.9	Very low	165 Å²	165	154.1 Å²	154.1	81%	0.813	73%	0.733	S	S	*	*			trans	64.6	128	133.3	-80.7	-150	-175.2	0	0	126.1
639	R	27	Very low	25.8	Very low	204 Å²	204	159.8 Å²	159.8	77%	0.77	74%	0.739	S	S	*	*				100.5	124.2	127.6	-94.7	-173.2	171.4	-169.5	-0.5	122.4
640	Q	27.5	Very low	25.8	Very low	132 Å²	132	162.9 Å²	162.9	62%	0.617	75%	0.749	S	S	*	*			trans	70	149.5	149.9	-66.2	-172.8	19.6	0	0	116
641	K	24.8	Very low	25.9	Very low	146 Å²	146	161.5 Å²	161.5	64%	0.635	75%	0.749	S	S	*	*			cis	-164	173.5	2.1	-112.5	166.4	177.6	160.1	0	107.2
642	H	24.2	Very low	26	Very low	147 Å²	147	159.6 Å²	159.6	68%	0.681	75%	0.751	S	S	*	*			cis	-158	-175.9	1	-129.3	-28.1	0	0	0	111.3
643	Y	25.1	Very low	26.3	Very low	173 Å²	173	159.1 Å²	159.1	68%	0.678	76%	0.755	S	S	*	*			trans	7	140	160.8	-73.6	-72.8	0	0	0	124.4
644	Y	25.1	Very low	26.3	Very low	233 Å²	233	158.8 Å²	158.8	91%	0.914	77%	0.77	S	S	*	*				-134.9	172.8	116.9	-127.3	-93.8	0	0	0	111.1
645	R	26	Very low	26.3	Very low	191 Å²	191	153.1 Å²	153.1	72%	0.721	77%	0.771	S	S	*	*			trans	-135.6	140.5	-167.8	-177.4	-173	-170.9	176.6	4	110.9
646	S	22.8	Very low	26.3	Very low	115 Å²	115	152.1 Å²	152.1	80%	0.804	78%	0.776	S	S	*	*			trans	-124.2	160.1	166.4	52.5	0	0	0	0	110.3
647	Y	27.2	Very low	26.3	Very low	188 Å²	188	154.7 Å²	154.7	74%	0.737	79%	0.785	S	S	*	*			trans	-103.7	154.1	-169.5	-78.2	-104.4	0	0	0	112.8
648	E	22.7	Very low	26.7	Very low	183 Å²	183	154.1 Å²	154.1	86%	0.855	78%	0.783	S	S	*	*			trans	-123.5	150.4	172.2	-164.7	156.2	-146.6	0	0	107.4
649	Y	26.1	Very low	26.7	Very low	225 Å²	225	150.7 Å²	150.7	88%	0.882	78%	0.781	S	S	*	*			trans	-113.4	115.7	-172.6	-104.4	-87.1	0	0	0	110.6
650	D	26.3	Very low	26.6	Very low	154 Å²	154	148.7 Å²	148.7	82%	0.824	79%	0.785	S	S	*	*			trans	-98.5	151.7	175.7	-78.2	-50.5	0	0	0	112.7
651	I	29	Very low	26.3	Very low	160 Å²	160	146.9 Å²	146.9	82%	0.821	79%	0.786	S	S	*	*			trans	-125.3	128.2	167.9	-61.2	178	0	0	0	107.6
652	P	30.6	Very low	26.3	Very low	118 Å²	118	146.2 Å²	146.2	77%	0.766	80%	0.795	S	S	*	*			trans	-82.8	149.4	-166.6	31.8	-36.5	0	0	0	114.6
653	P	30.3	Very low	26.3	Very low	132 Å²	132	147.6 Å²	147.6	86%	0.857	81%	0.806	S	S	*	*			trans	-80	159.2	168.7	34.2	-34.8	0	0	0	112.4
654	G	26.5	Very low	26.2	Very low	84 Å²	84	143 Å²	143	87%	0.866	81%	0.811	S	S	*	*			trans	-96.8	177.6	-169.5	0	0	0	0	0	117.3
655	G	26.5	Very low	26.1	Very low	78 Å²	78	138.8 Å²	138.8	80%	0.804	81%	0.805	S	S	*	*			trans	-107.9	-173	175.8	0	0	0	0	0	114.2
656	T	27.5	Very low	26	Very low	129 Å²	129	137.1 Å²	137.1	79%	0.791	81%	0.805	S	S	*	*			trans	-124.8	136.8	-153.4	29.3	0	0	0	0	117.2
657	L	25.2	Very low	26.1	Very low	163 Å²	163	139.2 Å²	139.2	85%	0.853	80%	0.802	S	S	*	*			trans	70.2	161.2	150.9	-63	173.5	0	0	0	119.3
