A0A087XBM1_POEFO Loading...

Hexosyltransferase

AlphaFold DB , UniProt , Accession A0A087XBM1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 430 aa.

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(Predicted Aligned Error values between residue pairs)

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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	35.8	Very low	38	Very low	243 Å²	243	199.5 Å²	199.5	100%	1.197	92%	0.921	S	S	*	*				0	115.4	0	-75.6	177.8	173.9	0	0	108.3
2	Q	33.8	Very low	38.8	Very low	201 Å²	201	199.3 Å²	199.3	94%	0.939	92%	0.916	S	S	*	*			trans	-85.4	143.8	-167.6	-85.9	170.8	-26.3	0	0	113.5
3	W	28.8	Very low	39.4	Very low	256 Å²	256	192.1 Å²	192.1	97%	0.97	89%	0.885	S	S	*	*			trans	-67.6	142.6	176.3	-80.7	61.5	0	0	0	113.5
4	R	36.8	Very low	41.1	Very low	239 Å²	239	184.1 Å²	184.1	90%	0.902	86%	0.857	S	S	*	*			trans	-110.8	129.1	165.4	-86.1	-172.2	174.8	-154.3	-1.5	111
5	R	39.3	Very low	41.8	Very low	238 Å²	238	185.2 Å²	185.2	90%	0.898	85%	0.851	S	S	*	*			trans	-81.7	146.6	165.7	-74.2	-178.9	178.3	-168	-0.6	110.8
6	R	41	Very low	42.7	Very low	244 Å²	244	180.3 Å²	180.3	92%	0.921	84%	0.839	S	S	*	*			trans	-132.7	140.3	153.6	-84.6	-171.9	174.8	-173.1	-0.8	109.8
7	H	41.3	Very low	43.6	Very low	191 Å²	191	174.4 Å²	174.4	88%	0.884	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-76.6	148.3	-171.2	-81.8	-90.8	0	0	0	114.3
8	L	38.3	Very low	44.3	Very low	175 Å²	175	172 Å²	172	92%	0.916	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-81	144.2	166.6	-87.2	111.3	0	0	0	111.9
9	C	36.3	Very low	44.9	Very low	123 Å²	123	171.7 Å²	171.7	83%	0.831	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-100.6	128.4	175.4	-154.5	0	0	0	0	110.1
10	S	39.2	Very low	45.6	Very low	117 Å²	117	166.8 Å²	166.8	82%	0.818	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-91.1	118.4	174.2	-83.5	0	0	0	0	110.9	K12	S10-K12 PolarHBondContact O-N 3.49Å
11	I	46.8	Very low	46.2	Very low	167 Å²	167	162.5 Å²	162.5	86%	0.856	76%	0.759	S	S	*	*			trans	-76.5	112.6	172.5	-64.1	170.6	0	0	0	108.9
12	K	48.5	Very low	47.6	Very low	198 Å²	198	158 Å²	158	86%	0.861	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-83.7	119.5	169.6	-86.8	-179.6	175.8	176	0	109.9	S10	S10-K12 PolarHBondContact O-N 3.49Å
13	M	46.3	Very low	49.1	Very low	105 Å²	105	157.7 Å²	157.7	52%	0.517	72%	0.723	S	S	.	*	P	Polyproline II helix	trans	-76.8	126.1	177.1	-144.1	162.2	117.5	0	0	110.5	I17 L21	M13-I17 HydrophobicContact CE-CG2 3.78Å; M13-I17 HydrophobicContact CG-CB 4.49Å; M13-I17 HydrophobicContact CG-CD1 4.4Å; M13-I17 HydrophobicContact CG-CG2 4.38Å; M13-L21 HydrophobicContact CE-CD1 3.78Å
14	T	63.3	Low	50.9	Low	80 Å²	80	149.4 Å²	149.4	49%	0.491	70%	0.701	S	S	.	*	P	Polyproline II helix	trans	-76.6	152.5	-174.9	53.2	0	0	0	0	112.8	T16 I17	T14-T16 PolarHBondContact O-N 3.5Å; T14-T16 VanDerWaalsContact O-N 3.15Å; T14-I17 PolarHBondContact O-N 2.92Å; T14-I17 VanDerWaalsContact O-N 3.09Å
15	W	51.7	Low	52.6	Low	201 Å²	201	143.8 Å²	143.8	76%	0.761	69%	0.685	S	S	*	*	H	α-helix	trans	-58.9	-27.8	-172.1	-151.9	81.6	0	0	0	113.8	R19	W15-R19 PolarHBondContact O-N 2.95Å
16	T	55.6	Low	54.4	Low	107 Å²	107	135.1 Å²	135.1	66%	0.656	66%	0.658	S	S	*	*	H	α-helix	trans	-66.3	-35.9	176.3	11.4	0	0	0	0	113.3	T14 R19 S20	T14-T16 PolarHBondContact O-N 3.5Å; T14-T16 VanDerWaalsContact O-N 3.15Å; T16-R19 PolarHBondContact O-N 3.31Å; T16-S20 PolarHBondContact O-N 3.36Å
17	I	58.8	Low	56.2	Low	80 Å²	80	126.3 Å²	126.3	41%	0.41	64%	0.638	S	S	.	*	H	α-helix	trans	-72.7	-38.1	179.9	-59.7	174.9	0	0	0	110.3	M13 T14 R19 S20 L21	M13-I17 HydrophobicContact CE-CG2 3.78Å; M13-I17 HydrophobicContact CG-CB 4.49Å; M13-I17 HydrophobicContact CG-CD1 4.4Å; M13-I17 HydrophobicContact CG-CG2 4.38Å; T14-I17 PolarHBondContact O-N 2.92Å; T14-I17 VanDerWaalsContact O-N 3.09Å; I17-R19 VanDerWaalsContact C-N 3.32Å; I17-R19 PolarHBondContact O-N 2.97Å; I17-S20 PolarHBondContact O-N 3.41Å; I17-L21 HydrophobicContact CG2-CD1 4.07Å; I17-L21 PolarHBondContact O-N 3.17Å
18	K	55.9	Low	58.1	Low	131 Å²	131	118.9 Å²	118.9	57%	0.57	61%	0.613	S	S	*	*	H	α-helix	trans	-62.4	-37.1	174.7	-71.8	-176	177	-177.1	0	112.4	F22	K18-F22 WeakPolarHBondContact O-CB 3.49Å; K18-F22 PolarHBondContact O-N 3.49Å
19	R	55.2	Low	60.1	Low	167 Å²	167	116.3 Å²	116.3	63%	0.63	60%	0.599	S	S	*	*	H	α-helix	trans	-72.2	-31.7	178.7	-155.8	173.9	-179.9	-171.4	0.3	112.9	W15 T16 I17 R23	W15-R19 PolarHBondContact O-N 2.95Å; T16-R19 PolarHBondContact O-N 3.31Å; I17-R19 VanDerWaalsContact C-N 3.32Å; I17-R19 PolarHBondContact O-N 2.97Å; R19-R23 PolarHBondContact O-N 3.07Å; R19-R23 VanDerWaalsContact O-N 3.11Å
20	S	60	Low	62.4	Low	73 Å²	73	116 Å²	116	51%	0.51	59%	0.589	S	S	.	*	H	α-helix	trans	-72.2	-43.9	174.7	-172.5	0	0	0	0	112.3	T16 I17 R23 T24	T16-S20 PolarHBondContact O-N 3.36Å; I17-S20 PolarHBondContact O-N 3.41Å; S20-R23 PolarHBondContact O-N 3.34Å; S20-T24 PolarHBondContact O-N 3.29Å; S20-T24 PolarHBondContact O-OG1 3.35Å
21	L	57.9	Low	64.4	Low	77 Å²	77	113.8 Å²	113.8	40%	0.403	57%	0.573	S	S	.	*	H	α-helix	trans	-62.5	-42.5	172.7	-80.6	158.8	0	0	0	111.5	M13 I17 R23 T24 H25	M13-L21 HydrophobicContact CE-CD1 3.78Å; I17-L21 HydrophobicContact CG2-CD1 4.07Å; I17-L21 PolarHBondContact O-N 3.17Å; L21-R23 PolarHBondContact O-N 3.06Å; L21-T24 WeakPolarHBondContact CA-OG1 3.29Å; L21-T24 PolarHBondContact O-N 3.09Å; L21-T24 PolarHBondContact O-OG1 3Å; L21-H25 PolarHBondContact O-CD2 3.05Å; L21-H25 PolarHBondContact O-N 3.39Å
22	F	64.8	Low	66.2	Low	147 Å²	147	111.4 Å²	111.4	65%	0.645	56%	0.561	S	S	*	*	H	α-helix	trans	-62.8	-40.8	176.7	-167.2	-101	0	0	0	112.5	K18 H25 V26	K18-F22 WeakPolarHBondContact O-CB 3.49Å; K18-F22 PolarHBondContact O-N 3.49Å; F22-H25 PolarHBondContact O-N 3.41Å; F22-V26 HydrophobicContact CD1-CG2 4.03Å; F22-V26 HydrophobicContact CE1-CG2 3.77Å; F22-V26 HydrophobicContact CZ-CG2 4.04Å; F22-V26 WeakPolarHBondContact O-CB 3.5Å; F22-V26 WeakPolarHBondContact O-CG2 3.49Å; F22-V26 PolarHBondContact O-N 2.82Å
23	R	64.3	Low	68.1	Low	195 Å²	195	104.5 Å²	104.5	74%	0.736	54%	0.541	S	S	*	.	H	α-helix	trans	-65.3	-39	176.6	-87.8	-177.6	140.5	-166	-5.7	113.6	R19 S20 L21 A27	R19-R23 PolarHBondContact O-N 3.07Å; R19-R23 VanDerWaalsContact O-N 3.11Å; S20-R23 PolarHBondContact O-N 3.34Å; L21-R23 PolarHBondContact O-N 3.06Å; R23-A27 WeakPolarHBondContact O-CB 3.48Å; R23-A27 PolarHBondContact O-N 3.43Å
24	T	68.4	Low	70	Confident	82 Å²	82	105.1 Å²	105.1	50%	0.503	55%	0.546	S	S	.	.	H	α-helix	trans	-71.3	-38.2	178.5	47.3	0	0	0	0	111.9	S20 L21 G28	S20-T24 PolarHBondContact O-N 3.29Å; S20-T24 PolarHBondContact O-OG1 3.35Å; L21-T24 WeakPolarHBondContact CA-OG1 3.29Å; L21-T24 PolarHBondContact O-N 3.09Å; L21-T24 PolarHBondContact O-OG1 3Å; T24-G28 PolarHBondContact O-N 3.21Å
25	H	71.3	Confident	70.9	Confident	121 Å²	121	106.9 Å²	106.9	56%	0.56	55%	0.552	S	S	*	*	H	α-helix	trans	-68.2	-39.1	173.6	-72.5	-61.1	0	0	0	113	L21 F22 G28 L29	L21-H25 PolarHBondContact O-CD2 3.05Å; L21-H25 PolarHBondContact O-N 3.39Å; F22-H25 PolarHBondContact O-N 3.41Å; H25-G28 PolarHBondContact O-N 3.41Å; H25-L29 WeakPolarHBondContact O-CB 3.39Å; H25-L29 WeakPolarHBondContact O-CG 3.4Å; H25-L29 PolarHBondContact O-N 2.88Å
26	V	78.1	Confident	72.5	Confident	57 Å²	57	103.5 Å²	103.5	35%	0.345	54%	0.543	S	S	.	.	H	α-helix	trans	-67.4	-41.2	175.7	171.8	0	0	0	0	111.4	F22 L29 L30	F22-V26 HydrophobicContact CD1-CG2 4.03Å; F22-V26 HydrophobicContact CE1-CG2 3.77Å; F22-V26 HydrophobicContact CZ-CG2 4.04Å; F22-V26 WeakPolarHBondContact O-CB 3.5Å; F22-V26 WeakPolarHBondContact O-CG2 3.49Å; F22-V26 PolarHBondContact O-N 2.82Å; V26-L29 PolarHBondContact O-N 2.98Å; V26-L30 HydrophobicContact CG1-CD1 4.05Å; V26-L30 WeakPolarHBondContact O-CG 3.39Å; V26-L30 PolarHBondContact O-N 3.47Å
27	A	77.3	Confident	73.7	Confident	59 Å²	59	102.3 Å²	102.3	49%	0.488	54%	0.535	S	S	.	.	H	α-helix	trans	-63.8	-40.2	174.7	0	0	0	0	0	112.2	R23 L30 S31	R23-A27 WeakPolarHBondContact O-CB 3.48Å; R23-A27 PolarHBondContact O-N 3.43Å; A27-L30 PolarHBondContact O-N 2.96Å; A27-S31 WeakPolarHBondContact O-CB 3.4Å; A27-S31 PolarHBondContact O-N 2.05Å
28	G	81.3	Confident	74.9	Confident	35 Å²	35	101.5 Å²	101.5	36%	0.361	53%	0.534	S	S	.	.	H	α-helix	trans	-63.1	-42.9	174.5	0	0	0	0	0	113	T24 H25 S31 L32	T24-G28 PolarHBondContact O-N 3.21Å; H25-G28 PolarHBondContact O-N 3.41Å; G28-S31 PolarHBondContact O-N 3.29Å; G28-L32 PolarHBondContact O-N 3.21Å
29	L	82	Confident	76	Confident	121 Å²	121	102.1 Å²	102.1	63%	0.634	54%	0.537	S	S	*	.	H	α-helix	trans	-64.9	-41.2	176.6	-81	163.4	0	0	0	112.5	H25 V26 S31 L32 A33	H25-L29 WeakPolarHBondContact O-CB 3.39Å; H25-L29 WeakPolarHBondContact O-CG 3.4Å; H25-L29 PolarHBondContact O-N 2.88Å; V26-L29 PolarHBondContact O-N 2.98Å; L29-S31 VanDerWaalsContact C-N 3.34Å; L29-L32 PolarHBondContact O-N 3.4Å; L29-A33 WeakPolarHBondContact O-CB 3.42Å; L29-A33 PolarHBondContact O-N 3Å
30	L	83.6	Confident	77.2	Confident	117 Å²	117	97.7 Å²	97.7	61%	0.613	53%	0.525	S	S	*	.	H	α-helix	trans	-65.6	-37.6	175.6	-72.7	169.8	0	0	0	111.9	V26 A27 A33 L34	V26-L30 HydrophobicContact CG1-CD1 4.05Å; V26-L30 WeakPolarHBondContact O-CG 3.39Å; V26-L30 PolarHBondContact O-N 3.47Å; A27-L30 PolarHBondContact O-N 2.96Å; L30-A33 PolarHBondContact O-N 3.4Å; L30-L34 WeakPolarHBondContact O-CB 3.33Å; L30-L34 PolarHBondContact O-N 3.16Å
31	S	82.1	Confident	77.9	Confident	69 Å²	69	100.6 Å²	100.6	48%	0.483	53%	0.529	S	S	.	.	H	α-helix	trans	-68.5	-39.9	177	-162.1	0	0	0	0	112.2	A27 G28 L29 L34 L35	A27-S31 WeakPolarHBondContact O-CB 3.4Å; A27-S31 PolarHBondContact O-N 2.05Å; G28-S31 PolarHBondContact O-N 3.29Å; L29-S31 VanDerWaalsContact C-N 3.34Å; S31-L34 PolarHBondContact O-N 3.23Å; S31-L35 WeakPolarHBondContact O-CG 3.25Å; S31-L35 PolarHBondContact O-N 3.43Å
32	L	84.1	Confident	78.3	Confident	117 Å²	117	103.4 Å²	103.4	61%	0.613	54%	0.538	S	S	*	.	H	α-helix	trans	-64.5	-41.5	172.5	-88.7	156	0	0	0	112.4	G28 L29 L34 L35 F36	G28-L32 PolarHBondContact O-N 3.21Å; L29-L32 PolarHBondContact O-N 3.4Å; L32-L34 VanDerWaalsContact C-N 3.31Å; L32-L34 PolarHBondContact O-N 3.36Å; L32-L35 PolarHBondContact O-N 3.49Å; L32-F36 WeakPolarHBondContact O-CB 3.24Å; L32-F36 PolarHBondContact O-N 3.37Å
33	A	87.8	Confident	78.3	Confident	53 Å²	53	99.1 Å²	99.1	44%	0.438	53%	0.527	S	S	.	.	H	α-helix	trans	-62.6	-39.6	175.1	0	0	0	0	0	111.5	L29 L30 F36 T37	L29-A33 WeakPolarHBondContact O-CB 3.42Å; L29-A33 PolarHBondContact O-N 3Å; L30-A33 PolarHBondContact O-N 3.4Å; A33-F36 PolarHBondContact O-N 3.02Å; A33-T37 WeakPolarHBondContact O-CG2 3.08Å; A33-T37 PolarHBondContact O-N 3.48Å; A33-T37 PolarHBondContact O-OG1 2.97Å
34	L	85.9	Confident	77.9	Confident	119 Å²	119	96.1 Å²	96.1	62%	0.623	52%	0.521	S	S	*	.	H	α-helix	trans	-70	-38.1	178.3	-150.4	124.5	0	0	0	112.4	L30 S31 L32 F36 T37 V38	L30-L34 WeakPolarHBondContact O-CB 3.33Å; L30-L34 PolarHBondContact O-N 3.16Å; S31-L34 PolarHBondContact O-N 3.23Å; L32-L34 VanDerWaalsContact C-N 3.31Å; L32-L34 PolarHBondContact O-N 3.36Å; L34-F36 VanDerWaalsContact C-N 3.34Å; L34-T37 WeakPolarHBondContact CA-OG1 3.06Å; L34-T37 PolarHBondContact O-OG1 2.97Å; L34-V38 WeakPolarHBondContact O-CB 3.43Å; L34-V38 WeakPolarHBondContact O-CG2 3.46Å; L34-V38 PolarHBondContact O-N 3.42Å
35	L	83.2	Confident	76.9	Confident	116 Å²	116	98.2 Å²	98.2	61%	0.607	53%	0.525	S	S	*	.	H	α-helix	trans	-65.8	-37.7	172.5	-76.8	167.2	0	0	0	111.8	S31 L32 F39	S31-L35 WeakPolarHBondContact O-CG 3.25Å; S31-L35 PolarHBondContact O-N 3.43Å; L32-L35 PolarHBondContact O-N 3.49Å; L35-F39 WeakPolarHBondContact O-CB 3.5Å; L35-F39 PolarHBondContact O-N 2.86Å
36	F	85.6	Confident	75.7	Confident	131 Å²	131	100.8 Å²	100.8	58%	0.575	54%	0.537	S	S	*	.	H	α-helix	trans	-69.5	-39.6	176.9	-170.2	-105.7	0	0	0	112.2	L32 A33 L34 F39 L40	L32-F36 WeakPolarHBondContact O-CB 3.24Å; L32-F36 PolarHBondContact O-N 3.37Å; A33-F36 PolarHBondContact O-N 3.02Å; L34-F36 VanDerWaalsContact C-N 3.34Å; F36-F39 PolarHBondContact O-N 3.48Å; F36-L40 HydrophobicContact CD1-CD1 3.86Å; F36-L40 HydrophobicContact CD1-CG 4.34Å; F36-L40 HydrophobicContact CE1-CD1 3.51Å; F36-L40 HydrophobicContact CE1-CG 4.09Å; F36-L40 HydrophobicContact CZ-CD1 4.17Å; F36-L40 HydrophobicContact CZ-CD2 4.46Å; F36-L40 HydrophobicContact CZ-CG 4.35Å; F36-L40 WeakPolarHBondContact O-CG 3.41Å; F36-L40 PolarHBondContact O-N 3.47Å
37	T	81.3	Confident	74	Confident	81 Å²	81	108.4 Å²	108.4	50%	0.497	56%	0.56	S	S	.	*	H	α-helix	trans	-67.7	-37.1	174.6	55.1	0	0	0	0	112.3	A33 L34 L40 F41	A33-T37 WeakPolarHBondContact O-CG2 3.08Å; A33-T37 PolarHBondContact O-N 3.48Å; A33-T37 PolarHBondContact O-OG1 2.97Å; L34-T37 WeakPolarHBondContact CA-OG1 3.06Å; L34-T37 PolarHBondContact O-OG1 2.97Å; T37-L40 PolarHBondContact O-N 2.98Å; T37-F41 WeakPolarHBondContact O-CB 3.35Å; T37-F41 PolarHBondContact O-N 2.99Å
38	V	82.3	Confident	71.9	Confident	63 Å²	63	112.5 Å²	112.5	38%	0.382	57%	0.573	S	S	.	*	H	α-helix	trans	-64.6	-42.1	172.4	170.8	0	0	0	0	111	L34 F41 F42	L34-V38 WeakPolarHBondContact O-CB 3.43Å; L34-V38 WeakPolarHBondContact O-CG2 3.46Å; L34-V38 PolarHBondContact O-N 3.42Å; V38-F41 WeakPolarHBondContact O-CB 3.41Å; V38-F41 PolarHBondContact O-N 3.4Å; V38-F42 HydrophobicContact CG1-CD2 3.59Å; V38-F42 HydrophobicContact CG1-CE2 3.44Å; V38-F42 VanDerWaalsContact CG1-CE2 3.44Å; V38-F42 WeakPolarHBondContact O-CD2 3.5Å; V38-F42 PolarHBondContact O-N 3.41Å
39	F	80.6	Confident	69.9	Low	144 Å²	144	117.2 Å²	117.2	63%	0.632	60%	0.597	S	S	*	*	H	α-helix	trans	-63.5	-40.8	174.9	-173.8	-94.6	0	0	0	112.4	L35 F36 F41 F42 S43	L35-F39 WeakPolarHBondContact O-CB 3.5Å; L35-F39 PolarHBondContact O-N 2.86Å; F36-F39 PolarHBondContact O-N 3.48Å; F39-F41 VanDerWaalsContact C-N 3.35Å; F39-F42 PolarHBondContact O-N 3.01Å; F39-S43 WeakPolarHBondContact O-CB 3.07Å; F39-S43 PolarHBondContact O-N 3.24Å; F39-S43 PolarHBondContact O-OG 3.47Å
40	L	78.8	Confident	68.1	Low	74 Å²	74	114.8 Å²	114.8	39%	0.387	60%	0.601	S	S	.	*	H	α-helix	trans	-64.3	-38.2	172.7	-72.8	178.3	0	0	0	112	F36 T37 S43 H44	F36-L40 HydrophobicContact CD1-CD1 3.86Å; F36-L40 HydrophobicContact CD1-CG 4.34Å; F36-L40 HydrophobicContact CE1-CD1 3.51Å; F36-L40 HydrophobicContact CE1-CG 4.09Å; F36-L40 HydrophobicContact CZ-CD1 4.17Å; F36-L40 HydrophobicContact CZ-CD2 4.46Å; F36-L40 HydrophobicContact CZ-CG 4.35Å; F36-L40 WeakPolarHBondContact O-CG 3.41Å; F36-L40 PolarHBondContact O-N 3.47Å; T37-L40 PolarHBondContact O-N 2.98Å; L40-S43 VanDerWaalsContact CA-OG 3.27Å; L40-S43 WeakPolarHBondContact CA-OG 3.13Å; L40-S43 PolarHBondContact O-N 3.47Å; L40-S43 PolarHBondContact O-OG 2.99Å; L40-H44 WeakPolarHBondContact O-CB 3.44Å; L40-H44 PolarHBondContact O-N 2.85Å
41	F	75.7	Confident	65.6	Low	135 Å²	135	121.2 Å²	121.2	59%	0.592	62%	0.617	S	S	*	*	H	α-helix	trans	-64.9	-42.4	175.8	-173.5	-96.7	0	0	0	112.4	T37 V38 F39 Q45	T37-F41 WeakPolarHBondContact O-CB 3.35Å; T37-F41 PolarHBondContact O-N 2.99Å; V38-F41 WeakPolarHBondContact O-CB 3.41Å; V38-F41 PolarHBondContact O-N 3.4Å; F39-F41 VanDerWaalsContact C-N 3.35Å; F41-Q45 PolarHBondContact O-N 3.4Å
42	F	65.1	Low	63.6	Low	136 Å²	136	124.4 Å²	124.4	60%	0.596	64%	0.64	S	S	*	*	H	α-helix	trans	-72.5	-31.8	176.3	-77.6	-66.1	0	0	0	113.4	V38 F39	V38-F42 HydrophobicContact CG1-CD2 3.59Å; V38-F42 HydrophobicContact CG1-CE2 3.44Å; V38-F42 VanDerWaalsContact CG1-CE2 3.44Å; V38-F42 WeakPolarHBondContact O-CD2 3.5Å; V38-F42 PolarHBondContact O-N 3.41Å; F39-F42 PolarHBondContact O-N 3.01Å
43	S	65.5	Low	61.1	Low	57 Å²	57	121.5 Å²	121.5	40%	0.399	64%	0.638	S	S	.	*	H	α-helix	trans	-77.9	-28.5	174.8	51.2	0	0	0	0	113.1	F39 L40	F39-S43 WeakPolarHBondContact O-CB 3.07Å; F39-S43 PolarHBondContact O-N 3.24Å; F39-S43 PolarHBondContact O-OG 3.47Å; L40-S43 VanDerWaalsContact CA-OG 3.27Å; L40-S43 WeakPolarHBondContact CA-OG 3.13Å; L40-S43 PolarHBondContact O-N 3.47Å; L40-S43 PolarHBondContact O-OG 2.99Å
44	H	55	Low	58.5	Low	132 Å²	132	125 Å²	125	61%	0.611	66%	0.656	S	S	*	*	H	α-helix	trans	-78.9	-17.1	173.1	-105.6	-80.8	0	0	0	114.5	L40 E46 W47	L40-H44 WeakPolarHBondContact O-CB 3.44Å; L40-H44 PolarHBondContact O-N 2.85Å; H44-E46 PolarHBondContact O-N 2.51Å; H44-W47 PolarHBondContact O-N 3.29Å
45	Q	49.1	Very low	55.9	Low	126 Å²	126	128.9 Å²	128.9	59%	0.589	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-13.8	171.9	-83.9	-141.1	-33.7	0	0	113.6	F41 W47	F41-Q45 PolarHBondContact O-N 3.4Å; Q45-W47 VanDerWaalsContact C-N 3.3Å
46	E	44.4	Very low	53.4	Low	174 Å²	174	129.6 Å²	129.6	81%	0.813	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-2.5	172.7	-66.9	-153.9	152.1	0	0	114	H44	H44-E46 PolarHBondContact O-N 2.51Å
47	W	42.6	Very low	50.8	Low	218 Å²	218	130 Å²	130	83%	0.826	67%	0.666	S	S	*	*			trans	-129.1	56.5	-178.4	-118.5	61.6	0	0	0	113	H44 Q45	H44-W47 PolarHBondContact O-N 3.29Å; Q45-W47 VanDerWaalsContact C-N 3.3Å
48	L	34	Very low	48.7	Very low	145 Å²	145	132.2 Å²	132.2	76%	0.759	68%	0.681	S	S	*	*			trans	-114.1	113.2	156.8	-74.9	171.9	0	0	0	108.7	G50	L48-G50 PolarHBondContact O-N 3.26Å
49	P	39.7	Very low	46.4	Very low	133 Å²	133	134 Å²	134	86%	0.864	69%	0.688	S	S	*	*			trans	-78.1	115.5	175.6	30.5	-28.5	0	0	0	108.8
50	G	43.4	Very low	44.2	Very low	71 Å²	71	131.6 Å²	131.6	73%	0.732	70%	0.695	S	S	*	*			trans	131.2	81.4	164.2	0	0	0	0	0	115.6	L48	L48-G50 PolarHBondContact O-N 3.26Å
51	R	30.9	Very low	41.8	Very low	251 Å²	251	136.1 Å²	136.1	95%	0.947	71%	0.708	S	S	*	*			trans	-170	104.7	139	-106.1	173.3	-173.9	-168.2	2.2	108.7	G53	R51-G53 PolarHBondContact O-N 3.44Å
52	S	41.3	Very low	39.7	Very low	137 Å²	137	135.7 Å²	135.7	96%	0.958	72%	0.716	S	S	*	*			trans	-70.9	105.1	171.2	31.2	0	0	0	0	109.8