658	P	34.8	Very low	26.1	Very low	117 Å²	117	136.2 Å²	136.2	76%	0.76	80%	0.803	S	S	*	*			cis	-138.8	177.4	-28.5	35.3	-16.5	0	0	0	116.4
659	A	26	Very low	26.2	Very low	92 Å²	92	138 Å²	138	76%	0.76	80%	0.804	S	S	*	*			trans	122	141.8	133.4	0	0	0	0	0	122.1
660	L	23.8	Very low	26.1	Very low	163 Å²	163	132.2 Å²	132.2	85%	0.853	80%	0.795	S	S	*	*			trans	73.1	107.6	156	-105.5	73.3	0	0	0	124.8
661	S	22.9	Very low	26.1	Very low	93 Å²	93	132.9 Å²	132.9	65%	0.65	80%	0.799	S	S	*	*			trans	22.8	129.7	135	63.7	0	0	0	0	124
662	T	24.3	Very low	26.1	Very low	132 Å²	132	132.3 Å²	132.3	81%	0.81	80%	0.796	S	S	*	*				-179.2	122.9	105.3	33	0	0	0	0	110.2
663	L	24.1	Very low	26	Very low	177 Å²	177	131.7 Å²	131.7	93%	0.927	79%	0.792	S	S	*	*				73	109.3	95.6	-160.8	83.9	0	0	0	115.4
664	G	22.6	Very low	25.9	Very low	76 Å²	76	133.5 Å²	133.5	78%	0.784	79%	0.793	S	S	*	*			trans	178.9	102.9	174.7	0	0	0	0	0	115.4
665	N	23.8	Very low	26.2	Very low	145 Å²	145	135.2 Å²	135.2	78%	0.775	79%	0.787	S	S	*	*			trans	-18.7	137.2	177.3	-62.2	-7	0	0	0	122
666	Q	24.2	Very low	26.3	Very low	155 Å²	155	138.6 Å²	138.6	72%	0.724	79%	0.786	S	S	*	*				16.7	140.6	118.2	-59.2	177	-11.2	0	0	117.8
667	H	23.8	Very low	26.5	Very low	160 Å²	160	140.8 Å²	140.8	74%	0.741	79%	0.792	S	S	*	*				-151.2	154.1	53.7	-81.4	-87	0	0	0	115.7
668	T	26.6	Very low	26.7	Very low	125 Å²	125	140 Å²	140	77%	0.767	79%	0.789	S	S	*	*			trans	-91.6	147.7	169.7	50.8	0	0	0	0	112.4
669	Y	24.7	Very low	26.4	Very low	219 Å²	219	137.8 Å²	137.8	86%	0.859	79%	0.787	S	S	*	*			trans	-139.4	130.2	151.2	-101.7	-78.6	0	0	0	113.5
670	C	25	Very low	26.6	Very low	105 Å²	105	142.9 Å²	142.9	71%	0.709	80%	0.795	S	S	*	*			trans	31.8	96.4	161.6	-62.5	0	0	0	0	121
671	N	26	Very low	26.8	Very low	167 Å²	167	146.2 Å²	146.2	89%	0.893	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-71.9	142.1	130.7	-81.7	-60.7	0	0	0	109
672	I	29.8	Very low	27.7	Very low	148 Å²	148	147.2 Å²	147.2	76%	0.759	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-103.3	121	167.6	-60.6	177.4	0	0	0	108.6
673	P	27.8	Very low	27.9	Very low	106 Å²	106	148.8 Å²	148.8	69%	0.688	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-88	135.8	176	33.4	-31.9	0	0	0	111.7
674	L	29.3	Very low	28.2	Very low	169 Å²	169	143 Å²	143	89%	0.885	79%	0.787	S	S	*	*			trans	-107.5	100.4	158	-96.4	81.3	0	0	0	110.3
675	T	32.3	Very low	28.5	Very low	121 Å²	121	149.4 Å²	149.4	74%	0.742	79%	0.793	S	S	*	*			trans	-122.1	106.3	159.1	53.3	0	0	0	0	108.4
676	L	28.6	Very low	28.6	Very low	149 Å²	149	146.6 Å²	146.6	78%	0.78	79%	0.785	S	S	*	*			trans	176	107.6	143.4	-100.6	164.5	0	0	0	111.5