53	G	30.7	Very low	38	Very low	55 Å²	55	137 Å²	137	57%	0.567	73%	0.728	S	S	*	*			trans	-130.2	149.3	165.4	0	0	0	0	0	109.5	R51 R55	R51-G53 PolarHBondContact O-N 3.44Å; G53-R55 PolarHBondContact O-N 2.96Å
54	P	34.2	Very low	36.3	Very low	126 Å²	126	145.6 Å²	145.6	82%	0.818	75%	0.751	S	S	*	*			trans	-68.8	125.1	-174.5	28.4	-31.8	0	0	0	109.9	D56	P54-D56 PolarHBondContact O-N 2.81Å; P54-D56 VanDerWaalsContact O-N 3.16Å
55	R	30	Very low	35	Very low	202 Å²	202	142.7 Å²	142.7	76%	0.762	76%	0.758	S	S	*	*			trans	-66.8	105.4	176.7	-82.9	174.3	167.6	-175.7	-1.6	110.1	G53 Y57	G53-R55 PolarHBondContact O-N 2.96Å; R55-Y57 HydrophobicContact CB-CD2 4.03Å; R55-Y57 HydrophobicContact CB-CE2 3.8Å; R55-Y57 WeakPolarHBondContact CD-OH 3.33Å; R55-Y57 HydrophobicContact CG-CE2 4.18Å; R55-Y57 PolarHBondContact NE-OH 2.99Å; R55-Y57 PolarHBondContact NH1-OH 2.77Å; R55-Y57 VanDerWaalsContact NH1-OH 3.08Å; R55-Y57 PolarHBondContact O-N 2.92Å
56	D	32	Very low	34.1	Very low	130 Å²	130	145.1 Å²	145.1	70%	0.695	77%	0.774	S	S	*	*			trans	-72.7	114.7	159.1	-79.2	-30.7	0	0	0	107.7	P54 K198	P54-D56 PolarHBondContact O-N 2.81Å; P54-D56 VanDerWaalsContact O-N 3.16Å; D56-K198 IonicContact OD2-NZ 2.74Å; D56-K198 PolarHBondContact OD2-NZ 3.29Å
57	Y	30.6	Very low	33.3	Very low	141 Å²	141	148.3 Å²	148.3	55%	0.553	78%	0.778	S	S	*	*			trans	-112.6	121.3	169.7	-80.2	-71.3	0	0	0	109.7	R55 L59	R55-Y57 HydrophobicContact CB-CD2 4.03Å; R55-Y57 HydrophobicContact CB-CE2 3.8Å; R55-Y57 WeakPolarHBondContact CD-OH 3.33Å; R55-Y57 HydrophobicContact CG-CE2 4.18Å; R55-Y57 PolarHBondContact NE-OH 2.99Å; R55-Y57 PolarHBondContact NH1-OH 2.77Å; R55-Y57 VanDerWaalsContact NH1-OH 3.08Å; R55-Y57 PolarHBondContact O-N 2.92Å; Y57-L59 HydrophobicContact CD1-CD1 4.04Å; Y57-L59 HydrophobicContact CD1-CG 4.45Å; Y57-L59 HydrophobicContact CG-CD1 3.92Å; Y57-L59 HydrophobicContact CG-CG 4.5Å; Y57-L59 PolarHBondContact O-N 3.42Å
58	P	37.9	Very low	32.5	Very low	126 Å²	126	142.4 Å²	142.4	82%	0.818	78%	0.776	S	S	*	*			trans	-84.4	102.1	160.7	31.5	-23.8	0	0	0	107.4
59	L	33.1	Very low	32.2	Very low	101 Å²	101	141.5 Å²	141.5	53%	0.529	78%	0.779	S	S	.	*			trans	-121.5	98.4	179.4	-74.2	167.2	0	0	0	111.3	Y57 Y61	Y57-L59 HydrophobicContact CD1-CD1 4.04Å; Y57-L59 HydrophobicContact CD1-CG 4.45Å; Y57-L59 HydrophobicContact CG-CD1 3.92Å; Y57-L59 HydrophobicContact CG-CG 4.5Å; Y57-L59 PolarHBondContact O-N 3.42Å; L59-Y61 HydrophobicContact CB-CD2 4.05Å; L59-Y61 HydrophobicContact CB-CE2 3.79Å; L59-Y61 HydrophobicContact CD1-CE2 4.02Å; L59-Y61 HydrophobicContact CD2-CE2 4.15Å; L59-Y61 HydrophobicContact CG-CE2 4.19Å
60	A	33.5	Very low	31.6	Very low	93 Å²	93	145.2 Å²	145.2	77%	0.769	78%	0.781	S	S	*	*			trans	-66.3	122.8	153.3	0	0	0	0	0	108.7
61	Y	29.9	Very low	30.8	Very low	170 Å²	170	145.4 Å²	145.4	67%	0.667	78%	0.783	S	S	*	*			trans	-117.3	124.6	165	-84.1	-77.5	0	0	0	110.4	L59	L59-Y61 HydrophobicContact CB-CD2 4.05Å; L59-Y61 HydrophobicContact CB-CE2 3.79Å; L59-Y61 HydrophobicContact CD1-CE2 4.02Å; L59-Y61 HydrophobicContact CD2-CE2 4.15Å; L59-Y61 HydrophobicContact CG-CE2 4.19Å
62	T	30	Very low	30.5	Very low	125 Å²	125	143 Å²	143	77%	0.767	78%	0.783	S	S	*	*			trans	-65.1	120.8	164.4	31.5	0	0	0	0	109.6	R64	T62-R64 PolarHBondContact O-N 3.24Å; T62-R64 VanDerWaalsContact O-N 3.13Å
63	I	31	Very low	29.8	Very low	164 Å²	164	140.2 Å²	140.2	84%	0.841	77%	0.768	S	S	*	*			trans	-77	99.9	168.5	-63.5	177.4	0	0	0	107.6
64	R	28.2	Very low	29.5	Very low	237 Å²	237	145.8 Å²	145.8	89%	0.894	79%	0.785	S	S	*	*			trans	-88.3	119.2	158.5	-127.5	180	-173.6	-174.5	2.1	107	T62 L66	T62-R64 PolarHBondContact O-N 3.24Å; T62-R64 VanDerWaalsContact O-N 3.13Å; R64-L66 PolarHBondContact O-N 3.3Å
65	G	29.5	Very low	29.1	Very low	72 Å²	72	148.6 Å²	148.6	74%	0.742	79%	0.787	S	S	*	*			trans	-55	131.7	-177.3	0	0	0	0	0	112.9
66	L	28.3	Very low	28.8	Very low	177 Å²	177	144.1 Å²	144.1	93%	0.927	79%	0.787	S	S	*	*			trans	-90.3	106	167.3	-83.3	158.3	0	0	0	108.6	R64	R64-L66 PolarHBondContact O-N 3.3Å
67	R	27.9	Very low	28.5	Very low	240 Å²	240	142.7 Å²	142.7	91%	0.906	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-60.5	128.7	151.6	-99.9	177.7	177	176	-1.3	107.9
68	A	25.8	Very low	28.1	Very low	95 Å²	95	141.1 Å²	141.1	79%	0.785	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-69.2	134.1	163.4	0	0	0	0	0	110
69	P	28.4	Very low	27.6	Very low	125 Å²	125	143 Å²	143	81%	0.812	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-88.1	122.6	162.4	30.1	-21.8	0	0	0	109.8
70	K	28.1	Very low	27.3	Very low	212 Å²	212	149.6 Å²	149.6	92%	0.922	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-58.9	136.5	144	-68.1	176.2	172.5	-178.2	0	105.8
71	G	25.3	Very low	26.9	Very low	75 Å²	75	149.8 Å²	149.8	77%	0.773	81%	0.813	S	S	*	*			cis	108.2	99.1	39.2	0	0	0	0	0	107.7
72	E	25.3	Very low	26.7	Very low	199 Å²	199	148 Å²	148	93%	0.93	81%	0.814	S	S	*	*			trans	-142.6	145.8	162.7	-77.4	-174.5	168.5	0	0	105.8
73	A	25.8	Very low	26.5	Very low	80 Å²	80	153.3 Å²	153.3	66%	0.661	82%	0.82	S	S	*	*			cis	-166	142.4	-25.6	0	0	0	0	0	102.7
74	N	24.2	Very low	26.3	Very low	172 Å²	172	153.5 Å²	153.5	92%	0.92	82%	0.815	S	S	*	*			trans	-160.5	137.4	138.7	-97.6	-18.8	0	0	0	110.4
75	Q	26.7	Very low	26	Very low	185 Å²	185	149.5 Å²	149.5	86%	0.864	81%	0.807	S	S	*	*			trans	-77.4	148.6	-163	-63.1	163.2	-6.2	0	0	112
76	S	24.1	Very low	25.8	Very low	108 Å²	108	153.1 Å²	153.1	76%	0.755	81%	0.814	S	S	*	*				-167.5	131.4	117	47.4	0	0	0	0	112.7
77	S	24.1	Very low	25.5	Very low	100 Å²	100	147.8 Å²	147.8	70%	0.699	80%	0.802	S	S	*	*			trans	60.6	109.1	146.1	59.7	0	0	0	0	122.3
78	S	24	Very low	25.3	Very low	108 Å²	108	148.3 Å²	148.3	76%	0.755	81%	0.806	S	S	*	*				73.8	135.3	125.7	94.7	0	0	0	0	116.9
79	L	26.8	Very low	25.2	Very low	165 Å²	165	147.7 Å²	147.7	86%	0.864	81%	0.809	S	S	*	*			cis	-147.7	138.8	24.5	-86.2	152.5	0	0	0	108.9
80	R	25.6	Very low	25	Very low	239 Å²	239	146.5 Å²	146.5	90%	0.902	81%	0.809	S	S	*	*			trans	-90.7	139.1	157.1	-77.5	-177.2	-177.2	-150.9	1.2	108.3
81	S	26.8	Very low	25.6	Very low	97 Å²	97	141.6 Å²	141.6	68%	0.678	80%	0.799	S	S	*	*				-174.2	118.2	126.1	38.6	0	0	0	0	110.2
82	L	24.9	Very low	25.6	Very low	134 Å²	134	147.4 Å²	147.4	70%	0.702	80%	0.803	S	S	*	*				74.6	124.7	115.7	-83.9	86.1	0	0	0	113.1
83	W	26.8	Very low	26.2	Very low	236 Å²	236	143 Å²	143	89%	0.894	79%	0.792	S	S	*	*				-157.9	162.4	55.2	-89.1	87.6	0	0	0	113.6
84	K	24.9	Very low	26.2	Very low	167 Å²	167	146.2 Å²	146.2	73%	0.726	80%	0.797	S	S	*	*			trans	-91.9	147.9	179.3	-117.1	-176.6	174.4	-167.9	0	112
85	E	23.9	Very low	26.3	Very low	154 Å²	154	145.5 Å²	145.5	72%	0.72	79%	0.792	S	S	*	*			trans	51.7	135.3	137.8	-75.1	-179	163.2	0	0	123.7
86	T	24.5	Very low	26.1	Very low	147 Å²	147	143.9 Å²	143.9	90%	0.902	79%	0.789	S	S	*	*				151.1	145.9	124.1	45.3	0	0	0	0	107.7
87	G	22.4	Very low	26.1	Very low	65 Å²	65	147.1 Å²	147.1	67%	0.67	80%	0.797	S	S	*	*			cis	150.5	119.5	7.4	0	0	0	0	0	108.2
88	Y	23.4	Very low	26	Very low	252 Å²	252	146.8 Å²	146.8	99%	0.988	80%	0.795	S	S	*	*			trans	48.8	137	157	-71.6	-85.4	0	0	0	124.3
89	G	24	Very low	26	Very low	82 Å²	82	146.2 Å²	146.2	85%	0.845	79%	0.791	S	S	*	*			trans	164	117.8	150.1	0	0	0	0	0	116.5
90	A	23.4	Very low	26	Very low	99 Å²	99	147.5 Å²	147.5	82%	0.818	79%	0.793	S	S	*	*			trans	-141.9	172.3	160.5	0	0	0	0	0	107.1
91	P	40.3	Very low	26	Very low	110 Å²	110	144.9 Å²	144.9	71%	0.714	79%	0.791	S	S	*	*			cis	-142.8	172.4	-1	38.9	-18.5	0	0	0	118.2
92	K	25.8	Very low	25.9	Very low	197 Å²	197	147.2 Å²	147.2	86%	0.857	80%	0.801	S	S	*	*			trans	67.4	166.8	145.8	-83.3	180	-175.3	-176.9	0	121.7
93	P	38.3	Very low	25.9	Very low	107 Å²	107	150.6 Å²	150.6	70%	0.695	81%	0.814	S	S	*	*			cis	-140.7	-170.9	-18.1	30.6	-6	0	0	0	116.7
94	L	24.8	Very low	25.8	Very low	146 Å²	146	143 Å²	143	76%	0.764	81%	0.808	S	S	*	*			trans	94.9	110.6	146.9	-92.5	154.7	0	0	0	121.7
95	L	26.4	Very low	25.7	Very low	157 Å²	157	141.8 Å²	141.8	82%	0.822	82%	0.815	S	S	*	*				158.5	145	104.2	-92.5	159.2	0	0	0	114.6
96	N	23	Very low	25.8	Very low	151 Å²	151	139.2 Å²	139.2	81%	0.807	82%	0.82	S	S	*	*			trans	-69.8	149.3	174.5	-78.5	-24.4	0	0	0	113.3
97	L	24.6	Very low	25.8	Very low	176 Å²	176	136.9 Å²	136.9	92%	0.921	82%	0.816	S	S	*	*			trans	-160.5	151.7	131.1	-145.1	67.8	0	0	0	112.4
98	S	22.3	Very low	26	Very low	94 Å²	94	146 Å²	146	66%	0.657	83%	0.83	S	S	*	*			trans	-86.1	165.9	-167.2	56.1	0	0	0	0	116.1
99	S	24.4	Very low	26.2	Very low	96 Å²	96	140.6 Å²	140.6	67%	0.671	82%	0.823	S	S	*	*			trans	64.9	113.7	141.4	64.5	0	0	0	0	120.5
100	Q	26.3	Very low	26.2	Very low	191 Å²	191	140 Å²	140	89%	0.893	82%	0.818	S	S	*	*				175.3	150.1	102.2	-98.9	177.9	-14.1	0	0	111.9
101	Q	25.8	Very low	26.4	Very low	184 Å²	184	143.4 Å²	143.4	86%	0.86	82%	0.82	S	S	*	*			trans	-65.2	147.4	176.2	-68.7	163.8	-44.3	0	0	112.3
102	T	24.1	Very low	25.8	Very low	147 Å²	147	145.2 Å²	145.2	90%	0.902	83%	0.829	S	S	*	*			trans	-170.7	141.9	130	25.5	0	0	0	0	110.6
103	E	24.4	Very low	26.1	Very low	205 Å²	205	138.9 Å²	138.9	96%	0.958	82%	0.82	S	S	*	*			trans	-62.1	148.7	177	-65.3	172.1	139.3	0	0	112.9
104	G	24	Very low	25.9	Very low	76 Å²	76	142.3 Å²	142.3	78%	0.784	83%	0.831	S	S	*	*			trans	178.6	110.3	174	0	0	0	0	0	113.4
105	T	23.9	Very low	26.1	Very low	141 Å²	141	138.4 Å²	138.4	87%	0.865	83%	0.826	S	S	*	*			trans	-40.7	139.2	173.7	26.4	0	0	0	0	117.5
106	A	25.5	Very low	26.4	Very low	100 Å²	100	137.8 Å²	137.8	83%	0.826	82%	0.824	S	S	*	*			trans	55	105.7	138.3	0	0	0	0	0	120.4
107	A	24.9	Very low	27	Very low	99 Å²	99	134 Å²	134	82%	0.818	81%	0.809	S	S	*	*			trans	-164.8	106.4	135.4	0	0	0	0	0	110.3
108	R	26.5	Very low	27.3	Very low	255 Å²	255	133.2 Å²	133.2	96%	0.962	80%	0.803	S	S	*	*			trans	-80.9	109.8	165.5	-88.5	178.9	171	174.9	-2.6	108.2	G110	R108-G110 PolarHBondContact O-N 3.17Å
109	T	26.9	Very low	27.9	Very low	139 Å²	139	133 Å²	133	85%	0.853	80%	0.802	S	S	*	*			trans	-72.6	119.8	159.8	34.9	0	0	0	0	109
110	G	24.7	Very low	28.7	Very low	70 Å²	70	131 Å²	131	72%	0.722	79%	0.787	S	S	*	*			trans	-69.1	136.4	-171.3	0	0	0	0	0	114.1	R108	R108-G110 PolarHBondContact O-N 3.17Å
111	I	27.3	Very low	29.6	Very low	171 Å²	171	125.8 Å²	125.8	88%	0.877	77%	0.765	S	S	*	*			trans	-87.6	110.1	154.1	-66.1	175.3	0	0	0	105.9	G113	I111-G113 PolarHBondContact O-N 3.18Å
112	V	28.8	Very low	30.3	Very low	148 Å²	148	123.1 Å²	123.1	90%	0.897	76%	0.757	S	S	*	*			trans	-70.2	121	173.7	174.7	0	0	0	0	108.2
113	G	32.1	Very low	31.5	Very low	64 Å²	64	118.4 Å²	118.4	66%	0.66	73%	0.73	S	S	*	*			trans	156.9	31.2	175.7	0	0	0	0	0	116.5	I111	I111-G113 PolarHBondContact O-N 3.18Å
114	L	33.2	Very low	32.7	Very low	178 Å²	178	110.4 Å²	110.4	93%	0.932	69%	0.694	S	S	*	*			trans	-145.2	66.5	170.7	-101.3	117.6	0	0	0	108.5
115	G	28.3	Very low	33.9	Very low	64 Å²	64	112 Å²	112	66%	0.66	68%	0.681	S	S	*	*			trans	-109.1	-20.2	-174.8	0	0	0	0	0	116
116	D	32.5	Very low	35	Very low	144 Å²	144	113.3 Å²	113.3	77%	0.77	68%	0.675	S	S	*	*	S	Bend	trans	-114.4	9.6	-165.7	-74.3	-21.9	0	0	0	115.5	S120	D116-S120 PolarHBondContact O-OG 2.97Å
117	S	36.3	Very low	36.3	Very low	73 Å²	73	111.7 Å²	111.7	51%	0.51	65%	0.65	S	S	.	*	S	Bend	trans	-90.8	-12.4	179.3	166.8	0	0	0	0	114.3	N121	S117-N121 PolarHBondContact O-ND2 3.34Å
118	M	32.2	Very low	37.5	Very low	158 Å²	158	107.6 Å²	107.6	78%	0.778	61%	0.614	S	S	*	*	S	Bend	trans	-97.3	-21.1	-173	-74.6	-151.7	156.3	0	0	114.7
119	S	33.6	Very low	38.6	Very low	91 Å²	91	101.7 Å²	101.7	64%	0.636	60%	0.601	S	S	*	*	H	α-helix	trans	-79.4	-29.6	177.6	54.9	0	0	0	0	113
120	S	41.5	Very low	39.6	Very low	52 Å²	52	100.4 Å²	100.4	36%	0.364	59%	0.593	S	S	.	*	H	α-helix	trans	-78.1	-18.3	178.1	26.9	0	0	0	0	113.5	D116 S123 L124	D116-S120 PolarHBondContact O-OG 2.97Å; S120-S123 PolarHBondContact O-OG 2.82Å; S120-L124 WeakPolarHBondContact O-CD1 3.5Å; S120-L124 PolarHBondContact O-N 3.47Å
121	N	44.3	Very low	40.7	Very low	82 Å²	82	97.7 Å²	97.7	44%	0.439	57%	0.565	S	S	.	*	H	α-helix	trans	-72.1	-34.8	176.2	-81.6	-15.3	0	0	0	112.9	S117 Q125	S117-N121 PolarHBondContact O-ND2 3.34Å; N121-Q125 VanDerWaalsContact O-CB 3.32Å; N121-Q125 WeakPolarHBondContact O-CB 3.34Å; N121-Q125 PolarHBondContact O-N 3.48Å
122	N	42	Very low	41.7	Very low	128 Å²	128	98.4 Å²	98.4	68%	0.684	57%	0.565	S	S	*	*	H	α-helix	trans	-73.8	-29.7	-177.4	-82.8	-11.3	0	0	0	113.5	K126	N122-K126 WeakPolarHBondContact O-CB 3.46Å; N122-K126 PolarHBondContact O-N 3.43Å
123	S	49.6	Very low	42.6	Very low	49 Å²	49	100.2 Å²	100.2	34%	0.343	56%	0.561	S	S	.	*	H	α-helix	trans	-74.6	-45.2	175.6	60.3	0	0	0	0	111.6	S120 Q125 K126 E127	S120-S123 PolarHBondContact O-OG 2.82Å; S123-Q125 PolarHBondContact O-N 3.26Å; S123-K126 PolarHBondContact O-N 3.03Å; S123-E127 WeakPolarHBondContact O-CG 3.11Å; S123-E127 PolarHBondContact O-N 2.9Å; S123-E127 VanDerWaalsContact O-N 3.1Å
124	L	49.6	Very low	43.5	Very low	37 Å²	37	100.1 Å²	100.1	19%	0.194	55%	0.545	C	S	.	.	H	α-helix	trans	-58.4	-47.7	174.5	-94.6	142.4	0	0	0	111.5	S120 K126 E127 M128	S120-L124 WeakPolarHBondContact O-CD1 3.5Å; S120-L124 PolarHBondContact O-N 3.47Å; L124-K126 VanDerWaalsContact C-N 3.29Å; L124-K126 PolarHBondContact O-N 3.18Å; L124-E127 PolarHBondContact O-N 3.29Å; L124-M128 HydrophobicContact CB-SD 4.36Å; L124-M128 HydrophobicContact CD2-SD 4.41Å; L124-M128 WeakPolarHBondContact O-CG 2.98Å; L124-M128 PolarHBondContact O-N 3.15Å; L124-M128 VanDerWaalsContact O-N 3.13Å
125	Q	48.8	Very low	44.3	Very low	109 Å²	109	96.6 Å²	96.6	51%	0.509	54%	0.535	S	S	.	.	H	α-helix	trans	-60.6	-36.9	-179.3	-154.5	91.3	35.3	0	0	112.7	N121 S123	N121-Q125 VanDerWaalsContact O-CB 3.32Å; N121-Q125 WeakPolarHBondContact O-CB 3.34Å; N121-Q125 PolarHBondContact O-N 3.48Å; S123-Q125 PolarHBondContact O-N 3.26Å
126	K	46.8	Very low	45.8	Very low	168 Å²	168	97 Å²	97	73%	0.73	53%	0.533	S	S	*	.	H	α-helix	trans	-76.6	-27	179.7	-162.7	175.9	-176.5	-178.7	0	112.7	N122 S123 L124 V130	N122-K126 WeakPolarHBondContact O-CB 3.46Å; N122-K126 PolarHBondContact O-N 3.43Å; S123-K126 PolarHBondContact O-N 3.03Å; L124-K126 VanDerWaalsContact C-N 3.29Å; L124-K126 PolarHBondContact O-N 3.18Å; K126-V130 WeakPolarHBondContact O-CG2 3.26Å
127	E	52.3	Low	47.3	Very low	66 Å²	66	92.8 Å²	92.8	31%	0.308	51%	0.508	S	S	.	.	H	α-helix	trans	-80.4	-27.2	177.9	-74.2	169.2	-155	0	0	112.9	S123 L124 D129 V130 P307 S308	S123-E127 WeakPolarHBondContact O-CG 3.11Å; S123-E127 PolarHBondContact O-N 2.9Å; S123-E127 VanDerWaalsContact O-N 3.1Å; L124-E127 PolarHBondContact O-N 3.29Å; E127-D129 PolarHBondContact O-N 2.6Å; E127-V130 PolarHBondContact O-N 2.66Å; E127-P307 VanDerWaalsContact CD-CG 3.46Å; E127-P307 HydrophobicContact CG-CG 4.33Å; E127-P307 VanDerWaalsContact OE1-CG 3.26Å; E127-P307 WeakPolarHBondContact OE1-CG 3.29Å; E127-S308 PolarHBondContact OE2-OG 3.42Å
128	M	50.9	Low	49	Very low	14 Å²	14	92.5 Å²	92.5	7%	0.069	50%	0.504	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	5.1	-179.8	-64.8	160	70.7	0	0	114.3	L124 K353	L124-M128 HydrophobicContact CB-SD 4.36Å; L124-M128 HydrophobicContact CD2-SD 4.41Å; L124-M128 WeakPolarHBondContact O-CG 2.98Å; L124-M128 PolarHBondContact O-N 3.15Å; L124-M128 VanDerWaalsContact O-N 3.13Å; M128-K353 HydrophobicContact CE-CB 3.05Å; M128-K353 HydrophobicContact CE-CD 3.57Å; M128-K353 HydrophobicContact CE-CG 3.29Å; M128-K353 PolarHBondContact O-NZ 3.24Å
129	D	49.6	Very low	51.4	Low	130 Å²	130	88.3 Å²	88.3	70%	0.695	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.1	1.2	-179.9	-151.7	38.8	0	0	0	112.7	E127	E127-D129 PolarHBondContact O-N 2.6Å
130	V	47.5	Very low	54.2	Low	113 Å²	113	92.5 Å²	92.5	69%	0.685	48%	0.482	S	S	*	.			trans	-110	13.1	-171.3	-173.8	0	0	0	0	112.9	K126 E127	K126-V130 WeakPolarHBondContact O-CG2 3.26Å; E127-V130 PolarHBondContact O-N 2.66Å
131	G	48.1	Very low	56.8	Low	13 Å²	13	92.1 Å²	92.1	13%	0.134	47%	0.473	C	S	.	.	S	Bend	trans	-81.3	140.5	168	0	0	0	0	0	111.1	K133	G131-K133 PolarHBondContact O-N 2.79Å
132	E	48.3	Very low	59.2	Low	185 Å²	185	91 Å²	91	86%	0.864	47%	0.467	S	S	*	.			trans	-46.6	119.6	159.9	-83.3	-177.3	148.9	0	0	107.9	L134	E132-L134 PolarHBondContact O-N 3.35Å
133	K	46.9	Very low	61.8	Low	187 Å²	187	86.3 Å²	86.3	81%	0.813	44%	0.441	S	S	*	.			trans	-57.5	103.7	174.1	-85.7	-179.6	176.8	176.1	0	107.1	G131 S135	G131-K133 PolarHBondContact O-N 2.79Å; K133-S135 PolarHBondContact O-N 2.88Å
134	L	50.7	Low	64	Low	61 Å²	61	85.6 Å²	85.6	32%	0.319	43%	0.434	S	S	.	.			trans	-66.5	107.6	172.5	-77.6	160	0	0	0	106.5	E132	E132-L134 PolarHBondContact O-N 3.35Å
135	S	50.3	Low	66.2	Low	105 Å²	105	85.3 Å²	85.3	73%	0.734	43%	0.431	S	S	*	.			trans	-48	140.7	159.3	169.2	0	0	0	0	108.5	K133	K133-S135 PolarHBondContact O-N 2.88Å
136	A	60	Low	68.5	Low	73 Å²	73	82.3 Å²	82.3	60%	0.603	42%	0.421	S	S	*	.	S	Bend	trans	-36	149.4	-174.5	0	0	0	0	0	115.9
137	Q	63.5	Low	70.7	Confident	55 Å²	55	80.1 Å²	80.1	26%	0.257	41%	0.412	S	S	.	.			trans	26.3	81.2	169.3	-75.5	-68.4	-33.6	0	0	114.9	Y139 N239 Y331	Q137-Y139 PolarHBondContact O-N 3.46Å; Q137-N239 VanDerWaalsContact NE2-CB 3.25Å; Q137-N239 PolarHBondContact NE2-ND2 3Å; Q137-N239 PolarHBondContact NE2-OD1 2.97Å; Q137-Y331 WeakPolarHBondContact CG-OH 3.48Å; Q137-Y331 PolarHBondContact NE2-OH 3.25Å
138	P	72.4	Confident	72.6	Confident	66 Å²	66	79.3 Å²	79.3	43%	0.429	41%	0.407	S	S	.	.	S	Bend	trans	-67.3	-10.5	-176.6	26.1	-33.4	0	0	0	114
139	Y	83.7	Confident	74.6	Confident	70 Å²	70	79.4 Å²	79.4	28%	0.275	41%	0.409	S	S	.	.	S	Bend	trans	-129.3	132.7	-177.3	-54.8	-70.4	0	0	0	110.8	Q137 Q221 D222 Y223 T232	Q137-Y139 PolarHBondContact O-N 3.46Å; Y139-Q221 PolarHBondContact O-NE2 3.06Å; Y139-D222 WeakPolarHBondContact CD1-O 3.44Å; Y139-Y223 HydrophobicContact CD2-CD1 4.31Å; Y139-Y223 HydrophobicContact CG-CD1 4.38Å; Y139-T232 HydrophobicContact CD2-CG2 3.55Å; Y139-T232 HydrophobicContact CE2-CG2 3.47Å; Y139-T232 VanDerWaalsContact CE2-CG2 3.47Å
140	R	91.7	Very high	76.5	Confident	179 Å²	179	81 Å²	81	68%	0.675	41%	0.405	S	S	*	.			trans	-76.4	148.5	173.1	65.9	-178.4	177.4	151.5	2.1	110.7	Q221 D222	R140-Q221 VanDerWaalsContact O-CA 3.3Å; R140-Q221 WeakPolarHBondContact O-CA 3.37Å; R140-D222 HydrophobicContact CG-CB 4.01Å; R140-D222 IonicContact CZ-OD2 3.61Å; R140-D222 IonicContact NE-OD2 3.64Å; R140-D222 PolarHBondContact NE-OD2 2.93Å; R140-D222 VanDerWaalsContact NE-OD2 3.15Å; R140-D222 IonicContact NH2-OD2 2.79Å; R140-D222 PolarHBondContact NH2-OD2 3.39Å; R140-D222 VanDerWaalsContact NH2-OD2 3.14Å; R140-D222 PolarHBondContact O-N 3.17Å; R140-D222 VanDerWaalsContact O-N 3.1Å
141	Y	95	Very high	78.4	Confident	44 Å²	44	82.7 Å²	82.7	17%	0.173	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	127.5	166.9	-69.6	-87.9	0	0	0	110	N144 I219 Q220 Q221 M236 N239	Y141-N144 HydrophobicContact CD1-CB 4.38Å; Y141-N144 WeakPolarHBondContact CD1-OD1 3.39Å; Y141-N144 HydrophobicContact CG-CB 4.09Å; Y141-I219 HydrophobicContact CE1-CB 4.48Å; Y141-I219 HydrophobicContact CE1-CD1 4.38Å; Y141-Q220 CarbonylContact C-O 3.56Å; Y141-Q220 WeakPolarHBondContact CA-O 3.29Å; Y141-Q221 HydrophobicContact CD1-CG 3.64Å; Y141-Q221 HydrophobicContact CD2-CG 4.37Å; Y141-Q221 HydrophobicContact CE1-CG 3.85Å; Y141-Q221 VanDerWaalsContact CE2-NE2 3.32Å; Y141-Q221 HydrophobicContact CG-CG 3.92Å; Y141-Q221 VanDerWaalsContact CZ-NE2 3.32Å; Y141-M236 HydrophobicContact CD1-CG 4.48Å; Y141-M236 HydrophobicContact CE1-CG 3.57Å; Y141-M236 HydrophobicContact CE1-SD 4.2Å; Y141-M236 PolarHBondContact OH-O 3.08Å; Y141-N239 PolarHBondContact OH-ND2 3.46Å
142	I	95.8	Very high	80.2	Confident	60 Å²	60	85.7 Å²	85.7	31%	0.308	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-42.6	168	-57.7	169.7	0	0	0	108.7	T196 Q220 D222	I142-T196 HydrophobicContact CD1-CG2 3.49Å; I142-T196 VanDerWaalsContact CD1-CG2 3.49Å; I142-Q220 HydrophobicContact CB-CB 4.49Å; I142-Q220 HydrophobicContact CD1-CG 4.41Å; I142-Q220 PolarHBondContact N-O 3.31Å; I142-D222 HydrophobicContact CD1-CB 3.95Å; I142-D222 HydrophobicContact CG1-CB 4.14Å
143	L	97.4	Very high	82.2	Confident	28 Å²	28	80.8 Å²	80.8	15%	0.147	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	131.6	174.1	-58.2	172.7	0	0	0	108	I208 I218 I219 Q220	L143-I208 HydrophobicContact CD1-CG2 3.85Å; L143-I218 HydrophobicContact CD1-CG2 3.96Å; L143-I219 WeakPolarHBondContact O-CA 3.5Å; L143-Q220 HydrophobicContact CB-CB 3.99Å; L143-Q220 HydrophobicContact CD1-CB 4.19Å; L143-Q220 HydrophobicContact CG-CB 4.23Å; L143-Q220 PolarHBondContact N-O 3.49Å; L143-Q220 PolarHBondContact O-N 2.84Å
144	N	94.7	Very high	84.4	Confident	34 Å²	34	72.1 Å²	72.1	18%	0.182	38%	0.375	C	S	.	.			trans	-137.8	-12.9	-164	-162	21	0	0	0	116	Y141 P146 W240 Y244	Y141-N144 HydrophobicContact CD1-CB 4.38Å; Y141-N144 WeakPolarHBondContact CD1-OD1 3.39Å; Y141-N144 HydrophobicContact CG-CB 4.09Å; N144-P146 VanDerWaalsContact C-CD 3.42Å; N144-P146 VanDerWaalsContact C-N 3.28Å; N144-W240 PolarHBondContact O-NE1 3.49Å; N144-Y244 PolarHBondContact ND2-OH 3.49Å; N144-Y244 WeakPolarHBondContact OD1-CE2 3.47Å
145	E	96.4	Very high	86.5	Confident	32 Å²	32	70.1 Å²	70.1	15%	0.15	36%	0.364	C	S	.	.			trans	37.1	45	179.5	-56.8	-58.2	160.2	0	0	116.4	F147 K148 S212 H216 I218 I219 W240	E145-F147 PolarHBondContact O-N 3.23Å; E145-K148 HydrophobicContact CB-CB 4.47Å; E145-K148 HydrophobicContact CB-CD 4.46Å; E145-K148 WeakPolarHBondContact O-CB 3.34Å; E145-K148 PolarHBondContact O-N 2.95Å; E145-S212 PolarHBondContact OE1-OG 3.39Å; E145-H216 WeakPolarHBondContact OE1-CA 3.18Å; E145-H216 IonicContact OE1-ND1 2.69Å; E145-H216 IonicContact OE2-CG 2.73Å; E145-H216 IonicContact OE2-ND1 2.78Å; E145-H216 PolarHBondContact OE2-ND1 3.49Å; E145-I218 WeakPolarHBondContact CG-O 3.32Å; E145-I219 HydrophobicContact CB-CG2 4.34Å; E145-I219 HydrophobicContact CG-CG2 4.43Å; E145-W240 WeakPolarHBondContact O-CZ2 3.37Å
146	P	95.9	Very high	88.8	Confident	45 Å²	45	65.1 Å²	65.1	29%	0.292	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-10.8	-162.1	29.6	-37.8	0	0	0	114.5	N144 Y244	N144-P146 VanDerWaalsContact C-CD 3.42Å; N144-P146 VanDerWaalsContact C-N 3.28Å; P146-Y244 HydrophobicContact CB-CD1 3.86Å; P146-Y244 HydrophobicContact CB-CE1 3.66Å
147	F	94.6	Very high	90.6	Very high	122 Å²	122	61.7 Å²	61.7	54%	0.535	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	0.5	-175.5	-49.7	-41.9	0	0	0	113	E145 C149 R150	E145-F147 PolarHBondContact O-N 3.23Å; F147-C149 PolarHBondContact O-N 3.08Å; F147-C149 VanDerWaalsContact O-N 3.17Å; F147-R150 WeakPolarHBondContact O-CB 3.37Å; F147-R150 PolarHBondContact O-N 3.37Å
148	K	91.6	Very high	92.3	Very high	50 Å²	50	59 Å²	59	22%	0.217	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-24.5	-171.5	-161.8	141.5	-173.3	-168.5	0	114.1	E145 I189 R190 L191 H216 W240	E145-K148 HydrophobicContact CB-CB 4.47Å; E145-K148 HydrophobicContact CB-CD 4.46Å; E145-K148 WeakPolarHBondContact O-CB 3.34Å; E145-K148 PolarHBondContact O-N 2.95Å; K148-I189 HydrophobicContact CD-CG2 4.09Å; K148-I189 HydrophobicContact CG-CD1 3.98Å; K148-I189 HydrophobicContact CG-CG1 4.44Å; K148-I189 HydrophobicContact CG-CG2 3.99Å; K148-I189 WeakPolarHBondContact O-CD1 3.34Å; K148-R190 PolarHBondContact NZ-O 3.27Å; K148-L191 HydrophobicContact CD-CD2 4.18Å; K148-H216 VanDerWaalsContact CD-O 3.29Å; K148-H216 WeakPolarHBondContact CD-O 3.41Å; K148-H216 WeakPolarHBondContact CE-O 3.44Å; K148-H216 PolarHBondContact NZ-O 3.25Å; K148-W240 HydrophobicContact CB-CH2 4.19Å; K148-W240 HydrophobicContact CB-CZ2 4.25Å
149	C	92.6	Very high	93.5	Very high	15 Å²	15	56 Å²	56	10%	0.101	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	15.2	173.6	-69.9	0	0	0	0	114.3	F147 S152 I189 Y244 C245	F147-C149 PolarHBondContact O-N 3.08Å; F147-C149 VanDerWaalsContact O-N 3.17Å; C149-S152 CarbonylContact C-O 3.55Å; C149-I189 VanDerWaalsContact SG-CD1 3.51Å; C149-Y244 WeakPolarHBondContact CB-O 2.98Å; C149-C245 HydrophobicContact CB-CB 3.6Å; C149-C245 WeakPolarHBondContact CB-SG 3.41Å; C149-C245 WeakPolarHBondContact SG-CB 3.41Å; C149-C245 CovalentContact SG-SG 2.04Å; C149-C245 PolarHBondContact SG-SG 3.06Å
150	R	89.1	Confident	94.2	Very high	163 Å²	163	52.6 Å²	52.6	62%	0.615	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-48.3	-175.7	178.8	-178.7	-76.8	176	-13	112.4	F147	F147-R150 WeakPolarHBondContact O-CB 3.37Å; F147-R150 PolarHBondContact O-N 3.37Å
151	D	86.9	Confident	94.6	Very high	150 Å²	150	44.4 Å²	44.4	80%	0.802	23%	0.225	S	C	*	.	S	Bend	trans	-98.9	-9.1	-169.6	-54.9	-43.9	0	0	0	113
152	S	86.3	Confident	94.7	Very high	76 Å²	76	42.4 Å²	42.4	53%	0.531	22%	0.218	S	C	.	.			trans	-149.9	144.9	177	69.3	0	0	0	0	111.2	C149 P154	C149-S152 CarbonylContact C-O 3.55Å; S152-P154 WeakPolarHBondContact O-CD 3.4Å
153	T	90.2	Very high	94.8	Very high	81 Å²	81	44.8 Å²	44.8	50%	0.497	23%	0.228	S	C	.	.			trans	-96.1	110.5	172.5	-59.8	0	0	0	0	108.5	L247	T153-L247 HydrophobicContact CG2-CB 3.77Å; T153-L247 WeakPolarHBondContact CG2-O 3.39Å
154	P	93.3	Very high	94.7	Very high	5 Å²	5	43.9 Å²	43.9	3%	0.032	22%	0.223	C	C	.	.			trans	-69.7	151.1	178.3	31.1	-37.2	0	0	0	110.9	S152 I157 I189 V248	S152-P154 WeakPolarHBondContact O-CD 3.4Å; P154-I157 HydrophobicContact CG-CD1 4.29Å; P154-I157 HydrophobicContact CG-CG1 4Å; P154-I189 HydrophobicContact CB-CD1 3.94Å; P154-I189 HydrophobicContact CB-CG1 3.98Å; P154-I189 HydrophobicContact CG-CD1 3.6Å; P154-I189 HydrophobicContact CG-CG1 4.14Å; P154-V248 HydrophobicContact CG-CB 4.48Å; P154-V248 HydrophobicContact CG-CG2 4.07Å; P154-V248 WeakPolarHBondContact O-CG2 3.39Å
155	F	95.9	Very high	94.8	Very high	20 Å²	20	49.6 Å²	49.6	9%	0.088	24%	0.242	C	C	.	.	S	Bend	trans	-70.5	-38.1	170.5	-179.9	-103.1	0	0	0	111.6	L186 G187 S249 Y250 I266 L270 P272	F155-L186 HydrophobicContact CB-CB 4.41Å; F155-G187 PolarHBondContact N-O 2.97Å; F155-S249 WeakPolarHBondContact O-CB 3.43Å; F155-Y250 HydrophobicContact CE1-CD2 4.03Å; F155-Y250 HydrophobicContact CE1-CE2 4.45Å; F155-Y250 AromaticContact CE2-CD2 3.99Å; F155-Y250 HydrophobicContact CE2-CD2 3.99Å; F155-Y250 AromaticContact CE2-CE2 3.94Å; F155-Y250 HydrophobicContact CE2-CE2 3.94Å; F155-Y250 AromaticContact CZ-CD2 3.64Å; F155-Y250 HydrophobicContact CZ-CD2 3.64Å; F155-Y250 AromaticContact CZ-CE2 3.66Å; F155-Y250 HydrophobicContact CZ-CE2 3.66Å; F155-Y250 PolarHBondContact O-N 3.17Å; F155-I266 HydrophobicContact CD1-CG1 4.35Å; F155-I266 HydrophobicContact CD1-CG2 4.12Å; F155-I266 HydrophobicContact CE1-CB 4.45Å; F155-I266 HydrophobicContact CE1-CG1 4.3Å; F155-I266 HydrophobicContact CE1-CG2 3.86Å; F155-L270 HydrophobicContact CE1-CB 3.87Å; F155-L270 HydrophobicContact CE1-CD1 4.04Å; F155-L270 HydrophobicContact CZ-CB 3.84Å; F155-P272 HydrophobicContact CD2-CB 4.3Å; F155-P272 HydrophobicContact CE1-CB 4.42Å; F155-P272 HydrophobicContact CE2-CB 3.82Å; F155-P272 HydrophobicContact CZ-CB 3.87Å
156	L	97.5	Very high	94.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	140.8	-176.5	176.5	66.4	0	0	0	111.1	L158 F188 I189 Y250 M252 T262 L265 I266 L270	L156-L158 HydrophobicContact CD1-CD2 4.44Å; L156-L158 HydrophobicContact CD2-CD2 3.7Å; L156-L158 HydrophobicContact CD2-CG 4.45Å; L156-L158 HydrophobicContact CG-CD2 4Å; L156-F188 HydrophobicContact CB-CB 3.77Å; L156-F188 HydrophobicContact CG-CB 4.35Å; L156-F188 CarbonylContact O-C 3.5Å; L156-F188 WeakPolarHBondContact O-CA 3.33Å; L156-F188 WeakPolarHBondContact O-CB 3.37Å; L156-I189 PolarHBondContact O-N 2.85Å; L156-Y250 CarbonylContact C-O 3.38Å; L156-Y250 VanDerWaalsContact CA-O 3.29Å; L156-Y250 WeakPolarHBondContact CA-O 3.38Å; L156-M252 HydrophobicContact CD1-CB 4.23Å; L156-T262 HydrophobicContact CD2-CG2 4.4Å; L156-L265 HydrophobicContact CD2-CD2 4.01Å; L156-I266 HydrophobicContact CD2-CD1 4.03Å; L156-I266 HydrophobicContact CD2-CG1 3.96Å; L156-L270 HydrophobicContact CD1-CD1 4.33Å
157	I	97.9	Very high	94.9	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	130.9	162.1	-70.1	168.9	0	0	0	109.4	P154 L159 I189 L191 W240 V241 C245 V248 Y250 V251 M252	P154-I157 HydrophobicContact CG-CD1 4.29Å; P154-I157 HydrophobicContact CG-CG1 4Å; I157-L159 HydrophobicContact CG2-CD2 3.61Å; I157-L159 HydrophobicContact CG2-CG 3.98Å; I157-I189 CarbonylContact C-O 3.59Å; I157-I189 WeakPolarHBondContact CA-O 3.03Å; I157-I189 HydrophobicContact CG1-CB 4.17Å; I157-L191 HydrophobicContact CG2-CD1 4.49Å; I157-W240 HydrophobicContact CD1-CZ3 4.09Å; I157-V241 HydrophobicContact CD1-CG1 4.41Å; I157-V241 HydrophobicContact CD1-CG2 4Å; I157-V241 HydrophobicContact CG2-CG2 4.28Å; I157-C245 HydrophobicContact CD1-CB 3.74Å; I157-C245 VanDerWaalsContact CD1-SG 3.58Å; I157-V248 HydrophobicContact CB-CG2 4.44Å; I157-V248 HydrophobicContact CD1-CB 4.08Å; I157-V248 HydrophobicContact CD1-CG1 4.24Å; I157-V248 HydrophobicContact CD1-CG2 3.92Å; I157-V248 HydrophobicContact CG1-CG2 3.86Å; I157-Y250 PolarHBondContact N-O 2.79Å; I157-V251 HydrophobicContact CB-CG1 4.44Å; I157-V251 CarbonylContact O-C 3.58Å; I157-V251 WeakPolarHBondContact O-CA 3.36Å; I157-M252 PolarHBondContact O-N 3.45Å
158	L	98.6	Very high	95.1	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	109	168.7	-56.7	-178.3	0	0	0	108.9	L156 I160 W177 F188 I189 L191 M252	L156-L158 HydrophobicContact CD1-CD2 4.44Å; L156-L158 HydrophobicContact CD2-CD2 3.7Å; L156-L158 HydrophobicContact CD2-CG 4.45Å; L156-L158 HydrophobicContact CG-CD2 4Å; L158-I160 HydrophobicContact CB-CD1 4.28Å; L158-I160 HydrophobicContact CB-CG1 4.16Å; L158-W177 HydrophobicContact CD1-CE3 4.05Å; L158-W177 HydrophobicContact CD1-CZ3 3.93Å; L158-F188 HydrophobicContact CD1-CD2 3.78Å; L158-F188 HydrophobicContact CD1-CE2 3.43Å; L158-F188 VanDerWaalsContact CD1-CE2 3.43Å; L158-F188 HydrophobicContact CD1-CZ 4.33Å; L158-F188 HydrophobicContact CG-CD2 3.95Å; L158-F188 HydrophobicContact CG-CE2 4.14Å; L158-I189 PolarHBondContact N-O 2.89Å; L158-L191 PolarHBondContact O-N 3.14Å; L158-M252 HydrophobicContact CD2-CB 3.78Å; L158-M252 HydrophobicContact CD2-CG 4.38Å; L158-M252 HydrophobicContact CD2-SD 4.23Å
159	L	98.9	Very high	95.4	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	107.1	171	-62.2	-177.3	0	0	0	108.9	I157 L191 L193 V241 V251 M252 K253 T254	I157-L159 HydrophobicContact CG2-CD2 3.61Å; I157-L159 HydrophobicContact CG2-CG 3.98Å; L159-L191 HydrophobicContact CD2-CB 4.38Å; L159-L191 HydrophobicContact CD2-CD1 4.32Å; L159-L193 HydrophobicContact CB-CD1 4.09Å; L159-L193 HydrophobicContact CB-CG 4.48Å; L159-L193 HydrophobicContact CD2-CD2 4.19Å; L159-V241 HydrophobicContact CD1-CG2 4.11Å; L159-V241 HydrophobicContact CD2-CG2 4.09Å; L159-V241 HydrophobicContact CG-CG2 4.45Å; L159-V251 HydrophobicContact CD1-CG1 3.57Å; L159-V251 HydrophobicContact CG-CG1 3.71Å; L159-M252 PolarHBondContact N-O 2.76Å; L159-K253 WeakPolarHBondContact O-CA 3.5Å; L159-T254 PolarHBondContact O-N 3Å
160	I	98.9	Very high	95.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	107.4	-170	-52.4	174.6	0	0	0	109.5	L158 A162 I173 W177 R190 L191 F192 L193 T254	L158-I160 HydrophobicContact CB-CD1 4.28Å; L158-I160 HydrophobicContact CB-CG1 4.16Å; I160-A162 PolarHBondContact O-N 3Å; I160-I173 HydrophobicContact CD1-CG2 3.79Å; I160-I173 HydrophobicContact CG2-CD1 4.08Å; I160-W177 HydrophobicContact CD1-CH2 3.53Å; I160-W177 HydrophobicContact CD1-CZ3 3.57Å; I160-W177 HydrophobicContact CG1-CH2 4.01Å; I160-W177 HydrophobicContact CG1-CZ3 4.21Å; I160-W177 HydrophobicContact CG2-CH2 4.3Å; I160-R190 HydrophobicContact CD1-CG 3.56Å; I160-L191 PolarHBondContact N-O 3.2Å; I160-F192 HydrophobicContact CB-CD1 3.77Å; I160-F192 HydrophobicContact CB-CE1 4.09Å; I160-F192 HydrophobicContact CD1-CD1 4.24Å; I160-F192 HydrophobicContact CD1-CE1 3.81Å; I160-F192 HydrophobicContact CD1-CZ 4.37Å; I160-F192 HydrophobicContact CG2-CD1 3.79Å; I160-F192 HydrophobicContact CG2-CE1 3.86Å; I160-F192 CarbonylContact O-C 3.51Å; I160-F192 WeakPolarHBondContact O-CA 3.36Å; I160-L193 PolarHBondContact O-N 3.01Å; I160-T254 CarbonylContact C-O 3.6Å; I160-T254 WeakPolarHBondContact CA-O 3.42Å; I160-T254 HydrophobicContact CB-CG2 4.48Å; I160-T254 HydrophobicContact CG1-CG2 3.95Å; I160-T254 HydrophobicContact CG2-CG2 4.43Å
161	A	98.7	Very high	96.2	Very high	7 Å²	7	43.6 Å²	43.6	6%	0.058	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	117.8	172.9	0	0	0	0	0	109.9	K233 T254 S256	A161-K233 HydrophobicContact CB-CD 3.82Å; A161-T254 PolarHBondContact N-O 3.06Å; A161-S256 PolarHBondContact O-N 3.43Å
162	A	98.1	Very high	96.8	Very high	2 Å²	2	36.5 Å²	36.5	2%	0.017	20%	0.196	C	C	.	.			trans	-134.1	154.4	176.1	0	0	0	0	0	109.6	I160 R170 F192 L193 L194 K233	I160-A162 PolarHBondContact O-N 3Å; A162-R170 HydrophobicContact CB-CG 4.23Å; A162-F192 HydrophobicContact CB-CD1 4.4Å; A162-L193 PolarHBondContact N-O 2.92Å; A162-L193 VanDerWaalsContact O-O 3.08Å; A162-L194 HydrophobicContact CB-CD2 3.98Å; A162-L194 WeakPolarHBondContact O-CD2 3.3Å; A162-K233 PolarHBondContact O-NZ 3.26Å
163	E	96.6	Very high	97.4	Very high	109 Å²	109	32.9 Å²	32.9	51%	0.509	17%	0.17	S	C	.	.			trans	-83.3	154.2	169.5	-67.3	-178.2	-163.7	0	0	111	R165 Q166 R170	E163-R165 PolarHBondContact O-N 3.03Å; E163-R165 VanDerWaalsContact O-N 3.15Å; E163-Q166 HydrophobicContact CB-CG 4.02Å; E163-Q166 WeakPolarHBondContact O-CB 3.41Å; E163-Q166 PolarHBondContact O-N 3.12Å; E163-R170 PolarHBondContact O-NH1 3.4Å
164	P	96.3	Very high	97.7	Very high	9 Å²	9	30 Å²	30	6%	0.058	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-41.6	-178	-31.1	40.2	0	0	0	112.9	Q166 R170 L204 I208 D225	P164-Q166 VanDerWaalsContact C-N 3.32Å; P164-Q166 PolarHBondContact O-N 3.04Å; P164-R170 PolarHBondContact O-NH1 3.33Å; P164-R170 PolarHBondContact O-NH2 3.07Å; P164-R170 VanDerWaalsContact O-NH2 3.09Å; P164-L204 HydrophobicContact CB-CD2 3.94Å; P164-L204 HydrophobicContact CB-CG 4.35Å; P164-I208 HydrophobicContact CB-CD1 3.66Å; P164-D225 WeakPolarHBondContact CD-OD2 3.28Å; P164-D225 HydrophobicContact CG-CB 3.99Å
165	R	96.2	Very high	97.9	Very high	154 Å²	154	34.1 Å²	34.1	58%	0.581	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-11.8	-178.6	-63.6	-169.5	-174	-74.2	-3.5	115	E163 A167 D201 L204	E163-R165 PolarHBondContact O-N 3.03Å; E163-R165 VanDerWaalsContact O-N 3.15Å; R165-A167 PolarHBondContact O-N 3.39Å; R165-D201 IonicContact CZ-OD2 3.15Å; R165-D201 IonicContact NH1-OD2 2.86Å; R165-D201 PolarHBondContact NH1-OD2 3.25Å; R165-D201 IonicContact NH2-OD2 3.47Å; R165-D201 PolarHBondContact NH2-OD2 3.27Å; R165-L204 HydrophobicContact CG-CD1 4.12Å; R165-L204 HydrophobicContact CG-CD2 3.8Å
166	Q	97.3	Very high	98	Very high	64 Å²	64	33.2 Å²	33.2	30%	0.299	17%	0.165	S	C	.	.			trans	-82.4	48.4	-174.5	-71.4	177.3	-40.1	0	0	113.1	E163 P164 D168 A169 R170 S256	E163-Q166 HydrophobicContact CB-CG 4.02Å; E163-Q166 WeakPolarHBondContact O-CB 3.41Å; E163-Q166 PolarHBondContact O-N 3.12Å; P164-Q166 VanDerWaalsContact C-N 3.32Å; P164-Q166 PolarHBondContact O-N 3.04Å; Q166-D168 VanDerWaalsContact C-N 3.31Å; Q166-D168 PolarHBondContact O-N 3.08Å; Q166-A169 HydrophobicContact CB-CB 4.08Å; Q166-A169 PolarHBondContact O-N 3.39Å; Q166-R170 WeakPolarHBondContact O-CG 3.47Å; Q166-R170 PolarHBondContact O-N 3.13Å; Q166-R170 VanDerWaalsContact O-N 3.08Å; Q166-S256 PolarHBondContact OE1-OG 3.27Å