677	L	30.7	Very low	28.8	Very low	175 Å²	175	148.8 Å²	148.8	92%	0.916	79%	0.786	S	S	*	*			trans	-152.7	102.5	140.3	-109.6	163.4	0	0	0	107.4
678	N	29.2	Very low	29.1	Very low	146 Å²	146	147.2 Å²	147.2	78%	0.781	78%	0.779	S	S	*	*			trans	-62.5	159.5	163.5	-70	-48.1	0	0	0	108.4
679	G	29.6	Very low	29.2	Very low	71 Å²	71	149 Å²	149	73%	0.732	78%	0.778	S	S	*	*			cis	178.3	-176.6	11.4	0	0	0	0	0	106.4
680	Q	28.9	Very low	29.3	Very low	198 Å²	198	142.8 Å²	142.8	93%	0.925	77%	0.767	S	S	*	*			cis	-157	153.1	29.3	-150.5	161.7	-33.6	0	0	110.1
681	R	29	Very low	29.6	Very low	233 Å²	233	144.8 Å²	144.8	88%	0.879	77%	0.77	S	S	*	*			trans	-82.2	-177.2	167	-66	177.8	173.3	171.3	-3.1	109.8
682	P	42.3	Very low	29.7	Very low	115 Å²	115	145 Å²	145	75%	0.747	77%	0.766	S	S	*	*			cis	-128.2	-155.9	-1	42	-21.8	0	0	0	111.1
683	L	28.8	Very low	29.7	Very low	164 Å²	164	146.8 Å²	146.8	86%	0.859	77%	0.771	S	S	*	*			cis	-158.4	155.9	-2.2	-162.2	65.9	0	0	0	106.4
684	G	29.1	Very low	29.7	Very low	56 Å²	56	146 Å²	146	58%	0.577	77%	0.773	S	S	*	*			cis	138.7	130	-9.8	0	0	0	0	0	113
685	K	28.9	Very low	29.6	Very low	211 Å²	211	146.7 Å²	146.7	92%	0.917	77%	0.772	S	S	*	*			trans	79.2	148.2	172.5	-65.9	-176.9	179.8	-178.1	0	116.8
686	S	26.7	Very low	29.5	Very low	85 Å²	85	145.6 Å²	145.6	59%	0.594	78%	0.775	S	S	*	*			cis	-173.5	134.4	-4.1	147.6	0	0	0	0	114.1
687	R	28.7	Very low	29.6	Very low	202 Å²	202	145.1 Å²	145.1	76%	0.762	77%	0.773	S	S	*	*			trans	62.8	166.6	148.2	-60.7	172.3	87.1	155.5	13.5	117.6
688	E	29.9	Very low	29.5	Very low	127 Å²	127	144 Å²	144	59%	0.593	77%	0.769	S	S	*	*			cis	-162.1	160.4	-29.6	-105.5	164.9	-171.2	0	0	108.9
689	H	29	Very low	29.6	Very low	161 Å²	161	141.8 Å²	141.8	75%	0.745	77%	0.77	S	S	*	*			trans	56.2	106.6	148.7	-85.6	-82.7	0	0	0	124.7
690	S	26.8	Very low	29.5	Very low	89 Å²	89	147.2 Å²	147.2	62%	0.622	78%	0.779	S	S	*	*				64	129.7	117.1	65.9	0	0	0	0	126
691	L	29.6	Very low	29.6	Very low	148 Å²	148	144.3 Å²	144.3	78%	0.775	77%	0.769	S	S	*	*			trans	79.7	112.4	132.3	-73.6	167.6	0	0	0	123.9
692	E	29	Very low	29.9	Very low	171 Å²	171	139.2 Å²	139.2	80%	0.799	77%	0.766	S	S	*	*				81.1	160.1	122	-131.4	161.6	-160.1	0	0	123.9
693	E	29.3	Very low	29.2	Very low	185 Å²	185	140.8 Å²	140.8	86%	0.864	77%	0.767	S	S	*	*			trans	67.9	151.6	174.4	-67.5	-162.2	145.1	0	0	119.2
694	A	28.3	Very low	29.3	Very low	90 Å²	90	140.7 Å²	140.7	74%	0.744	77%	0.767	S	S	*	*			cis	-152.6	-176.5	0.8	0	0	0	0	0	113.6
695	H	28.2	Very low	29.8	Very low	183 Å²	183	142.8 Å²	142.8	85%	0.847	77%	0.77	S	S	*	*			trans	-75.1	162.9	-168.3	-45.9	-42.2	0	0	0	118.8
696	A	29.3	Very low	29.8	Very low	99 Å²	99	142.2 Å²	142.2	82%	0.818	76%	0.762	S	S	*	*			trans	-153.7	161	140	0	0	0	0	0	111
697	N	30.3	Very low	29.8	Very low	139 Å²	139	145 Å²	145	74%	0.743	77%	0.765	S	S	*	*			trans	-127.6	165.5	-165	-76.4	-37.9	0	0	0	115.8