167	A	98.1	Very high	98	Very high	43 Å²	43	33.2 Å²	33.2	36%	0.355	17%	0.165	S	C	.	.	H	α-helix	trans	-59.2	-40.6	178.8	0	0	0	0	0	112.2	R165 A169 R170 N171	R165-A167 PolarHBondContact O-N 3.39Å; A167-A169 PolarHBondContact O-N 3.07Å; A167-R170 PolarHBondContact O-N 3.14Å; A167-N171 WeakPolarHBondContact O-CB 3.39Å; A167-N171 PolarHBondContact O-N 2.93Å
168	D	98.5	Very high	98	Very high	121 Å²	121	33.2 Å²	33.2	65%	0.647	17%	0.165	S	C	*	.	H	α-helix	trans	-64.2	-38.6	178.1	-67	-26.2	0	0	0	112.6	Q166 N171 A172 P390	Q166-D168 VanDerWaalsContact C-N 3.31Å; Q166-D168 PolarHBondContact O-N 3.08Å; D168-N171 PolarHBondContact O-N 2.99Å; D168-A172 WeakPolarHBondContact O-CB 3.4Å; D168-A172 PolarHBondContact O-N 3.47Å; D168-P390 HydrophobicContact CB-CB 4.27Å; D168-P390 HydrophobicContact CB-CG 4.05Å
169	A	98.8	Very high	97.8	Very high	11 Å²	11	35.9 Å²	35.9	9%	0.091	18%	0.18	C	C	.	.	H	α-helix	trans	-66.5	-45.9	176.5	0	0	0	0	0	110.7	Q166 A167 N171 A172 I173 P390	Q166-A169 HydrophobicContact CB-CB 4.08Å; Q166-A169 PolarHBondContact O-N 3.39Å; A167-A169 PolarHBondContact O-N 3.07Å; A169-N171 VanDerWaalsContact C-N 3.35Å; A169-N171 PolarHBondContact O-N 3.17Å; A169-A172 PolarHBondContact O-N 3.21Å; A169-I173 VanDerWaalsContact O-CG1 3.23Å; A169-I173 WeakPolarHBondContact O-CG1 3.47Å; A169-I173 PolarHBondContact O-N 3.2Å; A169-P390 HydrophobicContact CB-CG 4.21Å
170	R	98.7	Very high	97.2	Very high	3 Å²	3	39.6 Å²	39.6	1%	0.011	20%	0.197	C	C	.	.	H	α-helix	trans	-56	-50.8	174.3	-66.1	-167.1	-67.7	-86.4	7	110.7	A162 E163 P164 Q166 A167 A172 I173 R174 F192 E211	A162-R170 HydrophobicContact CB-CG 4.23Å; E163-R170 PolarHBondContact O-NH1 3.4Å; P164-R170 PolarHBondContact O-NH1 3.33Å; P164-R170 PolarHBondContact O-NH2 3.07Å; P164-R170 VanDerWaalsContact O-NH2 3.09Å; Q166-R170 WeakPolarHBondContact O-CG 3.47Å; Q166-R170 PolarHBondContact O-N 3.13Å; Q166-R170 VanDerWaalsContact O-N 3.08Å; A167-R170 PolarHBondContact O-N 3.14Å; R170-A172 PolarHBondContact O-N 3.21Å; R170-I173 WeakPolarHBondContact O-CB 3.44Å; R170-I173 PolarHBondContact O-N 2.95Å; R170-I173 VanDerWaalsContact O-N 3.15Å; R170-R174 WeakPolarHBondContact O-CG 3.4Å; R170-R174 PolarHBondContact O-N 3.36Å; R170-F192 HydrophobicContact CB-CD1 4.27Å; R170-F192 HydrophobicContact CB-CD2 4.21Å; R170-F192 HydrophobicContact CB-CE1 3.91Å; R170-F192 HydrophobicContact CB-CE2 3.83Å; R170-F192 HydrophobicContact CB-CG 4.41Å; R170-F192 HydrophobicContact CB-CZ 3.67Å; R170-F192 HydrophobicContact CG-CD1 3.61Å; R170-F192 HydrophobicContact CG-CD2 4.05Å; R170-F192 HydrophobicContact CG-CE1 3.7Å; R170-F192 HydrophobicContact CG-CE2 4.13Å; R170-F192 HydrophobicContact CG-CG 3.8Å; R170-F192 HydrophobicContact CG-CZ 3.96Å; R170-F192 WeakPolarHBondContact O-CZ 3.2Å; R170-E211 IonicContact CZ-OE1 3.91Å; R170-E211 IonicContact CZ-OE2 3.14Å; R170-E211 VanDerWaalsContact CZ-OE2 3.26Å; R170-E211 IonicContact NE-OE1 2.66Å; R170-E211 PolarHBondContact NE-OE1 3.21Å; R170-E211 IonicContact NE-OE2 2.68Å; R170-E211 PolarHBondContact NE-OE2 3.37Å; R170-E211 VanDerWaalsContact NE-OE2 3.1Å; R170-E211 IonicContact NH2-OE1 3.31Å; R170-E211 IonicContact NH2-OE2 3.64Å; R170-E211 PolarHBondContact NH2-OE2 2.86Å
171	N	98.6	Very high	96.4	Very high	60 Å²	60	43.9 Å²	43.9	32%	0.321	23%	0.227	S	C	.	.	H	α-helix	trans	-61	-44.1	179.8	-171	29.1	0	0	0	113	A167 D168 A169 I173 R174 Q175	A167-N171 WeakPolarHBondContact O-CB 3.39Å; A167-N171 PolarHBondContact O-N 2.93Å; D168-N171 PolarHBondContact O-N 2.99Å; A169-N171 VanDerWaalsContact C-N 3.35Å; A169-N171 PolarHBondContact O-N 3.17Å; N171-I173 VanDerWaalsContact C-N 3.28Å; N171-I173 PolarHBondContact O-N 3.31Å; N171-R174 WeakPolarHBondContact O-CB 3.25Å; N171-R174 PolarHBondContact O-N 2.92Å; N171-Q175 PolarHBondContact ND2-NE2 2.97Å; N171-Q175 WeakPolarHBondContact O-CG 3.4Å; N171-Q175 PolarHBondContact O-N 2.99Å; N171-Q175 VanDerWaalsContact O-N 3.07Å; N171-Q175 PolarHBondContact OD1-NE2 2.93Å
172	A	98.8	Very high	95.6	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-60.2	-39	175.1	0	0	0	0	0	112.1	D168 A169 R170 Q175 T176 P390 L393 I394	D168-A172 WeakPolarHBondContact O-CB 3.4Å; D168-A172 PolarHBondContact O-N 3.47Å; A169-A172 PolarHBondContact O-N 3.21Å; R170-A172 PolarHBondContact O-N 3.21Å; A172-Q175 PolarHBondContact O-N 3.27Å; A172-T176 WeakPolarHBondContact O-CB 3.32Å; A172-T176 VanDerWaalsContact O-CG2 3.23Å; A172-T176 WeakPolarHBondContact O-CG2 3.39Å; A172-T176 PolarHBondContact O-N 3.37Å; A172-T176 VanDerWaalsContact O-N 3.13Å; A172-T176 PolarHBondContact O-OG1 3.43Å; A172-P390 HydrophobicContact CB-CB 3.75Å; A172-L393 HydrophobicContact CB-CD2 4.29Å; A172-I394 HydrophobicContact CB-CD1 3.82Å; A172-I394 HydrophobicContact CB-CG1 3.85Å
173	I	98.8	Very high	94.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.3	-44	175.3	-69.3	169.2	0	0	0	111.1	I160 A169 R170 N171 Q175 T176 W177 G178 F192 L393	I160-I173 HydrophobicContact CD1-CG2 3.79Å; I160-I173 HydrophobicContact CG2-CD1 4.08Å; A169-I173 VanDerWaalsContact O-CG1 3.23Å; A169-I173 WeakPolarHBondContact O-CG1 3.47Å; A169-I173 PolarHBondContact O-N 3.2Å; R170-I173 WeakPolarHBondContact O-CB 3.44Å; R170-I173 PolarHBondContact O-N 2.95Å; R170-I173 VanDerWaalsContact O-N 3.15Å; N171-I173 VanDerWaalsContact C-N 3.28Å; N171-I173 PolarHBondContact O-N 3.31Å; I173-Q175 PolarHBondContact O-N 2.96Å; I173-T176 CarbonylContact O-C 3.58Å; I173-T176 PolarHBondContact O-N 3.49Å; I173-W177 HydrophobicContact CB-CZ2 4.21Å; I173-W177 HydrophobicContact CD1-CH2 3.88Å; I173-W177 HydrophobicContact CD1-CZ2 3.45Å; I173-W177 VanDerWaalsContact CD1-CZ2 3.45Å; I173-W177 HydrophobicContact CG1-CH2 4.12Å; I173-W177 HydrophobicContact CG1-CZ2 3.44Å; I173-W177 VanDerWaalsContact CG1-CZ2 3.44Å; I173-W177 HydrophobicContact CG2-CD2 4.14Å; I173-W177 HydrophobicContact CG2-CE3 4.07Å; I173-W177 HydrophobicContact CG2-CH2 3.68Å; I173-W177 HydrophobicContact CG2-CZ2 3.76Å; I173-W177 HydrophobicContact CG2-CZ3 3.83Å; I173-G178 VanDerWaalsContact O-CA 3.28Å; I173-G178 WeakPolarHBondContact O-CA 3.3Å; I173-G178 PolarHBondContact O-N 3.31Å; I173-F192 HydrophobicContact CB-CE1 4.26Å; I173-F192 HydrophobicContact CB-CZ 4.07Å; I173-F192 HydrophobicContact CD1-CE1 4.01Å; I173-F192 HydrophobicContact CG2-CE1 4.13Å; I173-F192 HydrophobicContact CG2-CZ 3.96Å; I173-L393 HydrophobicContact CG1-CD2 3.99Å
174	R	98.3	Very high	92.8	Very high	19 Å²	19	43.6 Å²	43.6	7%	0.072	25%	0.247	C	C	.	.	H	α-helix	trans	-56.5	-36.6	175.5	-59.9	-166	-179.6	95.6	3	112.1	R170 N171 N179 F192 E211 D217	R170-R174 WeakPolarHBondContact O-CG 3.4Å; R170-R174 PolarHBondContact O-N 3.36Å; N171-R174 WeakPolarHBondContact O-CB 3.25Å; N171-R174 PolarHBondContact O-N 2.92Å; R174-N179 WeakPolarHBondContact O-CA 3.32Å; R174-N179 VanDerWaalsContact O-CB 3.24Å; R174-N179 WeakPolarHBondContact O-CB 3.39Å; R174-F192 HydrophobicContact CG-CE2 4.15Å; R174-F192 HydrophobicContact CG-CZ 4.37Å; R174-E211 IonicContact CZ-OE1 2.68Å; R174-E211 IonicContact NH1-OE1 3.7Å; R174-E211 PolarHBondContact NH1-OE1 2.82Å; R174-E211 IonicContact NH2-OE1 3.85Å; R174-E211 PolarHBondContact NH2-OE1 2.98Å; R174-D217 IonicContact CZ-OD1 3.15Å; R174-D217 IonicContact CZ-OD2 3.1Å; R174-D217 IonicContact NE-OD1 3.62Å; R174-D217 PolarHBondContact NE-OD1 3.5Å; R174-D217 IonicContact NE-OD2 3.82Å; R174-D217 PolarHBondContact NE-OD2 3.27Å; R174-D217 IonicContact NH2-OD1 2.87Å; R174-D217 PolarHBondContact NH2-OD1 3.1Å; R174-D217 IonicContact NH2-OD2 2.65Å
175	Q	97.6	Very high	91.6	Very high	93 Å²	93	47.2 Å²	47.2	44%	0.435	29%	0.285	S	S	.	.	H	α-helix	trans	-82.2	-11.9	180	-67.4	174.4	47.2	0	0	113.9	N171 A172 I173	N171-Q175 PolarHBondContact ND2-NE2 2.97Å; N171-Q175 WeakPolarHBondContact O-CG 3.4Å; N171-Q175 PolarHBondContact O-N 2.99Å; N171-Q175 VanDerWaalsContact O-N 3.07Å; N171-Q175 PolarHBondContact OD1-NE2 2.93Å; A172-Q175 PolarHBondContact O-N 3.27Å; I173-Q175 PolarHBondContact O-N 2.96Å
176	T	97.8	Very high	90.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-121.1	-171.5	60.5	0	0	0	0	112	A172 I173 G178 N179 L393 I394 W397	A172-T176 WeakPolarHBondContact O-CB 3.32Å; A172-T176 VanDerWaalsContact O-CG2 3.23Å; A172-T176 WeakPolarHBondContact O-CG2 3.39Å; A172-T176 PolarHBondContact O-N 3.37Å; A172-T176 VanDerWaalsContact O-N 3.13Å; A172-T176 PolarHBondContact O-OG1 3.43Å; I173-T176 CarbonylContact O-C 3.58Å; I173-T176 PolarHBondContact O-N 3.49Å; T176-G178 PolarHBondContact O-N 2.86Å; T176-N179 WeakPolarHBondContact O-CB 3.17Å; T176-N179 PolarHBondContact O-N 2.76Å; T176-N179 VanDerWaalsContact O-N 3.09Å; T176-L393 HydrophobicContact CG2-CG 4.42Å; T176-I394 HydrophobicContact CG2-CB 4.33Å; T176-I394 HydrophobicContact CG2-CG1 3.95Å; T176-W397 VanDerWaalsContact CB-CG 3.46Å; T176-W397 HydrophobicContact CG2-CB 3.58Å; T176-W397 HydrophobicContact CG2-CG 3.66Å
177	W	97.3	Very high	90	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-22.2	-173.3	55.7	-101.1	0	0	0	113.8	L158 I160 I173 N179 T254 M258 I260 T262 W397	L158-W177 HydrophobicContact CD1-CE3 4.05Å; L158-W177 HydrophobicContact CD1-CZ3 3.93Å; I160-W177 HydrophobicContact CD1-CH2 3.53Å; I160-W177 HydrophobicContact CD1-CZ3 3.57Å; I160-W177 HydrophobicContact CG1-CH2 4.01Å; I160-W177 HydrophobicContact CG1-CZ3 4.21Å; I160-W177 HydrophobicContact CG2-CH2 4.3Å; I173-W177 HydrophobicContact CB-CZ2 4.21Å; I173-W177 HydrophobicContact CD1-CH2 3.88Å; I173-W177 HydrophobicContact CD1-CZ2 3.45Å; I173-W177 VanDerWaalsContact CD1-CZ2 3.45Å; I173-W177 HydrophobicContact CG1-CH2 4.12Å; I173-W177 HydrophobicContact CG1-CZ2 3.44Å; I173-W177 VanDerWaalsContact CG1-CZ2 3.44Å; I173-W177 HydrophobicContact CG2-CD2 4.14Å; I173-W177 HydrophobicContact CG2-CE3 4.07Å; I173-W177 HydrophobicContact CG2-CH2 3.68Å; I173-W177 HydrophobicContact CG2-CZ2 3.76Å; I173-W177 HydrophobicContact CG2-CZ3 3.83Å; W177-N179 VanDerWaalsContact C-N 3.3Å; W177-T254 HydrophobicContact CH2-CG2 3.8Å; W177-T254 HydrophobicContact CZ3-CG2 4.22Å; W177-M258 PolarHBondContact NE1-O 2.96Å; W177-I260 HydrophobicContact CB-CB 4.26Å; W177-I260 WeakPolarHBondContact CB-O 3.38Å; W177-I260 HydrophobicContact CD2-CB 3.78Å; W177-I260 HydrophobicContact CD2-CG1 3.85Å; W177-I260 HydrophobicContact CE3-CB 3.83Å; W177-I260 HydrophobicContact CE3-CG1 3.82Å; W177-I260 HydrophobicContact CG-CB 4Å; W177-I260 HydrophobicContact CG-CG1 4.49Å; W177-I260 HydrophobicContact CH2-CG1 4.03Å; W177-I260 HydrophobicContact CZ2-CG1 4.04Å; W177-I260 HydrophobicContact CZ3-CB 4.41Å; W177-I260 HydrophobicContact CZ3-CG1 3.92Å; W177-T262 PolarHBondContact O-OG1 3.23Å; W177-W397 HydrophobicContact CB-CE3 3.94Å; W177-W397 HydrophobicContact CB-CH2 3.84Å; W177-W397 HydrophobicContact CB-CZ2 4.47Å; W177-W397 HydrophobicContact CB-CZ3 3.54Å
178	G	96.8	Very high	89.7	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-13.4	175.4	0	0	0	0	0	112.8	I173 T176 E180 F188 R190	I173-G178 VanDerWaalsContact O-CA 3.28Å; I173-G178 WeakPolarHBondContact O-CA 3.3Å; I173-G178 PolarHBondContact O-N 3.31Å; T176-G178 PolarHBondContact O-N 2.86Å; G178-E180 PolarHBondContact O-N 2.86Å; G178-F188 VanDerWaalsContact O-CE2 3.3Å; G178-F188 WeakPolarHBondContact O-CE2 3.46Å; G178-F188 WeakPolarHBondContact O-CZ 3.37Å; G178-R190 VanDerWaalsContact C-NH1 3.34Å; G178-R190 PolarHBondContact O-NH1 3.35Å
179	N	94.6	Very high	89.5	Confident	57 Å²	57	34.4 Å²	34.4	31%	0.305	23%	0.232	S	C	.	.			trans	-63.1	118.3	-176.2	-173.4	-28	0	0	0	110.8	R174 T176 W177 S181 V182 F188	R174-N179 WeakPolarHBondContact O-CA 3.32Å; R174-N179 VanDerWaalsContact O-CB 3.24Å; R174-N179 WeakPolarHBondContact O-CB 3.39Å; T176-N179 WeakPolarHBondContact O-CB 3.17Å; T176-N179 PolarHBondContact O-N 2.76Å; T176-N179 VanDerWaalsContact O-N 3.09Å; W177-N179 VanDerWaalsContact C-N 3.3Å; N179-S181 VanDerWaalsContact CG-OG 3.25Å; N179-S181 PolarHBondContact O-N 3.49Å; N179-S181 WeakPolarHBondContact OD1-CB 3.34Å; N179-S181 PolarHBondContact OD1-N 2.9Å; N179-S181 VanDerWaalsContact OD1-N 3.09Å; N179-S181 PolarHBondContact OD1-OG 3.41Å; N179-V182 HydrophobicContact CB-CG2 3.92Å; N179-V182 VanDerWaalsContact O-CB 3.24Å; N179-V182 WeakPolarHBondContact O-CB 3.37Å; N179-V182 VanDerWaalsContact O-CG2 3.24Å; N179-V182 WeakPolarHBondContact O-CG2 3.29Å; N179-V182 PolarHBondContact O-N 2.72Å; N179-F188 WeakPolarHBondContact O-CE1 3.45Å; N179-F188 WeakPolarHBondContact O-CZ 3.31Å
180	E	86.1	Confident	89.4	Confident	78 Å²	78	34.9 Å²	34.9	36%	0.364	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-62.4	-21.2	-172.3	-59.6	-175.8	172.6	0	0	112.9	G178 V182 F188 R190	G178-E180 PolarHBondContact O-N 2.86Å; E180-V182 VanDerWaalsContact C-N 3.26Å; E180-V182 PolarHBondContact O-N 3.43Å; E180-F188 HydrophobicContact CG-CE2 4.26Å; E180-F188 VanDerWaalsContact CG-O 3.3Å; E180-F188 WeakPolarHBondContact CG-O 3.35Å; E180-R190 PolarHBondContact OE1-N 2.82Å; E180-R190 VanDerWaalsContact OE1-N 3.08Å
181	S	83.8	Confident	89.4	Confident	90 Å²	90	34.7 Å²	34.7	63%	0.629	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-69.8	-16.2	173.5	66.1	0	0	0	0	114.5	N179 A183	N179-S181 VanDerWaalsContact CG-OG 3.25Å; N179-S181 PolarHBondContact O-N 3.49Å; N179-S181 WeakPolarHBondContact OD1-CB 3.34Å; N179-S181 PolarHBondContact OD1-N 2.9Å; N179-S181 VanDerWaalsContact OD1-N 3.09Å; N179-S181 PolarHBondContact OD1-OG 3.41Å; S181-A183 PolarHBondContact O-N 3.2Å
182	V	79.9	Confident	89.4	Confident	34 Å²	34	31.9 Å²	31.9	21%	0.206	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-65.2	-23.2	-175.4	169.9	0	0	0	0	112.8	N179 E180 F188 W397	N179-V182 HydrophobicContact CB-CG2 3.92Å; N179-V182 VanDerWaalsContact O-CB 3.24Å; N179-V182 WeakPolarHBondContact O-CB 3.37Å; N179-V182 VanDerWaalsContact O-CG2 3.24Å; N179-V182 WeakPolarHBondContact O-CG2 3.29Å; N179-V182 PolarHBondContact O-N 2.72Å; E180-V182 VanDerWaalsContact C-N 3.26Å; E180-V182 PolarHBondContact O-N 3.43Å; V182-F188 HydrophobicContact CB-CE1 4.47Å; V182-W397 HydrophobicContact CG1-CH2 4.07Å; V182-W397 HydrophobicContact CG1-CZ2 3.99Å; V182-W397 HydrophobicContact CG2-CZ2 3.82Å
183	A	71.3	Confident	89.4	Confident	5 Å²	5	31.8 Å²	31.8	4%	0.041	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-103.1	24.5	-173.8	0	0	0	0	0	115.2	S181 G185 L186 F188 I266	S181-A183 PolarHBondContact O-N 3.2Å; A183-G185 PolarHBondContact O-N 2.94Å; A183-L186 PolarHBondContact O-N 2.94Å; A183-F188 HydrophobicContact CB-CD1 3.52Å; A183-F188 HydrophobicContact CB-CE1 3.79Å; A183-I266 HydrophobicContact CB-CD1 3.52Å
184	G	65.5	Low	89.3	Confident	74 Å²	74	31.8 Å²	31.8	76%	0.763	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	46	160.9	0	0	0	0	0	116.1	L186	G184-L186 PolarHBondContact O-N 3.3Å
185	G	70.9	Confident	89.3	Confident	84 Å²	84	30.9 Å²	30.9	87%	0.866	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.8	-7.4	173	0	0	0	0	0	116.4	A183 G187	A183-G185 PolarHBondContact O-N 2.94Å; G185-G187 PolarHBondContact O-N 2.85Å
186	L	79.4	Confident	89.1	Confident	64 Å²	64	27.9 Å²	27.9	34%	0.335	20%	0.2	S	C	.	.	S	Bend	trans	-66.9	-20.4	172.7	-75.5	160.5	0	0	0	113.1	F155 A183 G184 I266 P272	F155-L186 HydrophobicContact CB-CB 4.41Å; A183-L186 PolarHBondContact O-N 2.94Å; G184-L186 PolarHBondContact O-N 3.3Å; L186-I266 HydrophobicContact CD1-CG2 3.65Å; L186-P272 HydrophobicContact CD1-CB 3.95Å; L186-P272 HydrophobicContact CD1-CG 3.65Å; L186-P272 HydrophobicContact CD2-CB 3.55Å; L186-P272 HydrophobicContact CD2-CG 4.07Å; L186-P272 HydrophobicContact CG-CB 4.42Å
187	G	80.7	Confident	88.6	Confident	35 Å²	35	28.9 Å²	28.9	36%	0.361	21%	0.21	S	C	.	.			trans	70.3	120.8	-177.6	0	0	0	0	0	111.9	F155 G185	F155-G187 PolarHBondContact N-O 2.97Å; G185-G187 PolarHBondContact O-N 2.85Å
188	F	91.4	Very high	87.9	Confident	3 Å²	3	34.3 Å²	34.3	1%	0.013	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	151.5	160.8	75.5	-92.8	0	0	0	109.4	L156 L158 G178 N179 E180 V182 A183 T262 I266	L156-F188 HydrophobicContact CB-CB 3.77Å; L156-F188 HydrophobicContact CG-CB 4.35Å; L156-F188 CarbonylContact O-C 3.5Å; L156-F188 WeakPolarHBondContact O-CA 3.33Å; L156-F188 WeakPolarHBondContact O-CB 3.37Å; L158-F188 HydrophobicContact CD1-CD2 3.78Å; L158-F188 HydrophobicContact CD1-CE2 3.43Å; L158-F188 VanDerWaalsContact CD1-CE2 3.43Å; L158-F188 HydrophobicContact CD1-CZ 4.33Å; L158-F188 HydrophobicContact CG-CD2 3.95Å; L158-F188 HydrophobicContact CG-CE2 4.14Å; G178-F188 VanDerWaalsContact O-CE2 3.3Å; G178-F188 WeakPolarHBondContact O-CE2 3.46Å; G178-F188 WeakPolarHBondContact O-CZ 3.37Å; N179-F188 WeakPolarHBondContact O-CE1 3.45Å; N179-F188 WeakPolarHBondContact O-CZ 3.31Å; E180-F188 HydrophobicContact CG-CE2 4.26Å; E180-F188 VanDerWaalsContact CG-O 3.3Å; E180-F188 WeakPolarHBondContact CG-O 3.35Å; V182-F188 HydrophobicContact CB-CE1 4.47Å; A183-F188 HydrophobicContact CB-CD1 3.52Å; A183-F188 HydrophobicContact CB-CE1 3.79Å; F188-T262 HydrophobicContact CD1-CG2 4.35Å; F188-T262 HydrophobicContact CE1-CG2 3.94Å; F188-T262 HydrophobicContact CE2-CG2 4.48Å; F188-T262 HydrophobicContact CZ-CG2 3.99Å; F188-I266 HydrophobicContact CD1-CD1 4.44Å