698	N	29.6	Very low	29.7	Very low	152 Å²	152	141.4 Å²	141.4	81%	0.813	77%	0.766	S	S	*	*			trans	92.3	141.9	145.8	-68.6	-27.6	0	0	0	122.8
699	A	31.4	Very low	29.5	Very low	99 Å²	99	140.3 Å²	140.3	82%	0.818	77%	0.773	S	S	*	*			trans	71.8	144	149.1	0	0	0	0	0	119.6
700	M	27.6	Very low	29.5	Very low	185 Å²	185	140.3 Å²	140.3	91%	0.911	78%	0.777	S	S	*	*			cis	-162	157.1	-18.5	-177.1	158.9	173.2	0	0	109.7
701	L	29.4	Very low	29.5	Very low	137 Å²	137	140.6 Å²	140.6	72%	0.717	78%	0.779	S	S	*	*			trans	-68.8	157.8	176.4	-78.4	157.1	0	0	0	113	L703	L701-L703 HydrophobicContact CD2-CG 4.39Å
702	P	35.5	Very low	29.3	Very low	125 Å²	125	137.9 Å²	137.9	81%	0.812	77%	0.772	S	S	*	*				-136.4	160.8	95.8	34.1	-20.4	0	0	0	115.3
703	L	28.1	Very low	29.3	Very low	149 Å²	149	136.2 Å²	136.2	78%	0.78	77%	0.773	S	S	*	*			trans	-104.1	167.2	171	-73.6	164.4	0	0	0	110.8	L701	L701-L703 HydrophobicContact CD2-CG 4.39Å
704	L	30.4	Very low	29.3	Very low	162 Å²	162	133.9 Å²	133.9	85%	0.848	77%	0.765	S	S	*	*			trans	139.2	158.4	153.2	-73.3	163.1	0	0	0	111.3
705	P	40.7	Very low	29.6	Very low	99 Å²	99	144.5 Å²	144.5	64%	0.643	79%	0.786	S	S	*	*				-145	-179.8	-62.5	43.6	-25.9	0	0	0	115.9
706	R	28.4	Very low	29.7	Very low	200 Å²	200	142.6 Å²	142.6	76%	0.755	78%	0.783	S	S	*	*			trans	67	125.5	156.1	-65.4	-180	84.4	148	5.8	121.5
707	E	26	Very low	29.7	Very low	142 Å²	142	144.9 Å²	144.9	66%	0.664	78%	0.781	S	S	*	*			trans	68	152.1	138.8	-70.5	169.6	-127.3	0	0	119.3
708	T	27.3	Very low	29.7	Very low	127 Å²	127	145.2 Å²	145.2	78%	0.779	78%	0.784	S	S	*	*			cis	-136.2	177.9	7.6	-3.7	0	0	0	0	112.9
709	S	24.8	Very low	29.7	Very low	105 Å²	105	144.8 Å²	144.8	73%	0.734	78%	0.782	S	S	*	*			trans	-74.2	153.5	-179.1	55.1	0	0	0	0	117.3
710	I	29.6	Very low	29.5	Very low	161 Å²	161	147.7 Å²	147.7	83%	0.826	78%	0.78	S	S	*	*			trans	-156	116.2	145.8	-95.8	144.5	0	0	0	105.6
711	S	26.8	Very low	29.7	Very low	95 Å²	95	145.2 Å²	145.2	66%	0.664	77%	0.771	S	S	*	*				56.2	115.1	91.8	162.7	0	0	0	0	113.2
712	S	25.2	Very low	29.7	Very low	90 Å²	90	145.8 Å²	145.8	63%	0.629	78%	0.775	S	S	*	*			cis	104.1	95.5	29.4	72.7	0	0	0	0	114.4
713	V	28.2	Very low	29.3	Very low	136 Å²	136	147.4 Å²	147.4	82%	0.824	77%	0.772	S	S	*	*			trans	-150.6	110.3	156.4	175.6	0	0	0	0	104.6
714	I	29.9	Very low	29.3	Very low	136 Å²	136	147.3 Å²	147.3	70%	0.697	77%	0.771	S	S	*	*				74.7	107.4	51.9	-56.8	170.2	0	0	0	112.8
715	W	34.8	Very low	29.2	Very low	314 Å²	314	145.9 Å²	145.9	100%	1.189	76%	0.764	S	S	*	*				-150.9	0	120	-97.9	98.3	0	0	0	108.8

Retrieved 715 of 715 residues in 251.1 ms (Link to these results)

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