189	I	94.1	Very high	86.5	Confident	11 Å²	11	40.7 Å²	40.7	6%	0.056	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.8	-179.6	-71.4	171.6	0	0	0	108.8	K148 C149 P154 L156 I157 L158 L191	K148-I189 HydrophobicContact CD-CG2 4.09Å; K148-I189 HydrophobicContact CG-CD1 3.98Å; K148-I189 HydrophobicContact CG-CG1 4.44Å; K148-I189 HydrophobicContact CG-CG2 3.99Å; K148-I189 WeakPolarHBondContact O-CD1 3.34Å; C149-I189 VanDerWaalsContact SG-CD1 3.51Å; P154-I189 HydrophobicContact CB-CD1 3.94Å; P154-I189 HydrophobicContact CB-CG1 3.98Å; P154-I189 HydrophobicContact CG-CD1 3.6Å; P154-I189 HydrophobicContact CG-CG1 4.14Å; L156-I189 PolarHBondContact O-N 2.85Å; I157-I189 CarbonylContact C-O 3.59Å; I157-I189 WeakPolarHBondContact CA-O 3.03Å; I157-I189 HydrophobicContact CG1-CB 4.17Å; L158-I189 PolarHBondContact N-O 2.89Å; I189-L191 HydrophobicContact CG2-CD1 4.48Å; I189-L191 HydrophobicContact CG2-CD2 4.45Å; I189-L191 HydrophobicContact CG2-CG 4.01Å
190	R	96.6	Very high	85.4	Confident	21 Å²	21	43.2 Å²	43.2	8%	0.079	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.8	169.6	-176.9	-179	63.4	-102.4	-6	110.4	K148 I160 G178 E180 F192 D217	K148-R190 PolarHBondContact NZ-O 3.27Å; I160-R190 HydrophobicContact CD1-CG 3.56Å; G178-R190 VanDerWaalsContact C-NH1 3.34Å; G178-R190 PolarHBondContact O-NH1 3.35Å; E180-R190 PolarHBondContact OE1-N 2.82Å; E180-R190 VanDerWaalsContact OE1-N 3.08Å; R190-F192 HydrophobicContact CG-CE2 4.4Å; R190-F192 HydrophobicContact CG-CZ 4.39Å; R190-D217 IonicContact CZ-OD2 3.26Å; R190-D217 IonicContact NE-OD2 3.76Å; R190-D217 PolarHBondContact NE-OD2 2.94Å; R190-D217 VanDerWaalsContact NE-OD2 3.15Å; R190-D217 IonicContact NH2-OD2 2.66Å; R190-D217 PolarHBondContact NH2-OD2 2.79Å; R190-D217 WeakPolarHBondContact O-CB 3.49Å
191	L	98.4	Very high	85.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	125.4	171.9	-69.2	175.3	0	0	0	111	K148 I157 L158 L159 I160 I189 D217 I219 W240	K148-L191 HydrophobicContact CD-CD2 4.18Å; I157-L191 HydrophobicContact CG2-CD1 4.49Å; L158-L191 PolarHBondContact O-N 3.14Å; L159-L191 HydrophobicContact CD2-CB 4.38Å; L159-L191 HydrophobicContact CD2-CD1 4.32Å; I160-L191 PolarHBondContact N-O 3.2Å; I189-L191 HydrophobicContact CG2-CD1 4.48Å; I189-L191 HydrophobicContact CG2-CD2 4.45Å; I189-L191 HydrophobicContact CG2-CG 4.01Å; L191-D217 CarbonylContact C-O 3.54Å; L191-D217 WeakPolarHBondContact CA-O 3.35Å; L191-I219 HydrophobicContact CD2-CG2 4.34Å; L191-W240 HydrophobicContact CD1-CD2 3.83Å; L191-W240 HydrophobicContact CD1-CE3 3.48Å; L191-W240 VanDerWaalsContact CD1-CE3 3.48Å; L191-W240 HydrophobicContact CD1-CH2 3.69Å; L191-W240 HydrophobicContact CD1-CZ2 3.97Å; L191-W240 HydrophobicContact CD1-CZ3 3.44Å; L191-W240 VanDerWaalsContact CD1-CZ3 3.44Å
192	F	98.8	Very high	85.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	130	169.1	-63.7	-70.4	0	0	0	110.2	I160 A162 R170 I173 R174 R190 D217 I218 I219	I160-F192 HydrophobicContact CB-CD1 3.77Å; I160-F192 HydrophobicContact CB-CE1 4.09Å; I160-F192 HydrophobicContact CD1-CD1 4.24Å; I160-F192 HydrophobicContact CD1-CE1 3.81Å; I160-F192 HydrophobicContact CD1-CZ 4.37Å; I160-F192 HydrophobicContact CG2-CD1 3.79Å; I160-F192 HydrophobicContact CG2-CE1 3.86Å; I160-F192 CarbonylContact O-C 3.51Å; I160-F192 WeakPolarHBondContact O-CA 3.36Å; A162-F192 HydrophobicContact CB-CD1 4.4Å; R170-F192 HydrophobicContact CB-CD1 4.27Å; R170-F192 HydrophobicContact CB-CD2 4.21Å; R170-F192 HydrophobicContact CB-CE1 3.91Å; R170-F192 HydrophobicContact CB-CE2 3.83Å; R170-F192 HydrophobicContact CB-CG 4.41Å; R170-F192 HydrophobicContact CB-CZ 3.67Å; R170-F192 HydrophobicContact CG-CD1 3.61Å; R170-F192 HydrophobicContact CG-CD2 4.05Å; R170-F192 HydrophobicContact CG-CE1 3.7Å; R170-F192 HydrophobicContact CG-CE2 4.13Å; R170-F192 HydrophobicContact CG-CG 3.8Å; R170-F192 HydrophobicContact CG-CZ 3.96Å; R170-F192 WeakPolarHBondContact O-CZ 3.2Å; I173-F192 HydrophobicContact CB-CE1 4.26Å; I173-F192 HydrophobicContact CB-CZ 4.07Å; I173-F192 HydrophobicContact CD1-CE1 4.01Å; I173-F192 HydrophobicContact CG2-CE1 4.13Å; I173-F192 HydrophobicContact CG2-CZ 3.96Å; R174-F192 HydrophobicContact CG-CE2 4.15Å; R174-F192 HydrophobicContact CG-CZ 4.37Å; R190-F192 HydrophobicContact CG-CE2 4.4Å; R190-F192 HydrophobicContact CG-CZ 4.39Å; F192-D217 WeakPolarHBondContact CD2-O 3.19Å; F192-D217 WeakPolarHBondContact CE2-OD2 3.17Å; F192-D217 PolarHBondContact N-O 3.31Å; F192-I218 HydrophobicContact CB-CG1 4.38Å; F192-I219 PolarHBondContact O-N 3.09Å
193	L	98.8	Very high	86.1	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	112.2	-179.1	-50.9	-172.5	0	0	0	109.9	L159 I160 A162 I219 K233 M236	L159-L193 HydrophobicContact CB-CD1 4.09Å; L159-L193 HydrophobicContact CB-CG 4.48Å; L159-L193 HydrophobicContact CD2-CD2 4.19Å; I160-L193 PolarHBondContact O-N 3.01Å; A162-L193 PolarHBondContact N-O 2.92Å; A162-L193 VanDerWaalsContact O-O 3.08Å; L193-I219 HydrophobicContact CD2-CD1 3.38Å; L193-I219 HydrophobicContact CD2-CG1 3.51Å; L193-K233 HydrophobicContact CB-CD 4.01Å; L193-K233 HydrophobicContact CB-CG 3.64Å; L193-K233 HydrophobicContact CD1-CG 4.23Å; L193-K233 WeakPolarHBondContact O-CD 3.37Å; L193-K233 WeakPolarHBondContact O-CE 3.29Å; L193-K233 PolarHBondContact O-NZ 3.42Å; L193-M236 HydrophobicContact CB-CE 3.63Å; L193-M236 HydrophobicContact CD2-CE 3.99Å; L193-M236 HydrophobicContact CG-CE 4.31Å
194	L	98.3	Very high	87.3	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	149.8	180	-55.7	-174.3	0	0	0	111.7	A162 I208 I218 I219 Q220 Q221 Y223	A162-L194 HydrophobicContact CB-CD2 3.98Å; A162-L194 WeakPolarHBondContact O-CD2 3.3Å; L194-I208 HydrophobicContact CD1-CD1 4.3Å; L194-I208 HydrophobicContact CD1-CG1 4.45Å; L194-I208 HydrophobicContact CD1-CG2 3.84Å; L194-I218 HydrophobicContact CD1-CD1 4.47Å; L194-I218 HydrophobicContact CD1-CG2 3.63Å; L194-I218 HydrophobicContact CG-CG2 4.06Å; L194-I219 PolarHBondContact N-O 2.95Å; L194-Q220 HydrophobicContact CB-CB 4.26Å; L194-Q220 HydrophobicContact CB-CG 4.02Å; L194-Q220 WeakPolarHBondContact O-CA 3.46Å; L194-Q221 PolarHBondContact O-N 2.04Å; L194-Y223 PolarHBondContact O-OH 2.94Å
195	G	96.4	Very high	88.7	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-167.6	155.6	0	0	0	0	0	110.9	Q220 Y223 D225	G195-Q220 PolarHBondContact O-NE2 3.39Å; G195-Y223 CarbonylContact C-O 3.52Å; G195-Y223 WeakPolarHBondContact CA-O 3.19Å; G195-Y223 PolarHBondContact N-OH 3.36Å; G195-D225 PolarHBondContact N-OD2 3.46Å
196	T	94.2	Very high	89.9	Confident	29 Å²	29	45 Å²	45	18%	0.178	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	147.9	171.3	57.1	0	0	0	0	111.1	I142 Y223 D225	I142-T196 HydrophobicContact CD1-CG2 3.49Å; I142-T196 VanDerWaalsContact CD1-CG2 3.49Å; T196-Y223 PolarHBondContact N-O 3.02Å; T196-Y223 VanDerWaalsContact OG1-C 3.31Å; T196-Y223 PolarHBondContact OG1-O 3.08Å; T196-Y223 VanDerWaalsContact OG1-O 3.09Å; T196-D225 WeakPolarHBondContact O-CB 3.14Å; T196-D225 PolarHBondContact O-N 3.14Å
197	G	88.3	Confident	90.7	Very high	21 Å²	21	44.5 Å²	44.5	22%	0.216	28%	0.275	C	S	.	.			trans	-69.5	-167.8	172.8	0	0	0	0	0	113.1	S199	G197-S199 PolarHBondContact O-N 2.98Å
198	K	80.9	Confident	91.5	Very high	114 Å²	114	42.9 Å²	42.9	50%	0.496	26%	0.258	S	S	.	.			trans	-61.6	137.3	167	-66.1	179.8	-177.5	175.2	0	107.9	D56 S200 D201	D56-K198 IonicContact OD2-NZ 2.74Å; D56-K198 PolarHBondContact OD2-NZ 3.29Å; K198-S200 PolarHBondContact O-N 2.89Å; K198-D201 PolarHBondContact O-N 3.1Å
199	S	68.3	Low	91.8	Very high	135 Å²	135	45.6 Å²	45.6	94%	0.944	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-11.4	-167	52.2	0	0	0	0	116.5	G197	G197-S199 PolarHBondContact O-N 2.98Å
200	S	72.3	Confident	92	Very high	110 Å²	110	49.7 Å²	49.7	77%	0.769	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-1.9	-179.9	62.3	0	0	0	0	114.8	K198 A202	K198-S200 PolarHBondContact O-N 2.89Å; S200-A202 PolarHBondContact O-N 2.98Å
201	D	84.5	Confident	92.1	Very high	37 Å²	37	49.8 Å²	49.8	20%	0.198	29%	0.291	C	S	.	.			trans	-96.7	70.1	-172	-158	-18.1	0	0	0	112.8	R165 K198 F203 L204 Q205	R165-D201 IonicContact CZ-OD2 3.15Å; R165-D201 IonicContact NH1-OD2 2.86Å; R165-D201 PolarHBondContact NH1-OD2 3.25Å; R165-D201 IonicContact NH2-OD2 3.47Å; R165-D201 PolarHBondContact NH2-OD2 3.27Å; K198-D201 PolarHBondContact O-N 3.1Å; D201-F203 VanDerWaalsContact C-N 3.27Å; D201-F203 PolarHBondContact O-N 3.3Å; D201-L204 HydrophobicContact CB-CB 3.97Å; D201-L204 HydrophobicContact CB-CD2 4.42Å; D201-L204 PolarHBondContact O-N 3.46Å; D201-L204 VanDerWaalsContact OD1-CB 3.23Å; D201-L204 WeakPolarHBondContact OD1-CB 3.12Å; D201-L204 PolarHBondContact OD1-N 3.3Å; D201-L204 WeakPolarHBondContact OD2-CB 3.4Å; D201-Q205 PolarHBondContact O-N 3.47Å
202	A	88.5	Confident	92.1	Very high	75 Å²	75	50 Å²	50	62%	0.62	29%	0.293	S	S	*	.	H	α-helix	trans	-61.1	-36.2	177.6	0	0	0	0	0	112.3	S200 L204 Q205 S206	S200-A202 PolarHBondContact O-N 2.98Å; A202-L204 PolarHBondContact O-N 2.93Å; A202-Q205 PolarHBondContact O-N 3.08Å; A202-S206 PolarHBondContact O-N 2.93Å; A202-S206 PolarHBondContact O-OG 2.8Å
203	F	91.7	Very high	92.1	Very high	163 Å²	163	56.9 Å²	56.9	72%	0.715	32%	0.319	S	S	*	.	H	α-helix	trans	-63.6	-42.3	179	-179.7	-93.3	0	0	0	112.1	D201 S206 S207	D201-F203 VanDerWaalsContact C-N 3.27Å; D201-F203 PolarHBondContact O-N 3.3Å; F203-S206 PolarHBondContact O-N 2.75Å; F203-S207 WeakPolarHBondContact O-CB 3.41Å; F203-S207 PolarHBondContact O-N 3.18Å; F203-S207 PolarHBondContact O-OG 2.99Å
204	L	94.6	Very high	92	Very high	22 Å²	22	61 Å²	61	12%	0.115	34%	0.344	C	S	.	.	H	α-helix	trans	-61	-44.4	174.9	178	61.2	0	0	0	111.8	P164 R165 D201 A202 S207 I208	P164-L204 HydrophobicContact CB-CD2 3.94Å; P164-L204 HydrophobicContact CB-CG 4.35Å; R165-L204 HydrophobicContact CG-CD1 4.12Å; R165-L204 HydrophobicContact CG-CD2 3.8Å; D201-L204 HydrophobicContact CB-CB 3.97Å; D201-L204 HydrophobicContact CB-CD2 4.42Å; D201-L204 PolarHBondContact O-N 3.46Å; D201-L204 VanDerWaalsContact OD1-CB 3.23Å; D201-L204 WeakPolarHBondContact OD1-CB 3.12Å; D201-L204 PolarHBondContact OD1-N 3.3Å; D201-L204 WeakPolarHBondContact OD2-CB 3.4Å; A202-L204 PolarHBondContact O-N 2.93Å; L204-S207 PolarHBondContact O-N 2.86Å; L204-I208 HydrophobicContact CD1-CD1 4.11Å; L204-I208 HydrophobicContact CG-CD1 4.03Å; L204-I208 WeakPolarHBondContact O-CG1 3.33Å; L204-I208 PolarHBondContact O-N 3.24Å
205	Q	95.8	Very high	92	Very high	38 Å²	38	66 Å²	66	18%	0.178	36%	0.363	C	S	.	.	H	α-helix	trans	-63.7	-45.3	179.1	-174.8	58.7	31.1	0	0	111.4	D201 A202 S207 I208 E209	D201-Q205 PolarHBondContact O-N 3.47Å; A202-Q205 PolarHBondContact O-N 3.08Å; Q205-S207 VanDerWaalsContact C-N 3.29Å; Q205-S207 PolarHBondContact O-N 3.4Å; Q205-I208 PolarHBondContact O-N 3.28Å; Q205-I208 VanDerWaalsContact O-N 3.12Å; Q205-E209 WeakPolarHBondContact O-CG 3.47Å; Q205-E209 PolarHBondContact O-N 3.01Å
206	S	95.8	Very high	92	Very high	68 Å²	68	70.7 Å²	70.7	48%	0.476	39%	0.385	S	S	.	.	H	α-helix	trans	-61.1	-36.1	175.7	-61	0	0	0	0	112.9	A202 F203 E209 E210	A202-S206 PolarHBondContact O-N 2.93Å; A202-S206 PolarHBondContact O-OG 2.8Å; F203-S206 PolarHBondContact O-N 2.75Å; S206-E209 PolarHBondContact O-N 3.33Å; S206-E210 PolarHBondContact O-N 3.48Å
207	S	96.9	Very high	92.2	Very high	52 Å²	52	69.3 Å²	69.3	36%	0.364	38%	0.377	S	S	.	.	H	α-helix	trans	-66.6	-37	174.8	-57.7	0	0	0	0	112.4	F203 L204 Q205 E211	F203-S207 WeakPolarHBondContact O-CB 3.41Å; F203-S207 PolarHBondContact O-N 3.18Å; F203-S207 PolarHBondContact O-OG 2.99Å; L204-S207 PolarHBondContact O-N 2.86Å; Q205-S207 VanDerWaalsContact C-N 3.29Å; Q205-S207 PolarHBondContact O-N 3.4Å; S207-E211 WeakPolarHBondContact O-CB 3.46Å; S207-E211 PolarHBondContact O-N 2.84Å
208	I	98	Very high	92.7	Very high	2 Å²	2	68.3 Å²	68.3	1%	0.01	37%	0.366	C	S	.	.	H	α-helix	trans	-70.5	-40.3	176.7	-69.4	163.6	0	0	0	111.1	L143 P164 L194 L204 Q205 E210 E211 S212 I218	L143-I208 HydrophobicContact CD1-CG2 3.85Å; P164-I208 HydrophobicContact CB-CD1 3.66Å; L194-I208 HydrophobicContact CD1-CD1 4.3Å; L194-I208 HydrophobicContact CD1-CG1 4.45Å; L194-I208 HydrophobicContact CD1-CG2 3.84Å; L204-I208 HydrophobicContact CD1-CD1 4.11Å; L204-I208 HydrophobicContact CG-CD1 4.03Å; L204-I208 WeakPolarHBondContact O-CG1 3.33Å; L204-I208 PolarHBondContact O-N 3.24Å; Q205-I208 PolarHBondContact O-N 3.28Å; Q205-I208 VanDerWaalsContact O-N 3.12Å; I208-E210 VanDerWaalsContact C-N 3.34Å; I208-E211 PolarHBondContact O-N 3.47Å; I208-S212 WeakPolarHBondContact O-CB 3.48Å; I208-S212 PolarHBondContact O-N 3.34Å; I208-I218 HydrophobicContact CG2-CD1 4.31Å; I208-I218 HydrophobicContact CG2-CG2 4.3Å
209	E	97.8	Very high	93.5	Very high	60 Å²	60	62.9 Å²	62.9	28%	0.28	34%	0.343	S	S	.	.	H	α-helix	trans	-61.5	-43.9	175	-71.9	169.4	-170.2	0	0	111.4	Q205 S206 S212 R213	Q205-E209 WeakPolarHBondContact O-CG 3.47Å; Q205-E209 PolarHBondContact O-N 3.01Å; S206-E209 PolarHBondContact O-N 3.33Å; E209-S212 WeakPolarHBondContact O-CB 3.46Å; E209-S212 PolarHBondContact O-N 3.38Å; E209-R213 WeakPolarHBondContact O-CG 3.24Å; E209-R213 PolarHBondContact O-N 3.25Å; E209-R213 IonicContact OE2-NH2 3.36Å
210	E	98.1	Very high	94.9	Very high	97 Å²	97	56.4 Å²	56.4	45%	0.453	30%	0.298	S	S	.	.	H	α-helix	trans	-63.9	-43.9	175.3	-173.1	57.8	-155	0	0	111.7	S206 I208 S212 R213 V214	S206-E210 PolarHBondContact O-N 3.48Å; I208-E210 VanDerWaalsContact C-N 3.34Å; E210-S212 VanDerWaalsContact C-N 3.29Å; E210-S212 PolarHBondContact O-N 3.3Å; E210-R213 PolarHBondContact O-N 2.86Å; E210-R213 IonicContact OE2-CZ 3.63Å; E210-R213 IonicContact OE2-NH1 3.15Å; E210-R213 PolarHBondContact OE2-NH1 2.83Å; E210-V214 WeakPolarHBondContact O-CG2 3.24Å; E210-V214 PolarHBondContact O-N 3.03Å; E210-V214 VanDerWaalsContact O-N 3.15Å
211	E	98.4	Very high	96.1	Very high	23 Å²	23	51.3 Å²	51.3	11%	0.107	26%	0.262	C	S	.	.	H	α-helix	trans	-58	-42.8	173.6	-172.8	-176.1	178.4	0	0	111.7	R170 R174 S207 I208 V214 Y215 I218	R170-E211 IonicContact CZ-OE1 3.91Å; R170-E211 IonicContact CZ-OE2 3.14Å; R170-E211 VanDerWaalsContact CZ-OE2 3.26Å; R170-E211 IonicContact NE-OE1 2.66Å; R170-E211 PolarHBondContact NE-OE1 3.21Å; R170-E211 IonicContact NE-OE2 2.68Å; R170-E211 PolarHBondContact NE-OE2 3.37Å; R170-E211 VanDerWaalsContact NE-OE2 3.1Å; R170-E211 IonicContact NH2-OE1 3.31Å; R170-E211 IonicContact NH2-OE2 3.64Å; R170-E211 PolarHBondContact NH2-OE2 2.86Å; R174-E211 IonicContact CZ-OE1 2.68Å; R174-E211 IonicContact NH1-OE1 3.7Å; R174-E211 PolarHBondContact NH1-OE1 2.82Å; R174-E211 IonicContact NH2-OE1 3.85Å; R174-E211 PolarHBondContact NH2-OE1 2.98Å; S207-E211 WeakPolarHBondContact O-CB 3.46Å; S207-E211 PolarHBondContact O-N 2.84Å; I208-E211 PolarHBondContact O-N 3.47Å; E211-V214 PolarHBondContact O-N 3.37Å; E211-Y215 HydrophobicContact CG-CD2 3.7Å; E211-Y215 HydrophobicContact CG-CE2 4.1Å; E211-Y215 VanDerWaalsContact O-CD2 3.3Å; E211-Y215 WeakPolarHBondContact O-CD2 3.47Å; E211-Y215 PolarHBondContact O-N 3.3Å; E211-I218 HydrophobicContact CB-CD1 4.08Å; E211-I218 HydrophobicContact CG-CD1 3.8Å
212	S	98.3	Very high	96.5	Very high	5 Å²	5	52.7 Å²	52.7	4%	0.035	27%	0.269	C	S	.	.	H	α-helix	trans	-64.1	-40.1	177.7	-158.9	0	0	0	0	111.9	E145 I208 E209 E210 V214 H216	E145-S212 PolarHBondContact OE1-OG 3.39Å; I208-S212 WeakPolarHBondContact O-CB 3.48Å; I208-S212 PolarHBondContact O-N 3.34Å; E209-S212 WeakPolarHBondContact O-CB 3.46Å; E209-S212 PolarHBondContact O-N 3.38Å; E210-S212 VanDerWaalsContact C-N 3.29Å; E210-S212 PolarHBondContact O-N 3.3Å; S212-V214 PolarHBondContact O-N 3.29Å; S212-H216 VanDerWaalsContact O-CA 3.3Å; S212-H216 WeakPolarHBondContact O-CA 3.29Å; S212-H216 PolarHBondContact O-N 3.47Å
213	R	97.9	Very high	96.8	Very high	144 Å²	144	49.3 Å²	49.3	54%	0.543	24%	0.24	S	C	.	.	H	α-helix	trans	-62.2	-32	175.9	-71.9	175.3	-155.6	133.1	7.2	112.7	E209 E210 H216	E209-R213 WeakPolarHBondContact O-CG 3.24Å; E209-R213 PolarHBondContact O-N 3.25Å; E209-R213 IonicContact OE2-NH2 3.36Å; E210-R213 PolarHBondContact O-N 2.86Å; E210-R213 IonicContact OE2-CZ 3.63Å; E210-R213 IonicContact OE2-NH1 3.15Å; E210-R213 PolarHBondContact OE2-NH1 2.83Å; R213-H216 PolarHBondContact O-NE2 3.13Å
214	V	97.6	Very high	96.9	Very high	86 Å²	86	48.8 Å²	48.8	52%	0.521	23%	0.233	S	C	.	.	H	α-helix	trans	-83.3	-46.4	-178.7	174.4	0	0	0	0	111.7	E210 E211 S212	E210-V214 WeakPolarHBondContact O-CG2 3.24Å; E210-V214 PolarHBondContact O-N 3.03Å; E210-V214 VanDerWaalsContact O-N 3.15Å; E211-V214 PolarHBondContact O-N 3.37Å; S212-V214 PolarHBondContact O-N 3.29Å
215	Y	97.4	Very high	96.9	Very high	104 Å²	104	48.9 Å²	48.9	41%	0.408	23%	0.234	S	C	.	.	H	α-helix	trans	-103.9	-16	-168.3	-62.7	-72.3	0	0	0	114.6	E211 D217	E211-Y215 HydrophobicContact CG-CD2 3.7Å; E211-Y215 HydrophobicContact CG-CE2 4.1Å; E211-Y215 VanDerWaalsContact O-CD2 3.3Å; E211-Y215 WeakPolarHBondContact O-CD2 3.47Å; E211-Y215 PolarHBondContact O-N 3.3Å; Y215-D217 WeakPolarHBondContact CB-OD1 3.1Å; Y215-D217 PolarHBondContact O-N 3.18Å; Y215-D217 VanDerWaalsContact O-N 3.08Å
216	H	96.9	Very high	96.8	Very high	99 Å²	99	49.1 Å²	49.1	46%	0.458	24%	0.238	S	C	.	.			trans	49.7	34.3	-179.3	-68.3	-70.1	0	0	0	113.9	E145 K148 S212 R213	E145-H216 WeakPolarHBondContact OE1-CA 3.18Å; E145-H216 IonicContact OE1-ND1 2.69Å; E145-H216 IonicContact OE2-CG 2.73Å; E145-H216 IonicContact OE2-ND1 2.78Å; E145-H216 PolarHBondContact OE2-ND1 3.49Å; K148-H216 VanDerWaalsContact CD-O 3.29Å; K148-H216 WeakPolarHBondContact CD-O 3.41Å; K148-H216 WeakPolarHBondContact CE-O 3.44Å; K148-H216 PolarHBondContact NZ-O 3.25Å; S212-H216 VanDerWaalsContact O-CA 3.3Å; S212-H216 WeakPolarHBondContact O-CA 3.29Å; S212-H216 PolarHBondContact O-N 3.47Å; R213-H216 PolarHBondContact O-NE2 3.13Å
217	D	97.7	Very high	96.7	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.232	C	C	.	.			trans	-129.6	24.4	-172.2	70	-1.3	0	0	0	113.6	R174 R190 L191 F192 Y215	R174-D217 IonicContact CZ-OD1 3.15Å; R174-D217 IonicContact CZ-OD2 3.1Å; R174-D217 IonicContact NE-OD1 3.62Å; R174-D217 PolarHBondContact NE-OD1 3.5Å; R174-D217 IonicContact NE-OD2 3.82Å; R174-D217 PolarHBondContact NE-OD2 3.27Å; R174-D217 IonicContact NH2-OD1 2.87Å; R174-D217 PolarHBondContact NH2-OD1 3.1Å; R174-D217 IonicContact NH2-OD2 2.65Å; R190-D217 IonicContact CZ-OD2 3.26Å; R190-D217 IonicContact NE-OD2 3.76Å; R190-D217 PolarHBondContact NE-OD2 2.94Å; R190-D217 VanDerWaalsContact NE-OD2 3.15Å; R190-D217 IonicContact NH2-OD2 2.66Å; R190-D217 PolarHBondContact NH2-OD2 2.79Å; R190-D217 WeakPolarHBondContact O-CB 3.49Å; L191-D217 CarbonylContact C-O 3.54Å; L191-D217 WeakPolarHBondContact CA-O 3.35Å; F192-D217 WeakPolarHBondContact CD2-O 3.19Å; F192-D217 WeakPolarHBondContact CE2-OD2 3.17Å; F192-D217 PolarHBondContact N-O 3.31Å; Y215-D217 WeakPolarHBondContact CB-OD1 3.1Å; Y215-D217 PolarHBondContact O-N 3.18Å; Y215-D217 VanDerWaalsContact O-N 3.08Å
218	I	98.7	Very high	96.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.9	179.4	-61.4	178.6	0	0	0	109.8	L143 E145 F192 L194 I208 E211	L143-I218 HydrophobicContact CD1-CG2 3.96Å; E145-I218 WeakPolarHBondContact CG-O 3.32Å; F192-I218 HydrophobicContact CB-CG1 4.38Å; L194-I218 HydrophobicContact CD1-CD1 4.47Å; L194-I218 HydrophobicContact CD1-CG2 3.63Å; L194-I218 HydrophobicContact CG-CG2 4.06Å; I208-I218 HydrophobicContact CG2-CD1 4.31Å; I208-I218 HydrophobicContact CG2-CG2 4.3Å; E211-I218 HydrophobicContact CB-CD1 4.08Å; E211-I218 HydrophobicContact CG-CD1 3.8Å
219	I	98.6	Very high	96.4	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	135.5	162.5	57.2	163.1	0	0	0	109.6	Y141 L143 E145 L191 F192 L193 L194 M236 W240	Y141-I219 HydrophobicContact CE1-CB 4.48Å; Y141-I219 HydrophobicContact CE1-CD1 4.38Å; L143-I219 WeakPolarHBondContact O-CA 3.5Å; E145-I219 HydrophobicContact CB-CG2 4.34Å; E145-I219 HydrophobicContact CG-CG2 4.43Å; L191-I219 HydrophobicContact CD2-CG2 4.34Å; F192-I219 PolarHBondContact O-N 3.09Å; L193-I219 HydrophobicContact CD2-CD1 3.38Å; L193-I219 HydrophobicContact CD2-CG1 3.51Å; L194-I219 PolarHBondContact N-O 2.95Å; I219-M236 HydrophobicContact CD1-CE 4.22Å; I219-M236 HydrophobicContact CG1-CE 4.19Å; I219-W240 HydrophobicContact CD1-CB 3.82Å; I219-W240 HydrophobicContact CD1-CG 3.82Å
220	Q	98.1	Very high	96.4	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	132.3	-173.3	-170.7	-175.5	28.9	0	0	110	Y141 I142 L143 L194 G195	Y141-Q220 CarbonylContact C-O 3.56Å; Y141-Q220 WeakPolarHBondContact CA-O 3.29Å; I142-Q220 HydrophobicContact CB-CB 4.49Å; I142-Q220 HydrophobicContact CD1-CG 4.41Å; I142-Q220 PolarHBondContact N-O 3.31Å; L143-Q220 HydrophobicContact CB-CB 3.99Å; L143-Q220 HydrophobicContact CD1-CB 4.19Å; L143-Q220 HydrophobicContact CG-CB 4.23Å; L143-Q220 PolarHBondContact N-O 3.49Å; L143-Q220 PolarHBondContact O-N 2.84Å; L194-Q220 HydrophobicContact CB-CB 4.26Å; L194-Q220 HydrophobicContact CB-CG 4.02Å; L194-Q220 WeakPolarHBondContact O-CA 3.46Å; G195-Q220 PolarHBondContact O-NE2 3.39Å
221	Q	96.3	Very high	96.3	Very high	3 Å²	3	50 Å²	50	1%	0.014	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	158.7	170.3	-80.4	-176	-17.6	0	0	112.1	Y139 R140 Y141 L194 Y223 M236	Y139-Q221 PolarHBondContact O-NE2 3.06Å; R140-Q221 VanDerWaalsContact O-CA 3.3Å; R140-Q221 WeakPolarHBondContact O-CA 3.37Å; Y141-Q221 HydrophobicContact CD1-CG 3.64Å; Y141-Q221 HydrophobicContact CD2-CG 4.37Å; Y141-Q221 HydrophobicContact CE1-CG 3.85Å; Y141-Q221 VanDerWaalsContact CE2-NE2 3.32Å; Y141-Q221 HydrophobicContact CG-CG 3.92Å; Y141-Q221 VanDerWaalsContact CZ-NE2 3.32Å; L194-Q221 PolarHBondContact O-N 2.04Å; Q221-Y223 HydrophobicContact CB-CD1 3.69Å; Q221-Y223 HydrophobicContact CB-CE1 3.77Å; Q221-Y223 PolarHBondContact O-N 3.26Å; Q221-M236 HydrophobicContact CB-CG 4.36Å; Q221-M236 HydrophobicContact CB-SD 3.54Å; Q221-M236 VanDerWaalsContact CB-SD 3.54Å; Q221-M236 HydrophobicContact CG-CG 3.69Å; Q221-M236 HydrophobicContact CG-SD 3.42Å; Q221-M236 WeakPolarHBondContact CG-SD 3.28Å
222	D	93.9	Very high	96.3	Very high	65 Å²	65	49.2 Å²	49.2	35%	0.348	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	56.4	-176.5	-157.6	-5.8	0	0	0	113.2	Y139 R140 I142	Y139-D222 WeakPolarHBondContact CD1-O 3.44Å; R140-D222 HydrophobicContact CG-CB 4.01Å; R140-D222 IonicContact CZ-OD2 3.61Å; R140-D222 IonicContact NE-OD2 3.64Å; R140-D222 PolarHBondContact NE-OD2 2.93Å; R140-D222 VanDerWaalsContact NE-OD2 3.15Å; R140-D222 IonicContact NH2-OD2 2.79Å; R140-D222 PolarHBondContact NH2-OD2 3.39Å; R140-D222 VanDerWaalsContact NH2-OD2 3.14Å; R140-D222 PolarHBondContact O-N 3.17Å; R140-D222 VanDerWaalsContact O-N 3.1Å; I142-D222 HydrophobicContact CD1-CB 3.95Å; I142-D222 HydrophobicContact CG1-CB 4.14Å
223	Y	93.4	Very high	96.2	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.016	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	146.4	171.3	69.1	-92.8	0	0	0	110.5	Y139 L194 G195 T196 Q221 D225 N229 T232 K233 M236	Y139-Y223 HydrophobicContact CD2-CD1 4.31Å; Y139-Y223 HydrophobicContact CG-CD1 4.38Å; L194-Y223 PolarHBondContact O-OH 2.94Å; G195-Y223 CarbonylContact C-O 3.52Å; G195-Y223 WeakPolarHBondContact CA-O 3.19Å; G195-Y223 PolarHBondContact N-OH 3.36Å; T196-Y223 PolarHBondContact N-O 3.02Å; T196-Y223 VanDerWaalsContact OG1-C 3.31Å; T196-Y223 PolarHBondContact OG1-O 3.08Å; T196-Y223 VanDerWaalsContact OG1-O 3.09Å; Q221-Y223 HydrophobicContact CB-CD1 3.69Å; Q221-Y223 HydrophobicContact CB-CE1 3.77Å; Q221-Y223 PolarHBondContact O-N 3.26Å; Y223-D225 PolarHBondContact O-N 3.2Å; Y223-N229 HydrophobicContact CD2-CB 3.98Å; Y223-N229 HydrophobicContact CE2-CB 4.22Å; Y223-T232 HydrophobicContact CD1-CG2 3.72Å; Y223-T232 HydrophobicContact CD2-CG2 4.33Å; Y223-T232 HydrophobicContact CE1-CG2 4.05Å; Y223-T232 HydrophobicContact CG-CG2 3.91Å; Y223-K233 HydrophobicContact CE2-CB 4.37Å; Y223-K233 WeakPolarHBondContact OH-CA 3.44Å; Y223-K233 WeakPolarHBondContact OH-CB 3.36Å; Y223-K233 WeakPolarHBondContact OH-CE 3.37Å; Y223-K233 VanDerWaalsContact OH-CG 3.23Å; Y223-K233 WeakPolarHBondContact OH-CG 3.36Å; Y223-M236 HydrophobicContact CE1-SD 4.01Å
224	R	94.1	Very high	96.3	Very high	152 Å²	152	42.4 Å²	42.4	57%	0.574	20%	0.195	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-64	121.3	179.1	-172.5	-177.3	171	170.1	-4	111.1	T226 N229	R224-T226 HydrophobicContact CG-CG2 3.99Å; R224-T226 PolarHBondContact O-N 3.48Å; R224-N229 PolarHBondContact O-ND2 2.82Å
225	D	95.1	Very high	96.3	Very high	25 Å²	25	38.8 Å²	38.8	13%	0.134	17%	0.172	C	C	.	.			trans	-74.7	107.8	-178.6	-152.3	-29.1	0	0	0	111	P164 G195 T196 Y223 K233	P164-D225 WeakPolarHBondContact CD-OD2 3.28Å; P164-D225 HydrophobicContact CG-CB 3.99Å; G195-D225 PolarHBondContact N-OD2 3.46Å; T196-D225 WeakPolarHBondContact O-CB 3.14Å; T196-D225 PolarHBondContact O-N 3.14Å; Y223-D225 PolarHBondContact O-N 3.2Å; D225-K233 VanDerWaalsContact OD1-CE 3.29Å; D225-K233 WeakPolarHBondContact OD1-CE 3.1Å; D225-K233 IonicContact OD1-NZ 3.76Å; D225-K233 PolarHBondContact OD1-NZ 3Å; D225-K233 VanDerWaalsContact OD2-CE 3.3Å; D225-K233 WeakPolarHBondContact OD2-CE 3.48Å; D225-K233 IonicContact OD2-NZ 3.39Å; D225-K233 PolarHBondContact OD2-NZ 3.07Å
226	T	94.6	Very high	96.3	Very high	43 Å²	43	34 Å²	34	26%	0.264	15%	0.153	S	C	.	.			trans	-145.7	159.9	178.2	67.3	0	0	0	0	109.2	R224 Y228 N229	R224-T226 HydrophobicContact CG-CG2 3.99Å; R224-T226 PolarHBondContact O-N 3.48Å; T226-Y228 PolarHBondContact O-N 3.45Å; T226-Y228 VanDerWaalsContact O-N 3.15Å; T226-Y228 PolarHBondContact OG1-N 2.98Å; T226-N229 PolarHBondContact O-N 2.6Å; T226-N229 PolarHBondContact OG1-N 2.99Å
227	Y	92.9	Very high	96.3	Very high	87 Å²	87	29.2 Å²	29.2	34%	0.341	13%	0.131	S	C	.	.	G	3₁₀ helix	trans	-51.3	-38.6	172.8	-176.4	-99.7	0	0	0	112.5	N229 L230 W299 L342	Y227-N229 PolarHBondContact O-N 2.8Å; Y227-L230 HydrophobicContact CD2-CD1 3.46Å; Y227-L230 VanDerWaalsContact CD2-CD1 3.46Å; Y227-L230 HydrophobicContact CD2-CG 4.46Å; Y227-L230 HydrophobicContact CE2-CD1 3.58Å; Y227-L230 HydrophobicContact CG-CD1 4.22Å; Y227-L230 WeakPolarHBondContact O-CB 3.45Å; Y227-L230 VanDerWaalsContact O-CG 3.27Å; Y227-L230 WeakPolarHBondContact O-CG 3.4Å; Y227-L230 PolarHBondContact O-N 3.08Å; Y227-W299 PolarHBondContact OH-NE1 2.76Å; Y227-L342 HydrophobicContact CE1-CD2 4.4Å
228	Y	93.7	Very high	96.4	Very high	132 Å²	132	29.2 Å²	29.2	52%	0.518	13%	0.131	S	C	.	.	G	3₁₀ helix	trans	-69.3	-17	-179.3	-72.9	-84.7	0	0	0	114.2	T226 H341	T226-Y228 PolarHBondContact O-N 3.45Å; T226-Y228 VanDerWaalsContact O-N 3.15Å; T226-Y228 PolarHBondContact OG1-N 2.98Å; Y228-H341 HydrophobicContact CD1-CB 3.7Å; Y228-H341 AromaticContact CD1-CD2 3.55Å; Y228-H341 AromaticContact CD1-CG 3.59Å; Y228-H341 AromaticContact CE1-CD2 3.67Å; Y228-H341 HydrophobicContact CG-CB 4.42Å; Y228-H341 VanDerWaalsContact O-CB 3.32Å; Y228-H341 WeakPolarHBondContact O-CB 3.25Å
229	N	95.7	Very high	96.3	Very high	45 Å²	45	30 Å²	30	24%	0.241	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-103.1	11.6	178.9	-73.1	-28.9	0	0	0	113.1	Y223 R224 T226 Y227 T231 T232 K233	Y223-N229 HydrophobicContact CD2-CB 3.98Å; Y223-N229 HydrophobicContact CE2-CB 4.22Å; R224-N229 PolarHBondContact O-ND2 2.82Å; T226-N229 PolarHBondContact O-N 2.6Å; T226-N229 PolarHBondContact OG1-N 2.99Å; Y227-N229 PolarHBondContact O-N 2.8Å; N229-T231 PolarHBondContact O-N 2.82Å; N229-T232 WeakPolarHBondContact O-CB 3.44Å; N229-T232 PolarHBondContact O-N 2.67Å; N229-K233 PolarHBondContact O-N 3.42Å
230	L	96.6	Very high	96.3	Very high	32 Å²	32	30 Å²	30	17%	0.168	14%	0.135	C	C	.	.	H	α-helix	trans	-57.2	-36.5	177.2	-76.7	175.3	0	0	0	112.6	Y227 T232 K233 T234 E343	Y227-L230 HydrophobicContact CD2-CD1 3.46Å; Y227-L230 VanDerWaalsContact CD2-CD1 3.46Å; Y227-L230 HydrophobicContact CD2-CG 4.46Å; Y227-L230 HydrophobicContact CE2-CD1 3.58Å; Y227-L230 HydrophobicContact CG-CD1 4.22Å; Y227-L230 WeakPolarHBondContact O-CB 3.45Å; Y227-L230 VanDerWaalsContact O-CG 3.27Å; Y227-L230 WeakPolarHBondContact O-CG 3.4Å; Y227-L230 PolarHBondContact O-N 3.08Å; L230-T232 VanDerWaalsContact C-N 3.34Å; L230-T232 PolarHBondContact O-N 3.32Å; L230-K233 HydrophobicContact CD2-CD 4.33Å; L230-K233 CarbonylContact O-C 3.52Å; L230-K233 WeakPolarHBondContact O-CA 3.35Å; L230-K233 VanDerWaalsContact O-CB 3.32Å; L230-K233 WeakPolarHBondContact O-CB 3.35Å; L230-K233 PolarHBondContact O-N 3.1Å; L230-K233 VanDerWaalsContact O-N 3.12Å; L230-T234 PolarHBondContact O-N 3.16Å; L230-E343 HydrophobicContact CB-CB 3.91Å; L230-E343 HydrophobicContact CB-CG 4.49Å
231	T	97.3	Very high	96.3	Very high	2 Å²	2	30 Å²	30	1%	0.012	14%	0.136	C	C	.	.	H	α-helix	trans	-60.7	-44.1	175.4	-55.5	0	0	0	0	111.9	N229 K233 T234 L235 R339 L340 E343 Y346	N229-T231 PolarHBondContact O-N 2.82Å; T231-K233 VanDerWaalsContact C-N 3.29Å; T231-K233 PolarHBondContact O-N 3.08Å; T231-T234 PolarHBondContact O-N 3.31Å; T231-L235 HydrophobicContact CG2-CD1 4.13Å; T231-L235 HydrophobicContact CG2-CG 4.44Å; T231-L235 WeakPolarHBondContact O-CB 3.46Å; T231-L235 VanDerWaalsContact O-CG 3.26Å; T231-L235 WeakPolarHBondContact O-CG 3.38Å; T231-L235 PolarHBondContact O-N 3.22Å; T231-R339 HydrophobicContact CG2-CG 3.71Å; T231-L340 WeakPolarHBondContact CB-O 3.42Å; T231-L340 PolarHBondContact OG1-O 3.01Å; T231-E343 VanDerWaalsContact OG1-CA 3.27Å; T231-E343 WeakPolarHBondContact OG1-CA 3.29Å; T231-Y346 HydrophobicContact CG2-CD1 3.26Å; T231-Y346 HydrophobicContact CG2-CD2 4.3Å; T231-Y346 HydrophobicContact CG2-CE1 3.7Å; T231-Y346 HydrophobicContact CG2-CG 3.58Å
232	T	96.6	Very high	96.3	Very high	6 Å²	6	30.9 Å²	30.9	4%	0.037	14%	0.143	C	C	.	.	H	α-helix	trans	-59.9	-43.6	174.1	-57.4	0	0	0	0	110.5	Y139 Y223 N229 L230 L235 M236	Y139-T232 HydrophobicContact CD2-CG2 3.55Å; Y139-T232 HydrophobicContact CE2-CG2 3.47Å; Y139-T232 VanDerWaalsContact CE2-CG2 3.47Å; Y223-T232 HydrophobicContact CD1-CG2 3.72Å; Y223-T232 HydrophobicContact CD2-CG2 4.33Å; Y223-T232 HydrophobicContact CE1-CG2 4.05Å; Y223-T232 HydrophobicContact CG-CG2 3.91Å; N229-T232 WeakPolarHBondContact O-CB 3.44Å; N229-T232 PolarHBondContact O-N 2.67Å; L230-T232 VanDerWaalsContact C-N 3.34Å; L230-T232 PolarHBondContact O-N 3.32Å; T232-L235 PolarHBondContact O-N 3.02Å; T232-M236 WeakPolarHBondContact O-CB 3.34Å; T232-M236 PolarHBondContact O-N 3.06Å
233	K	97.9	Very high	96.4	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.009	15%	0.148	C	C	.	.	H	α-helix	trans	-59.8	-47.5	177.1	-175.8	174.7	-71.7	-170	0	112.9	A161 A162 L193 Y223 D225 N229 L230 T231 M236 G237	A161-K233 HydrophobicContact CB-CD 3.82Å; A162-K233 PolarHBondContact O-NZ 3.26Å; L193-K233 HydrophobicContact CB-CD 4.01Å; L193-K233 HydrophobicContact CB-CG 3.64Å; L193-K233 HydrophobicContact CD1-CG 4.23Å; L193-K233 WeakPolarHBondContact O-CD 3.37Å; L193-K233 WeakPolarHBondContact O-CE 3.29Å; L193-K233 PolarHBondContact O-NZ 3.42Å; Y223-K233 HydrophobicContact CE2-CB 4.37Å; Y223-K233 WeakPolarHBondContact OH-CA 3.44Å; Y223-K233 WeakPolarHBondContact OH-CB 3.36Å; Y223-K233 WeakPolarHBondContact OH-CE 3.37Å; Y223-K233 VanDerWaalsContact OH-CG 3.23Å; Y223-K233 WeakPolarHBondContact OH-CG 3.36Å; D225-K233 VanDerWaalsContact OD1-CE 3.29Å; D225-K233 WeakPolarHBondContact OD1-CE 3.1Å; D225-K233 IonicContact OD1-NZ 3.76Å; D225-K233 PolarHBondContact OD1-NZ 3Å; D225-K233 VanDerWaalsContact OD2-CE 3.3Å; D225-K233 WeakPolarHBondContact OD2-CE 3.48Å; D225-K233 IonicContact OD2-NZ 3.39Å; D225-K233 PolarHBondContact OD2-NZ 3.07Å; N229-K233 PolarHBondContact O-N 3.42Å; L230-K233 HydrophobicContact CD2-CD 4.33Å; L230-K233 CarbonylContact O-C 3.52Å; L230-K233 WeakPolarHBondContact O-CA 3.35Å; L230-K233 VanDerWaalsContact O-CB 3.32Å; L230-K233 WeakPolarHBondContact O-CB 3.35Å; L230-K233 PolarHBondContact O-N 3.1Å; L230-K233 VanDerWaalsContact O-N 3.12Å; T231-K233 VanDerWaalsContact C-N 3.29Å; T231-K233 PolarHBondContact O-N 3.08Å; K233-M236 HydrophobicContact CG-CE 4.43Å; K233-M236 WeakPolarHBondContact O-CB 3.07Å; K233-M236 PolarHBondContact O-N 2.66Å; K233-G237 PolarHBondContact O-N 2.87Å
234	T	98.3	Very high	96.6	Very high	4 Å²	4	34.4 Å²	34.4	3%	0.025	16%	0.16	C	C	.	.	H	α-helix	trans	-64.5	-45.8	177.3	-73.1	0	0	0	0	111	L230 T231 M236 G237 M238 Y320 E343 V347	L230-T234 PolarHBondContact O-N 3.16Å; T231-T234 PolarHBondContact O-N 3.31Å; T234-M236 VanDerWaalsContact C-N 3.27Å; T234-M236 PolarHBondContact O-N 2.86Å; T234-G237 PolarHBondContact O-N 3.09Å; T234-M238 HydrophobicContact CG2-CE 3.58Å; T234-M238 HydrophobicContact CG2-CG 4.28Å; T234-M238 HydrophobicContact CG2-SD 3.91Å; T234-M238 PolarHBondContact O-N 2.61Å; T234-Y320 WeakPolarHBondContact CG2-OH 3.24Å; T234-E343 WeakPolarHBondContact CB-OE1 3.47Å; T234-E343 HydrophobicContact CG2-CG 4.27Å; T234-E343 WeakPolarHBondContact CG2-OE1 3.49Å; T234-E343 WeakPolarHBondContact OG1-CG 3.48Å; T234-E343 PolarHBondContact OG1-OE1 3.47Å; T234-V347 HydrophobicContact CG2-CG2 4.24Å
235	L	97.8	Very high	96.7	Very high	10 Å²	10	27.3 Å²	27.3	5%	0.052	13%	0.134	C	C	.	.	H	α-helix	trans	-63.5	-33.9	179.7	-68	177.5	0	0	0	112.1	T231 T232 G237 M238 N239 Y331 Y346	T231-L235 HydrophobicContact CG2-CD1 4.13Å; T231-L235 HydrophobicContact CG2-CG 4.44Å; T231-L235 WeakPolarHBondContact O-CB 3.46Å; T231-L235 VanDerWaalsContact O-CG 3.26Å; T231-L235 WeakPolarHBondContact O-CG 3.38Å; T231-L235 PolarHBondContact O-N 3.22Å; T232-L235 PolarHBondContact O-N 3.02Å; L235-G237 VanDerWaalsContact C-N 3.35Å; L235-M238 PolarHBondContact O-N 3.28Å; L235-N239 VanDerWaalsContact O-CB 3.24Å; L235-N239 WeakPolarHBondContact O-CB 3.32Å; L235-N239 PolarHBondContact O-N 3.09Å; L235-Y331 HydrophobicContact CB-CD2 4.44Å; L235-Y346 HydrophobicContact CD1-CE1 3.9Å; L235-Y346 HydrophobicContact CD2-CE1 4.35Å; L235-Y346 HydrophobicContact CG-CE1 4.48Å
236	M	97.6	Very high	96.8	Very high	2 Å²	2	30 Å²	30	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-57.5	-47	170.1	171.1	-170.7	78.9	0	0	111.3	Y141 L193 I219 Q221 Y223 T232 K233 T234 W240	Y141-M236 HydrophobicContact CD1-CG 4.48Å; Y141-M236 HydrophobicContact CE1-CG 3.57Å; Y141-M236 HydrophobicContact CE1-SD 4.2Å; Y141-M236 PolarHBondContact OH-O 3.08Å; L193-M236 HydrophobicContact CB-CE 3.63Å; L193-M236 HydrophobicContact CD2-CE 3.99Å; L193-M236 HydrophobicContact CG-CE 4.31Å; I219-M236 HydrophobicContact CD1-CE 4.22Å; I219-M236 HydrophobicContact CG1-CE 4.19Å; Q221-M236 HydrophobicContact CB-CG 4.36Å; Q221-M236 HydrophobicContact CB-SD 3.54Å; Q221-M236 VanDerWaalsContact CB-SD 3.54Å; Q221-M236 HydrophobicContact CG-CG 3.69Å; Q221-M236 HydrophobicContact CG-SD 3.42Å; Q221-M236 WeakPolarHBondContact CG-SD 3.28Å; Y223-M236 HydrophobicContact CE1-SD 4.01Å; T232-M236 WeakPolarHBondContact O-CB 3.34Å; T232-M236 PolarHBondContact O-N 3.06Å; K233-M236 HydrophobicContact CG-CE 4.43Å; K233-M236 WeakPolarHBondContact O-CB 3.07Å; K233-M236 PolarHBondContact O-N 2.66Å; T234-M236 VanDerWaalsContact C-N 3.27Å; T234-M236 PolarHBondContact O-N 2.86Å; M236-W240 WeakPolarHBondContact O-CB 3.33Å; M236-W240 PolarHBondContact O-N 3.01Å
237	G	98.2	Very high	96.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.3	-45.4	177.9	0	0	0	0	0	112.6	K233 T234 L235 W240 V241	K233-G237 PolarHBondContact O-N 2.87Å; T234-G237 PolarHBondContact O-N 3.09Å; L235-G237 VanDerWaalsContact C-N 3.35Å; G237-W240 WeakPolarHBondContact O-CB 3.5Å; G237-W240 PolarHBondContact O-N 3.33Å; G237-V241 WeakPolarHBondContact O-CG2 3.45Å; G237-V241 PolarHBondContact O-N 2.88Å
238	M	98.3	Very high	97	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.9	-41.8	177.7	-70.1	177.7	175	0	0	112.1	T234 L235 W240 V241 A242 Y320 F322 I330 V347	T234-M238 HydrophobicContact CG2-CE 3.58Å; T234-M238 HydrophobicContact CG2-CG 4.28Å; T234-M238 HydrophobicContact CG2-SD 3.91Å; T234-M238 PolarHBondContact O-N 2.61Å; L235-M238 PolarHBondContact O-N 3.28Å; M238-W240 VanDerWaalsContact C-N 3.33Å; M238-W240 PolarHBondContact O-N 3.31Å; M238-V241 PolarHBondContact O-N 3.13Å; M238-A242 PolarHBondContact O-N 2.95Å; M238-Y320 HydrophobicContact CE-CE2 4.05Å; M238-F322 HydrophobicContact CE-CE1 4.02Å; M238-F322 HydrophobicContact CE-CZ 3.85Å; M238-F322 HydrophobicContact CG-CZ 4.12Å; M238-I330 HydrophobicContact CE-CD1 4.07Å; M238-I330 HydrophobicContact CE-CG2 4.27Å; M238-I330 HydrophobicContact SD-CB 3.99Å; M238-I330 HydrophobicContact SD-CD1 4.32Å; M238-I330 HydrophobicContact SD-CG2 3.51Å; M238-I330 VanDerWaalsContact SD-CG2 3.51Å; M238-V347 HydrophobicContact CE-CG1 4.45Å; M238-V347 HydrophobicContact CE-CG2 4.18Å
239	N	97.5	Very high	97.2	Very high	15 Å²	15	25.4 Å²	25.4	8%	0.08	14%	0.143	C	C	.	.	H	α-helix	trans	-62.4	-41.9	173.5	179.9	81.1	0	0	0	112.2	Q137 Y141 L235 V241 A242 T243 Y331	Q137-N239 VanDerWaalsContact NE2-CB 3.25Å; Q137-N239 PolarHBondContact NE2-ND2 3Å; Q137-N239 PolarHBondContact NE2-OD1 2.97Å; Y141-N239 PolarHBondContact OH-ND2 3.46Å; L235-N239 VanDerWaalsContact O-CB 3.24Å; L235-N239 WeakPolarHBondContact O-CB 3.32Å; L235-N239 PolarHBondContact O-N 3.09Å; N239-V241 VanDerWaalsContact C-N 3.29Å; N239-V241 PolarHBondContact O-N 3.47Å; N239-A242 PolarHBondContact O-N 3.08Å; N239-T243 PolarHBondContact ND2-OG1 3.04Å; N239-T243 VanDerWaalsContact O-CB 3.3Å; N239-T243 WeakPolarHBondContact O-CB 3.36Å; N239-T243 PolarHBondContact O-N 2.65Å; N239-T243 PolarHBondContact O-OG1 2.79Å; N239-Y331 HydrophobicContact CB-CD1 4.44Å; N239-Y331 HydrophobicContact CB-CD2 3.72Å; N239-Y331 HydrophobicContact CB-CE1 4.41Å; N239-Y331 HydrophobicContact CB-CE2 3.68Å; N239-Y331 HydrophobicContact CB-CG 4.12Å; N239-Y331 WeakPolarHBondContact OD1-CE1 3.11Å; N239-Y331 VanDerWaalsContact OD1-CZ 3.31Å
240	W	97.9	Very high	97.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-58.1	-45.7	177.3	-174.1	94.9	0	0	0	110.5	N144 E145 K148 I157 L191 I219 M236 G237 M238 T243 Y244 C245	N144-W240 PolarHBondContact O-NE1 3.49Å; E145-W240 WeakPolarHBondContact O-CZ2 3.37Å; K148-W240 HydrophobicContact CB-CH2 4.19Å; K148-W240 HydrophobicContact CB-CZ2 4.25Å; I157-W240 HydrophobicContact CD1-CZ3 4.09Å; L191-W240 HydrophobicContact CD1-CD2 3.83Å; L191-W240 HydrophobicContact CD1-CE3 3.48Å; L191-W240 VanDerWaalsContact CD1-CE3 3.48Å; L191-W240 HydrophobicContact CD1-CH2 3.69Å; L191-W240 HydrophobicContact CD1-CZ2 3.97Å; L191-W240 HydrophobicContact CD1-CZ3 3.44Å; L191-W240 VanDerWaalsContact CD1-CZ3 3.44Å; I219-W240 HydrophobicContact CD1-CB 3.82Å; I219-W240 HydrophobicContact CD1-CG 3.82Å; M236-W240 WeakPolarHBondContact O-CB 3.33Å; M236-W240 PolarHBondContact O-N 3.01Å; G237-W240 WeakPolarHBondContact O-CB 3.5Å; G237-W240 PolarHBondContact O-N 3.33Å; M238-W240 VanDerWaalsContact C-N 3.33Å; M238-W240 PolarHBondContact O-N 3.31Å; W240-T243 PolarHBondContact O-N 2.68Å; W240-Y244 AromaticContact CD1-CD2 3.39Å; W240-Y244 AromaticContact CD1-CE2 3.78Å; W240-Y244 HydrophobicContact CD2-CD2 4.06Å; W240-Y244 AromaticContact CE2-CD2 3.84Å; W240-Y244 AromaticContact CG-CD2 3.79Å; W240-Y244 HydrophobicContact CG-CD2 3.79Å; W240-Y244 HydrophobicContact CG-CE2 4.46Å; W240-Y244 AromaticContact NE1-CD2 3.42Å; W240-Y244 AromaticContact NE1-CE2 4Å; W240-Y244 WeakPolarHBondContact O-CB 3.29Å; W240-Y244 WeakPolarHBondContact O-CD2 3.3Å; W240-Y244 PolarHBondContact O-N 2.83Å; W240-C245 HydrophobicContact CZ3-CB 3.97Å
241	V	98.3	Very high	97.5	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.006	12%	0.124	C	C	.	.	H	α-helix	trans	-61	-49.8	175.9	174.3	0	0	0	0	111	I157 L159 G237 M238 N239 T243 C245 V248 V251 A327	I157-V241 HydrophobicContact CD1-CG1 4.41Å; I157-V241 HydrophobicContact CD1-CG2 4Å; I157-V241 HydrophobicContact CG2-CG2 4.28Å; L159-V241 HydrophobicContact CD1-CG2 4.11Å; L159-V241 HydrophobicContact CD2-CG2 4.09Å; L159-V241 HydrophobicContact CG-CG2 4.45Å; G237-V241 WeakPolarHBondContact O-CG2 3.45Å; G237-V241 PolarHBondContact O-N 2.88Å; M238-V241 PolarHBondContact O-N 3.13Å; N239-V241 VanDerWaalsContact C-N 3.29Å; N239-V241 PolarHBondContact O-N 3.47Å; V241-T243 PolarHBondContact O-N 3.32Å; V241-C245 CarbonylContact O-C 3.26Å; V241-C245 VanDerWaalsContact O-CA 3.3Å; V241-C245 WeakPolarHBondContact O-CA 2.95Å; V241-C245 PolarHBondContact O-N 3.23Å; V241-V248 HydrophobicContact CG1-CG1 3.65Å; V241-V251 HydrophobicContact CG1-CG2 3.91Å; V241-V251 HydrophobicContact CG2-CG1 4.43Å; V241-V251 HydrophobicContact CG2-CG2 4.28Å; V241-A327 HydrophobicContact CB-CB 3.94Å; V241-A327 HydrophobicContact CG1-CB 3.75Å
242	A	97.4	Very high	97.5	Very high	21 Å²	21	21.8 Å²	21.8	17%	0.174	12%	0.123	C	C	.	.	H	α-helix	trans	-59.5	-34.2	179.5	0	0	0	0	0	112.7	M238 N239 E328	M238-A242 PolarHBondContact O-N 2.95Å; N239-A242 PolarHBondContact O-N 3.08Å; A242-E328 HydrophobicContact CB-CB 3.81Å; A242-E328 HydrophobicContact CB-CG 4.34Å
243	T	96.2	Very high	97.6	Very high	72 Å²	72	21.6 Å²	21.6	44%	0.442	12%	0.122	S	C	.	.	H	α-helix	trans	-84.6	-46.7	-176.2	-53.9	0	0	0	0	112.4	N239 W240 V241	N239-T243 PolarHBondContact ND2-OG1 3.04Å; N239-T243 VanDerWaalsContact O-CB 3.3Å; N239-T243 WeakPolarHBondContact O-CB 3.36Å; N239-T243 PolarHBondContact O-N 2.65Å; N239-T243 PolarHBondContact O-OG1 2.79Å; W240-T243 PolarHBondContact O-N 2.68Å; V241-T243 PolarHBondContact O-N 3.32Å
244	Y	96.7	Very high	97.7	Very high	71 Å²	71	21.5 Å²	21.5	28%	0.278	12%	0.122	S	C	.	.	H	α-helix	trans	-109.5	-14.3	-167.3	-59.9	-68.6	0	0	0	113.6	N144 P146 C149 W240	N144-Y244 PolarHBondContact ND2-OH 3.49Å; N144-Y244 WeakPolarHBondContact OD1-CE2 3.47Å; P146-Y244 HydrophobicContact CB-CD1 3.86Å; P146-Y244 HydrophobicContact CB-CE1 3.66Å; C149-Y244 WeakPolarHBondContact CB-O 2.98Å; W240-Y244 AromaticContact CD1-CD2 3.39Å; W240-Y244 AromaticContact CD1-CE2 3.78Å; W240-Y244 HydrophobicContact CD2-CD2 4.06Å; W240-Y244 AromaticContact CE2-CD2 3.84Å; W240-Y244 AromaticContact CG-CD2 3.79Å; W240-Y244 HydrophobicContact CG-CD2 3.79Å; W240-Y244 HydrophobicContact CG-CE2 4.46Å; W240-Y244 AromaticContact NE1-CD2 3.42Å; W240-Y244 AromaticContact NE1-CE2 4Å; W240-Y244 WeakPolarHBondContact O-CB 3.29Å; W240-Y244 WeakPolarHBondContact O-CD2 3.3Å; W240-Y244 PolarHBondContact O-N 2.83Å
245	C	96.9	Very high	97.7	Very high	4 Å²	4	22.9 Å²	22.9	3%	0.027	13%	0.129	C	C	.	.			trans	-143.6	51.5	-178.6	-150.6	0	0	0	0	113.8	C149 I157 W240 V241 L247 V248	C149-C245 HydrophobicContact CB-CB 3.6Å; C149-C245 WeakPolarHBondContact CB-SG 3.41Å; C149-C245 WeakPolarHBondContact SG-CB 3.41Å; C149-C245 CovalentContact SG-SG 2.04Å; C149-C245 PolarHBondContact SG-SG 3.06Å; I157-C245 HydrophobicContact CD1-CB 3.74Å; I157-C245 VanDerWaalsContact CD1-SG 3.58Å; W240-C245 HydrophobicContact CZ3-CB 3.97Å; V241-C245 CarbonylContact O-C 3.26Å; V241-C245 VanDerWaalsContact O-CA 3.3Å; V241-C245 WeakPolarHBondContact O-CA 2.95Å; V241-C245 PolarHBondContact O-N 3.23Å; C245-L247 PolarHBondContact O-N 3.07Å; C245-L247 VanDerWaalsContact O-N 3.12Å; C245-V248 WeakPolarHBondContact O-CG1 3.41Å; C245-V248 PolarHBondContact O-N 3.42Å
246	P	96.1	Very high	97.7	Very high	80 Å²	80	22.8 Å²	22.8	52%	0.519	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-17.1	-171.8	27.8	-36.3	0	0	0	114.2
247	L	95.8	Very high	97.7	Very high	133 Å²	133	25.1 Å²	25.1	70%	0.696	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.7	0.5	-177.4	-58.1	-178.7	0	0	0	114	T153 C245	T153-L247 HydrophobicContact CG2-CB 3.77Å; T153-L247 WeakPolarHBondContact CG2-O 3.39Å; C245-L247 PolarHBondContact O-N 3.07Å; C245-L247 VanDerWaalsContact O-N 3.12Å
248	V	97	Very high	97.8	Very high	7 Å²	7	25.1 Å²	25.1	4%	0.042	14%	0.142	C	C	.	.			trans	-56.7	140.8	177.7	67.2	0	0	0	0	111	P154 I157 V241 C245 Y250 V251 G324	P154-V248 HydrophobicContact CG-CB 4.48Å; P154-V248 HydrophobicContact CG-CG2 4.07Å; P154-V248 WeakPolarHBondContact O-CG2 3.39Å; I157-V248 HydrophobicContact CB-CG2 4.44Å; I157-V248 HydrophobicContact CD1-CB 4.08Å; I157-V248 HydrophobicContact CD1-CG1 4.24Å; I157-V248 HydrophobicContact CD1-CG2 3.92Å; I157-V248 HydrophobicContact CG1-CG2 3.86Å; V241-V248 HydrophobicContact CG1-CG1 3.65Å; C245-V248 WeakPolarHBondContact O-CG1 3.41Å; C245-V248 PolarHBondContact O-N 3.42Å; V248-Y250 WeakPolarHBondContact CG2-O 3.45Å; V248-V251 HydrophobicContact CG1-CG2 3.87Å; V248-G324 WeakPolarHBondContact O-CA 3.41Å
249	S	97.5	Very high	97.8	Very high	26 Å²	26	25.1 Å²	25.1	18%	0.182	14%	0.142	C	C	.	.	S	Bend	trans	-72.8	-46.3	178.9	-61.3	0	0	0	0	112.3	F155 P276 S323 G324	F155-S249 WeakPolarHBondContact O-CB 3.43Å; S249-P276 WeakPolarHBondContact OG-CG 3.5Å; S249-S323 WeakPolarHBondContact O-CA 3.23Å; S249-G324 PolarHBondContact O-N 2.59Å
250	Y	98.6	Very high	97.8	Very high	3 Å²	3	24.4 Å²	24.4	1%	0.012	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	156	-177.8	-63	-77.5	0	0	0	112.7	F155 L156 I157 V248 L270 P276 K277 Y280 F322	F155-Y250 HydrophobicContact CE1-CD2 4.03Å; F155-Y250 HydrophobicContact CE1-CE2 4.45Å; F155-Y250 AromaticContact CE2-CD2 3.99Å; F155-Y250 HydrophobicContact CE2-CD2 3.99Å; F155-Y250 AromaticContact CE2-CE2 3.94Å; F155-Y250 HydrophobicContact CE2-CE2 3.94Å; F155-Y250 AromaticContact CZ-CD2 3.64Å; F155-Y250 HydrophobicContact CZ-CD2 3.64Å; F155-Y250 AromaticContact CZ-CE2 3.66Å; F155-Y250 HydrophobicContact CZ-CE2 3.66Å; F155-Y250 PolarHBondContact O-N 3.17Å; L156-Y250 CarbonylContact C-O 3.38Å; L156-Y250 VanDerWaalsContact CA-O 3.29Å; L156-Y250 WeakPolarHBondContact CA-O 3.38Å; I157-Y250 PolarHBondContact N-O 2.79Å; V248-Y250 WeakPolarHBondContact CG2-O 3.45Å; Y250-L270 HydrophobicContact CD1-CD2 3.72Å; Y250-L270 HydrophobicContact CD2-CB 4.1Å; Y250-L270 HydrophobicContact CD2-CD1 3.86Å; Y250-L270 HydrophobicContact CD2-CD2 4.11Å; Y250-L270 HydrophobicContact CD2-CG 4.24Å; Y250-L270 HydrophobicContact CE1-CD2 3.81Å; Y250-L270 HydrophobicContact CE2-CB 3.97Å; Y250-L270 HydrophobicContact CE2-CD2 4.18Å; Y250-L270 HydrophobicContact CE2-CG 4.45Å; Y250-L270 HydrophobicContact CG-CD1 3.82Å; Y250-L270 HydrophobicContact CG-CD2 3.86Å; Y250-L270 HydrophobicContact CG-CG 4.32Å; Y250-P276 HydrophobicContact CE2-CB 4.25Å; Y250-P276 WeakPolarHBondContact OH-CA 3.48Å; Y250-K277 HydrophobicContact CE1-CB 4.38Å; Y250-K277 PolarHBondContact OH-N 3.44Å; Y250-Y280 HydrophobicContact CE1-CD1 4.11Å; Y250-F322 CarbonylContact C-O 3.55Å; Y250-F322 WeakPolarHBondContact CA-O 3.41Å
251	V	98.8	Very high	97.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	138.2	174	-173.8	0	0	0	0	108.5	I157 L159 V241 V248 V321 F322	I157-V251 HydrophobicContact CB-CG1 4.44Å; I157-V251 CarbonylContact O-C 3.58Å; I157-V251 WeakPolarHBondContact O-CA 3.36Å; L159-V251 HydrophobicContact CD1-CG1 3.57Å; L159-V251 HydrophobicContact CG-CG1 3.71Å; V241-V251 HydrophobicContact CG1-CG2 3.91Å; V241-V251 HydrophobicContact CG2-CG1 4.43Å; V241-V251 HydrophobicContact CG2-CG2 4.28Å; V248-V251 HydrophobicContact CG1-CG2 3.87Å; V251-V321 CarbonylContact O-C 3.58Å; V251-V321 WeakPolarHBondContact O-CA 3.23Å; V251-F322 HydrophobicContact CB-CD1 4.34Å; V251-F322 HydrophobicContact CB-CD2 3.93Å; V251-F322 HydrophobicContact CB-CE1 3.91Å; V251-F322 HydrophobicContact CB-CE2 3.49Å; V251-F322 VanDerWaalsContact CB-CE2 3.49Å; V251-F322 HydrophobicContact CB-CG 4.37Å; V251-F322 HydrophobicContact CB-CZ 3.48Å; V251-F322 VanDerWaalsContact CB-CZ 3.48Å; V251-F322 HydrophobicContact CG1-CE1 3.82Å; V251-F322 HydrophobicContact CG1-CE2 3.84Å; V251-F322 HydrophobicContact CG1-CZ 3.34Å; V251-F322 HydrophobicContact CG2-CD2 4.36Å; V251-F322 HydrophobicContact CG2-CE2 3.87Å; V251-F322 HydrophobicContact CG2-CZ 4.26Å; V251-F322 PolarHBondContact N-O 3.1Å; V251-F322 WeakPolarHBondContact O-CD1 3.48Å; V251-F322 PolarHBondContact O-N 3.4Å
252	M	98.8	Very high	97.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	125.5	168	-179.3	171.3	-173.8	0	0	109.2	L156 I157 L158 L159 I260 L265 Y320 V321 T384	L156-M252 HydrophobicContact CD1-CB 4.23Å; I157-M252 PolarHBondContact O-N 3.45Å; L158-M252 HydrophobicContact CD2-CB 3.78Å; L158-M252 HydrophobicContact CD2-CG 4.38Å; L158-M252 HydrophobicContact CD2-SD 4.23Å; L159-M252 PolarHBondContact N-O 2.76Å; M252-I260 HydrophobicContact CE-CD1 3.47Å; M252-I260 VanDerWaalsContact CE-CD1 3.47Å; M252-I260 HydrophobicContact CE-CG1 4.19Å; M252-I260 HydrophobicContact CE-CG2 4.08Å; M252-I260 HydrophobicContact SD-CG2 3.9Å; M252-L265 HydrophobicContact SD-CD2 3.5Å; M252-L265 VanDerWaalsContact SD-CD2 3.5Å; M252-Y320 WeakPolarHBondContact CA-O 3.23Å; M252-Y320 WeakPolarHBondContact CG-O 3.35Å; M252-V321 HydrophobicContact CB-CG2 4.02Å; M252-V321 HydrophobicContact CG-CG2 3.88Å; M252-V321 HydrophobicContact SD-CG2 4.14Å; M252-T384 HydrophobicContact CE-CG2 3.85Å
253	K	98.8	Very high	97.4	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.009	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	135.8	163.4	-176.1	-94	167.1	176.6	0	108.8	L159 D255 G317 G319 Y320 F322 E343	L159-K253 WeakPolarHBondContact O-CA 3.5Å; K253-D255 WeakPolarHBondContact CE-OD1 3.36Å; K253-D255 IonicContact NZ-OD1 3.2Å; K253-D255 PolarHBondContact NZ-OD1 2.98Å; K253-G317 PolarHBondContact NZ-O 2.85Å; K253-G319 VanDerWaalsContact O-CA 3.32Å; K253-G319 WeakPolarHBondContact O-CA 3.47Å; K253-Y320 HydrophobicContact CB-CD2 4.15Å; K253-Y320 HydrophobicContact CB-CE1 4.23Å; K253-Y320 HydrophobicContact CB-CE2 3.54Å; K253-Y320 HydrophobicContact CD-CD1 4.45Å; K253-Y320 HydrophobicContact CD-CE1 3.66Å; K253-Y320 HydrophobicContact CG-CE1 4.38Å; K253-Y320 HydrophobicContact CG-CE2 4.38Å; K253-Y320 PolarHBondContact N-O 3.42Å; K253-Y320 PolarHBondContact O-N 3.35Å; K253-Y320 VanDerWaalsContact O-N 3.07Å; K253-F322 HydrophobicContact CB-CE1 4.46Å; K253-E343 IonicContact NZ-OE2 2.71Å; K253-E343 PolarHBondContact NZ-OE2 3.45Å
254	T	98.8	Very high	97.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	169.6	177.6	-171.5	0	0	0	0	111	L159 I160 A161 W177 M258 T318	L159-T254 PolarHBondContact O-N 3Å; I160-T254 CarbonylContact C-O 3.6Å; I160-T254 WeakPolarHBondContact CA-O 3.42Å; I160-T254 HydrophobicContact CB-CG2 4.48Å; I160-T254 HydrophobicContact CG1-CG2 3.95Å; I160-T254 HydrophobicContact CG2-CG2 4.43Å; A161-T254 PolarHBondContact N-O 3.06Å; W177-T254 HydrophobicContact CH2-CG2 3.8Å; W177-T254 HydrophobicContact CZ3-CG2 4.22Å; T254-M258 WeakPolarHBondContact OG1-CG 3.3Å; T254-T318 PolarHBondContact OG1-O 3.45Å
255	D	98.6	Very high	97.3	Very high	33 Å²	33	22.2 Å²	22.2	18%	0.176	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	162.1	176.1	-55.5	-29	0	0	0	111.3	K253 D257 M258	K253-D255 WeakPolarHBondContact CE-OD1 3.36Å; K253-D255 IonicContact NZ-OD1 3.2Å; K253-D255 PolarHBondContact NZ-OD1 2.98Å; D255-D257 VanDerWaalsContact C-N 3.27Å; D255-D257 PolarHBondContact O-N 3.05Å; D255-M258 HydrophobicContact CB-CG 4.15Å; D255-M258 WeakPolarHBondContact O-CB 3.3Å; D255-M258 WeakPolarHBondContact O-CG 3.31Å; D255-M258 PolarHBondContact O-N 3.41Å
256	S	98.4	Very high	97.2	Very high	9 Å²	9	22.1 Å²	22.1	6%	0.063	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-8.7	-175.5	60.7	0	0	0	0	115.3	A161 Q166	A161-S256 PolarHBondContact O-N 3.43Å; Q166-S256 PolarHBondContact OE1-OG 3.27Å
257	D	98.3	Very high	97	Very high	51 Å²	51	22 Å²	22	27%	0.273	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	24.1	177.7	69	-19.2	0	0	0	112.4	D255 H386 Q387 F388	D255-D257 VanDerWaalsContact C-N 3.27Å; D255-D257 PolarHBondContact O-N 3.05Å; D257-H386 IonicContact OD1-CD2 3.19Å; D257-H386 IonicContact OD1-NE2 2.73Å; D257-H386 IonicContact OD2-CD2 2.85Å; D257-H386 IonicContact OD2-NE2 2.9Å; D257-H386 PolarHBondContact OD2-NE2 2.86Å; D257-Q387 PolarHBondContact O-N 2.95Å; D257-F388 PolarHBondContact O-N 2.91Å
258	M	98.6	Very high	96.9	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.106	C	C	.	.			trans	-101.3	147.5	-179.6	-63.3	-62.5	-59.5	0	0	112	W177 T254 D255 I260 T318 T384 H386	W177-M258 PolarHBondContact NE1-O 2.96Å; T254-M258 WeakPolarHBondContact OG1-CG 3.3Å; D255-M258 HydrophobicContact CB-CG 4.15Å; D255-M258 WeakPolarHBondContact O-CB 3.3Å; D255-M258 WeakPolarHBondContact O-CG 3.31Å; D255-M258 PolarHBondContact O-N 3.41Å; M258-I260 HydrophobicContact CB-CD1 3.86Å; M258-I260 HydrophobicContact CB-CG1 4.36Å; M258-T318 WeakPolarHBondContact CE-O 3.42Å; M258-T318 WeakPolarHBondContact CG-O 3.4Å; M258-T318 HydrophobicContact SD-CG2 4.41Å; M258-T384 HydrophobicContact CE-CG2 4.46Å; M258-H386 HydrophobicContact CE-CB 3.96Å; M258-H386 WeakPolarHBondContact SD-CA 3.14Å; M258-H386 HydrophobicContact SD-CB 3.55Å; M258-H386 VanDerWaalsContact SD-CB 3.55Å; M258-H386 PolarHBondContact SD-CD2 3.47Å
259	F	98.5	Very high	96.9	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	128.1	155.7	172	-80.2	0	0	0	108.6	N261 Y379 L382 T384 S385 F388 L393 W397 L400	F259-N261 HydrophobicContact CE1-CB 3.99Å; F259-Y379 HydrophobicContact CB-CE1 4.23Å; F259-Y379 AromaticContact CD1-CD1 3.59Å; F259-Y379 HydrophobicContact CD1-CD1 3.59Å; F259-Y379 AromaticContact CD1-CE1 3.71Å; F259-Y379 HydrophobicContact CD1-CE1 3.71Å; F259-Y379 AromaticContact CD2-CD1 3.98Å; F259-Y379 HydrophobicContact CD2-CD1 3.98Å; F259-Y379 HydrophobicContact CD2-CE1 4.09Å; F259-Y379 AromaticContact CE1-CD1 3.5Å; F259-Y379 HydrophobicContact CE1-CD1 3.5Å; F259-Y379 HydrophobicContact CE1-CE1 4.13Å; F259-Y379 HydrophobicContact CE1-CG 4.47Å; F259-Y379 AromaticContact CE2-CD1 3.86Å; F259-Y379 HydrophobicContact CE2-CD1 3.86Å; F259-Y379 HydrophobicContact CE2-CE1 4.44Å; F259-Y379 AromaticContact CG-CD1 3.87Å; F259-Y379 HydrophobicContact CG-CD1 3.87Å; F259-Y379 AromaticContact CG-CE1 3.74Å; F259-Y379 HydrophobicContact CG-CE1 3.74Å; F259-Y379 AromaticContact CZ-CD1 3.67Å; F259-Y379 HydrophobicContact CZ-CD1 3.67Å; F259-Y379 HydrophobicContact CZ-CE1 4.49Å; F259-L382 HydrophobicContact CD1-CD1 4Å; F259-L382 HydrophobicContact CE1-CD1 3.99Å; F259-T384 WeakPolarHBondContact O-CA 3.38Å; F259-S385 PolarHBondContact N-O 3.13Å; F259-S385 PolarHBondContact O-N 3.46Å; F259-S385 VanDerWaalsContact O-N 3.08Å; F259-F388 HydrophobicContact CB-CD1 4.5Å; F259-F388 HydrophobicContact CB-CD2 3.65Å; F259-F388 HydrophobicContact CB-CE1 4.17Å; F259-F388 HydrophobicContact CB-CE2 3.27Å; F259-F388 HydrophobicContact CB-CG 4.24Å; F259-F388 HydrophobicContact CB-CZ 3.55Å; F259-F388 HydrophobicContact CD2-CZ 4.37Å; F259-F388 HydrophobicContact CG-CE2 4.3Å; F259-F388 HydrophobicContact CG-CZ 4.17Å; F259-L393 HydrophobicContact CB-CD1 4.02Å; F259-L393 HydrophobicContact CD2-CD1 3.92Å; F259-L393 HydrophobicContact CG-CD1 4.44Å; F259-W397 HydrophobicContact CD2-CE3 4.45Å; F259-W397 AromaticContact CE2-CE3 3.6Å; F259-W397 HydrophobicContact CE2-CE3 3.6Å; F259-W397 HydrophobicContact CE2-CZ3 4.16Å; F259-W397 AromaticContact CZ-CE3 3.96Å; F259-W397 HydrophobicContact CZ-CE3 3.96Å; F259-W397 HydrophobicContact CZ-CZ3 4.05Å; F259-L400 HydrophobicContact CE2-CD2 4.29Å; F259-L400 HydrophobicContact CZ-CD2 3.65Å
260	I	98.3	Very high	96.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127.5	175.3	-50.2	-56.7	0	0	0	109.8	W177 M252 M258 T262 I383 T384 W397	W177-I260 HydrophobicContact CB-CB 4.26Å; W177-I260 WeakPolarHBondContact CB-O 3.38Å; W177-I260 HydrophobicContact CD2-CB 3.78Å; W177-I260 HydrophobicContact CD2-CG1 3.85Å; W177-I260 HydrophobicContact CE3-CB 3.83Å; W177-I260 HydrophobicContact CE3-CG1 3.82Å; W177-I260 HydrophobicContact CG-CB 4Å; W177-I260 HydrophobicContact CG-CG1 4.49Å; W177-I260 HydrophobicContact CH2-CG1 4.03Å; W177-I260 HydrophobicContact CZ2-CG1 4.04Å; W177-I260 HydrophobicContact CZ3-CB 4.41Å; W177-I260 HydrophobicContact CZ3-CG1 3.92Å; M252-I260 HydrophobicContact CE-CD1 3.47Å; M252-I260 VanDerWaalsContact CE-CD1 3.47Å; M252-I260 HydrophobicContact CE-CG1 4.19Å; M252-I260 HydrophobicContact CE-CG2 4.08Å; M252-I260 HydrophobicContact SD-CG2 3.9Å; M258-I260 HydrophobicContact CB-CD1 3.86Å; M258-I260 HydrophobicContact CB-CG1 4.36Å; I260-T262 VanDerWaalsContact C-N 3.35Å; I260-T262 PolarHBondContact O-N 3.04Å; I260-I383 CarbonylContact C-O 3.51Å; I260-I383 VanDerWaalsContact CA-O 3.28Å; I260-I383 WeakPolarHBondContact CA-O 3.43Å; I260-T384 HydrophobicContact CD1-CG2 3.8Å; I260-W397 WeakPolarHBondContact O-CZ3 3.32Å
261	N	96.6	Very high	96.6	Very high	9 Å²	9	25.2 Å²	25.2	5%	0.048	12%	0.117	C	C	.	.			trans	-86.2	80.6	166.5	-167	-25.9	0	0	0	109.4	F259 E263 Y264 L265 Y379 L382 I383	F259-N261 HydrophobicContact CE1-CB 3.99Å; N261-E263 VanDerWaalsContact C-N 3.27Å; N261-E263 PolarHBondContact O-N 2.85Å; N261-Y264 PolarHBondContact O-N 2.85Å; N261-Y264 WeakPolarHBondContact OD1-CB 3.45Å; N261-Y264 PolarHBondContact OD1-N 2.72Å; N261-L265 WeakPolarHBondContact O-CB 3.28Å; N261-L265 PolarHBondContact O-N 3.18Å; N261-Y379 PolarHBondContact ND2-O 2.9Å; N261-L382 WeakPolarHBondContact CB-O 3.38Å; N261-I383 PolarHBondContact N-O 3.07Å
262	T	95.7	Very high	96.3	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.1	-39.1	-175	-47.6	0	0	0	0	112.2	L156 W177 F188 I260 L265 I266	L156-T262 HydrophobicContact CD2-CG2 4.4Å; W177-T262 PolarHBondContact O-OG1 3.23Å; F188-T262 HydrophobicContact CD1-CG2 4.35Å; F188-T262 HydrophobicContact CE1-CG2 3.94Å; F188-T262 HydrophobicContact CE2-CG2 4.48Å; F188-T262 HydrophobicContact CZ-CG2 3.99Å; I260-T262 VanDerWaalsContact C-N 3.35Å; I260-T262 PolarHBondContact O-N 3.04Å; T262-L265 WeakPolarHBondContact O-CB 3.45Å; T262-L265 PolarHBondContact O-N 2.9Å; T262-I266 HydrophobicContact CG2-CD1 3.96Å; T262-I266 WeakPolarHBondContact O-CG1 3.24Å; T262-I266 PolarHBondContact O-N 3.5Å
263	E	92.1	Very high	96	Very high	56 Å²	56	33 Å²	33	26%	0.262	16%	0.156	S	C	.	.	H	α-helix	trans	-66.3	-45.8	177.2	-177.2	-176.7	-165.1	0	0	111.8	N261 L265 I266 Q267 K404	N261-E263 VanDerWaalsContact C-N 3.27Å; N261-E263 PolarHBondContact O-N 2.85Å; E263-L265 VanDerWaalsContact C-N 3.32Å; E263-L265 PolarHBondContact O-N 3.47Å; E263-I266 PolarHBondContact O-N 3.38Å; E263-Q267 HydrophobicContact CG-CG 4.06Å; E263-Q267 VanDerWaalsContact O-CB 3.25Å; E263-Q267 WeakPolarHBondContact O-CB 3.24Å; E263-Q267 WeakPolarHBondContact O-CG 3.22Å; E263-Q267 PolarHBondContact O-N 2.92Å; E263-K404 WeakPolarHBondContact OE1-CE 3.34Å; E263-K404 IonicContact OE1-NZ 2.6Å; E263-K404 PolarHBondContact OE1-NZ 2.92Å; E263-K404 WeakPolarHBondContact OE2-CE 3.35Å; E263-K404 IonicContact OE2-NZ 3.36Å; E263-K404 PolarHBondContact OE2-NZ 2.97Å
264	Y	94.4	Very high	95.7	Very high	53 Å²	53	37.2 Å²	37.2	21%	0.208	18%	0.178	C	C	.	.	H	α-helix	trans	-62.6	-42.4	176.5	-168.9	-75.6	0	0	0	111.1	N261 I266 K268 L269 L366 S380 I383	N261-Y264 PolarHBondContact O-N 2.85Å; N261-Y264 WeakPolarHBondContact OD1-CB 3.45Å; N261-Y264 PolarHBondContact OD1-N 2.72Å; Y264-I266 PolarHBondContact O-N 2.97Å; Y264-K268 HydrophobicContact CD1-CB 3.88Å; Y264-K268 HydrophobicContact CD1-CG 4.25Å; Y264-K268 HydrophobicContact CD2-CB 4.38Å; Y264-K268 HydrophobicContact CD2-CG 3.88Å; Y264-K268 HydrophobicContact CE1-CB 3.71Å; Y264-K268 HydrophobicContact CE1-CG 4.23Å; Y264-K268 HydrophobicContact CE2-CB 4.25Å; Y264-K268 HydrophobicContact CE2-CG 3.88Å; Y264-K268 HydrophobicContact CG-CB 4.2Å; Y264-K268 HydrophobicContact CG-CG 4.06Å; Y264-K268 WeakPolarHBondContact O-CA 3.49Å; Y264-K268 VanDerWaalsContact O-CB 3.24Å; Y264-K268 WeakPolarHBondContact O-CB 3.17Å; Y264-K268 PolarHBondContact O-N 3.04Å; Y264-L269 PolarHBondContact O-N 3.22Å; Y264-L366 HydrophobicContact CE1-CD1 4.46Å; Y264-L366 HydrophobicContact CE1-CD2 3.59Å; Y264-S380 WeakPolarHBondContact CD2-O 3.17Å; Y264-I383 HydrophobicContact CD1-CD1 4.35Å; Y264-I383 HydrophobicContact CD1-CG1 3.74Å; Y264-I383 HydrophobicContact CE1-CG1 4.28Å
265	L	96.5	Very high	95.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.213	C	C	.	.	I	π-helix	trans	-53.7	-54.8	174.4	169.3	59	0	0	0	111	L156 M252 N261 T262 E263 L269 L270 V321 I383	L156-L265 HydrophobicContact CD2-CD2 4.01Å; M252-L265 HydrophobicContact SD-CD2 3.5Å; M252-L265 VanDerWaalsContact SD-CD2 3.5Å; N261-L265 WeakPolarHBondContact O-CB 3.28Å; N261-L265 PolarHBondContact O-N 3.18Å; T262-L265 WeakPolarHBondContact O-CB 3.45Å; T262-L265 PolarHBondContact O-N 2.9Å; E263-L265 VanDerWaalsContact C-N 3.32Å; E263-L265 PolarHBondContact O-N 3.47Å; L265-L269 HydrophobicContact CD1-CB 4.33Å; L265-L269 HydrophobicContact CD1-CD2 3.8Å; L265-L269 WeakPolarHBondContact O-CB 3.23Å; L265-L269 PolarHBondContact O-N 2.7Å; L265-L270 HydrophobicContact CD1-CD1 3.99Å; L265-L270 HydrophobicContact CD1-CD2 4.48Å; L265-L270 HydrophobicContact CD1-CG 3.95Å; L265-L270 HydrophobicContact CG-CD1 4.05Å; L265-L270 HydrophobicContact CG-CG 4.39Å; L265-L270 WeakPolarHBondContact O-CG 3.43Å; L265-L270 PolarHBondContact O-N 3.4Å; L265-V321 HydrophobicContact CD1-CG1 4.47Å; L265-V321 HydrophobicContact CD1-CG2 3.79Å; L265-V321 HydrophobicContact CD2-CG2 4.27Å; L265-I383 HydrophobicContact CB-CG2 4.09Å; L265-I383 HydrophobicContact CD1-CD1 4.21Å; L265-I383 HydrophobicContact CD1-CG2 4.38Å
266	I	94.9	Very high	95.3	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	22%	0.22	C	C	.	.	I	π-helix	trans	-65.9	-55.3	-177.3	-69	170.1	0	0	0	110.5	F155 L156 A183 L186 F188 T262 E263 Y264 L270 K271 P272	F155-I266 HydrophobicContact CD1-CG1 4.35Å; F155-I266 HydrophobicContact CD1-CG2 4.12Å; F155-I266 HydrophobicContact CE1-CB 4.45Å; F155-I266 HydrophobicContact CE1-CG1 4.3Å; F155-I266 HydrophobicContact CE1-CG2 3.86Å; L156-I266 HydrophobicContact CD2-CD1 4.03Å; L156-I266 HydrophobicContact CD2-CG1 3.96Å; A183-I266 HydrophobicContact CB-CD1 3.52Å; L186-I266 HydrophobicContact CD1-CG2 3.65Å; F188-I266 HydrophobicContact CD1-CD1 4.44Å; T262-I266 HydrophobicContact CG2-CD1 3.96Å; T262-I266 WeakPolarHBondContact O-CG1 3.24Å; T262-I266 PolarHBondContact O-N 3.5Å; E263-I266 PolarHBondContact O-N 3.38Å; Y264-I266 PolarHBondContact O-N 2.97Å; I266-L270 CarbonylContact O-C 3.57Å; I266-L270 PolarHBondContact O-N 3.25Å; I266-K271 PolarHBondContact O-N 2.76Å; I266-P272 HydrophobicContact CG2-CG 4.33Å; I266-P272 WeakPolarHBondContact O-CD 3.4Å
267	Q	92.7	Very high	95.2	Very high	78 Å²	78	47.2 Å²	47.2	36%	0.364	24%	0.236	S	C	.	.	I	π-helix	trans	-80.1	-26	-167.5	-62	-64.5	-19.7	0	0	114	E263	E263-Q267 HydrophobicContact CG-CG 4.06Å; E263-Q267 VanDerWaalsContact O-CB 3.25Å; E263-Q267 WeakPolarHBondContact O-CB 3.24Å; E263-Q267 WeakPolarHBondContact O-CG 3.22Å; E263-Q267 PolarHBondContact O-N 2.92Å
268	K	94.2	Very high	95.2	Very high	132 Å²	132	51 Å²	51	57%	0.574	25%	0.252	S	S	*	.	I	π-helix	trans	-109.2	-36.9	-175.2	-56.9	-59.1	-177	-171.2	0	113.3	Y264 K271	Y264-K268 HydrophobicContact CD1-CB 3.88Å; Y264-K268 HydrophobicContact CD1-CG 4.25Å; Y264-K268 HydrophobicContact CD2-CB 4.38Å; Y264-K268 HydrophobicContact CD2-CG 3.88Å; Y264-K268 HydrophobicContact CE1-CB 3.71Å; Y264-K268 HydrophobicContact CE1-CG 4.23Å; Y264-K268 HydrophobicContact CE2-CB 4.25Å; Y264-K268 HydrophobicContact CE2-CG 3.88Å; Y264-K268 HydrophobicContact CG-CB 4.2Å; Y264-K268 HydrophobicContact CG-CG 4.06Å; Y264-K268 WeakPolarHBondContact O-CA 3.49Å; Y264-K268 VanDerWaalsContact O-CB 3.24Å; Y264-K268 WeakPolarHBondContact O-CB 3.17Å; Y264-K268 PolarHBondContact O-N 3.04Å; K268-K271 WeakPolarHBondContact O-CE 2.96Å
269	L	96.1	Very high	95.2	Very high	11 Å²	11	57.4 Å²	57.4	6%	0.058	28%	0.28	C	S	.	.	I	π-helix	trans	-93	-50.2	179.8	-174.7	69	0	0	0	112.4	Y264 L265 T282 P362 F367 I383	Y264-L269 PolarHBondContact O-N 3.22Å; L265-L269 HydrophobicContact CD1-CB 4.33Å; L265-L269 HydrophobicContact CD1-CD2 3.8Å; L265-L269 WeakPolarHBondContact O-CB 3.23Å; L265-L269 PolarHBondContact O-N 2.7Å; L269-T282 HydrophobicContact CD2-CG2 4.12Å; L269-P362 HydrophobicContact CD1-CG 4.08Å; L269-F367 HydrophobicContact CD2-CE2 3.78Å; L269-F367 HydrophobicContact CD2-CZ 3.66Å; L269-I383 HydrophobicContact CB-CD1 4.02Å; L269-I383 HydrophobicContact CD2-CD1 3.6Å; L269-I383 HydrophobicContact CG-CD1 4.35Å
270	L	95.9	Very high	95.2	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.021	28%	0.283	C	S	.	.	I	π-helix	trans	-87	-30.4	-171.3	-60.8	-177.9	0	0	0	113.8	F155 L156 Y250 L265 I266 V321	F155-L270 HydrophobicContact CE1-CB 3.87Å; F155-L270 HydrophobicContact CE1-CD1 4.04Å; F155-L270 HydrophobicContact CZ-CB 3.84Å; L156-L270 HydrophobicContact CD1-CD1 4.33Å; Y250-L270 HydrophobicContact CD1-CD2 3.72Å; Y250-L270 HydrophobicContact CD2-CB 4.1Å; Y250-L270 HydrophobicContact CD2-CD1 3.86Å; Y250-L270 HydrophobicContact CD2-CD2 4.11Å; Y250-L270 HydrophobicContact CD2-CG 4.24Å; Y250-L270 HydrophobicContact CE1-CD2 3.81Å; Y250-L270 HydrophobicContact CE2-CB 3.97Å; Y250-L270 HydrophobicContact CE2-CD2 4.18Å; Y250-L270 HydrophobicContact CE2-CG 4.45Å; Y250-L270 HydrophobicContact CG-CD1 3.82Å; Y250-L270 HydrophobicContact CG-CD2 3.86Å; Y250-L270 HydrophobicContact CG-CG 4.32Å; L265-L270 HydrophobicContact CD1-CD1 3.99Å; L265-L270 HydrophobicContact CD1-CD2 4.48Å; L265-L270 HydrophobicContact CD1-CG 3.95Å; L265-L270 HydrophobicContact CG-CD1 4.05Å; L265-L270 HydrophobicContact CG-CG 4.39Å; L265-L270 WeakPolarHBondContact O-CG 3.43Å; L265-L270 PolarHBondContact O-N 3.4Å; I266-L270 CarbonylContact O-C 3.57Å; I266-L270 PolarHBondContact O-N 3.25Å; L270-V321 HydrophobicContact CD1-CG1 4.34Å; L270-V321 HydrophobicContact CD2-CG1 3.91Å
271	K	94.4	Very high	95.2	Very high	89 Å²	89	58.4 Å²	58.4	39%	0.387	28%	0.284	S	S	.	.			trans	54.7	78.6	171	-65.6	-173.4	-179.4	-175.7	0	112.5	I266 K268 E273 L274	I266-K271 PolarHBondContact O-N 2.76Å; K268-K271 WeakPolarHBondContact O-CE 2.96Å; K271-E273 VanDerWaalsContact CA-OE2 3.29Å; K271-E273 WeakPolarHBondContact CA-OE2 3.41Å; K271-E273 WeakPolarHBondContact CB-OE1 3.43Å; K271-E273 PolarHBondContact O-N 2.93Å; K271-L274 HydrophobicContact CB-CB 4.47Å; K271-L274 HydrophobicContact CB-CD1 3.88Å; K271-L274 HydrophobicContact CB-CG 4.08Å; K271-L274 HydrophobicContact CD-CD1 3.76Å; K271-L274 WeakPolarHBondContact O-CB 3.41Å; K271-L274 PolarHBondContact O-N 3.23Å
272	P	92.1	Very high	95.3	Very high	36 Å²	36	58 Å²	58	23%	0.234	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-18.8	-175.2	27.3	-37.5	0	0	0	114.3	F155 L186 I266 L274	F155-P272 HydrophobicContact CD2-CB 4.3Å; F155-P272 HydrophobicContact CE1-CB 4.42Å; F155-P272 HydrophobicContact CE2-CB 3.82Å; F155-P272 HydrophobicContact CZ-CB 3.87Å; L186-P272 HydrophobicContact CD1-CB 3.95Å; L186-P272 HydrophobicContact CD1-CG 3.65Å; L186-P272 HydrophobicContact CD2-CB 3.55Å; L186-P272 HydrophobicContact CD2-CG 4.07Å; L186-P272 HydrophobicContact CG-CB 4.42Å; I266-P272 HydrophobicContact CG2-CG 4.33Å; I266-P272 WeakPolarHBondContact O-CD 3.4Å; P272-L274 PolarHBondContact O-N 2.88Å
273	E	92	Very high	95.4	Very high	127 Å²	127	58 Å²	58	59%	0.593	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-12.1	173.5	72.2	-78.8	-172.4	0	0	114	K271	K271-E273 VanDerWaalsContact CA-OE2 3.29Å; K271-E273 WeakPolarHBondContact CA-OE2 3.41Å; K271-E273 WeakPolarHBondContact CB-OE1 3.43Å; K271-E273 PolarHBondContact O-N 2.93Å
274	L	93.5	Very high	95.7	Very high	91 Å²	91	57.7 Å²	57.7	48%	0.476	28%	0.278	S	S	.	.	S	Bend	trans	-106.1	153.1	178.8	-58.3	-179.5	0	0	0	111.1	K271 P272	K271-L274 HydrophobicContact CB-CB 4.47Å; K271-L274 HydrophobicContact CB-CD1 3.88Å; K271-L274 HydrophobicContact CB-CG 4.08Å; K271-L274 HydrophobicContact CD-CD1 3.76Å; K271-L274 WeakPolarHBondContact O-CB 3.41Å; K271-L274 PolarHBondContact O-N 3.23Å; P272-L274 PolarHBondContact O-N 2.88Å
275	P	94.9	Very high	95.9	Very high	113 Å²	113	56.3 Å²	56.3	73%	0.734	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-54	135.3	170.1	-25.7	34.8	0	0	0	111.5	K277	P275-K277 PolarHBondContact O-N 3.47Å
276	P	94.1	Very high	95.9	Very high	49 Å²	49	57.3 Å²	57.3	32%	0.318	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-56.1	132.6	176	-26.3	34.7	0	0	0	111.5	S249 Y250	S249-P276 WeakPolarHBondContact OG-CG 3.5Å; Y250-P276 HydrophobicContact CE2-CB 4.25Å; Y250-P276 WeakPolarHBondContact OH-CA 3.48Å
277	K	96.6	Very high	96	Very high	91 Å²	91	63.6 Å²	63.6	40%	0.396	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-61.7	151.2	172.9	-60.6	177.3	-177.3	175.8	0	109.4	Y250 P275 Y280 S323	Y250-K277 HydrophobicContact CE1-CB 4.38Å; Y250-K277 PolarHBondContact OH-N 3.44Å; P275-K277 PolarHBondContact O-N 3.47Å; K277-Y280 HydrophobicContact CB-CD1 4.36Å; K277-Y280 HydrophobicContact CB-CD2 4.4Å; K277-Y280 HydrophobicContact CB-CG 3.89Å; K277-Y280 HydrophobicContact CD-CD1 3.97Å; K277-Y280 HydrophobicContact CD-CD2 3.49Å; K277-Y280 VanDerWaalsContact CD-CD2 3.49Å; K277-Y280 HydrophobicContact CD-CE1 4.11Å; K277-Y280 HydrophobicContact CD-CE2 3.65Å; K277-Y280 HydrophobicContact CD-CG 3.63Å; K277-Y280 HydrophobicContact CG-CG 4.43Å; K277-Y280 PolarHBondContact NZ-OH 3.15Å; K277-S323 WeakPolarHBondContact O-CB 3.47Å
278	Q	97.5	Very high	96.1	Very high	130 Å²	130	62 Å²	62	61%	0.607	31%	0.308	S	S	*	.	S	Bend	trans	-114.7	152	174.7	-62	-61.8	-51.1	0	0	109.3	Y280	Q278-Y280 PolarHBondContact O-N 2.9Å; Q278-Y280 VanDerWaalsContact O-N 3.09Å
279	K	98.1	Very high	96.2	Very high	134 Å²	134	61 Å²	61	58%	0.583	30%	0.301	S	S	*	.	S	Bend	trans	48.2	37	-176.3	-62.2	-176.7	179.6	-178.5	0	113	S323 D325 M326 L329 I356	K279-S323 PolarHBondContact N-OG 2.75Å; K279-D325 WeakPolarHBondContact CG-OD2 3.3Å; K279-D325 PolarHBondContact N-OD1 3.38Å; K279-D325 PolarHBondContact N-OD2 3.44Å; K279-M326 VanDerWaalsContact CA-SD 3.59Å; K279-M326 HydrophobicContact CB-SD 4.25Å; K279-L329 HydrophobicContact CG-CD1 4.19Å; K279-I356 HydrophobicContact CB-CD1 4.02Å; K279-I356 HydrophobicContact CD-CD1 4.18Å; K279-I356 HydrophobicContact CG-CD1 4.13Å
280	Y	98.6	Very high	96.3	Very high	18 Å²	18	62.9 Å²	62.9	7%	0.071	32%	0.318	C	S	.	.			trans	-103.3	133.7	-173.2	176.1	-107.3	0	0	0	110.5	Y250 K277 Q278 T282 F322 S323 A359	Y250-Y280 HydrophobicContact CE1-CD1 4.11Å; K277-Y280 HydrophobicContact CB-CD1 4.36Å; K277-Y280 HydrophobicContact CB-CD2 4.4Å; K277-Y280 HydrophobicContact CB-CG 3.89Å; K277-Y280 HydrophobicContact CD-CD1 3.97Å; K277-Y280 HydrophobicContact CD-CD2 3.49Å; K277-Y280 VanDerWaalsContact CD-CD2 3.49Å; K277-Y280 HydrophobicContact CD-CE1 4.11Å; K277-Y280 HydrophobicContact CD-CE2 3.65Å; K277-Y280 HydrophobicContact CD-CG 3.63Å; K277-Y280 HydrophobicContact CG-CG 4.43Å; K277-Y280 PolarHBondContact NZ-OH 3.15Å; Q278-Y280 PolarHBondContact O-N 2.9Å; Q278-Y280 VanDerWaalsContact O-N 3.09Å; Y280-T282 HydrophobicContact CE1-CG2 3.64Å; Y280-T282 VanDerWaalsContact OH-CG2 3.26Å; Y280-T282 WeakPolarHBondContact OH-CG2 3.41Å; Y280-F322 CarbonylContact O-C 3.6Å; Y280-F322 WeakPolarHBondContact O-CA 3.2Å; Y280-F322 WeakPolarHBondContact O-CB 3.46Å; Y280-S323 PolarHBondContact N-OG 3.3Å; Y280-S323 PolarHBondContact O-N 2.86Å; Y280-S323 PolarHBondContact O-OG 2.56Å; Y280-A359 HydrophobicContact CD2-CB 4.12Å; Y280-A359 HydrophobicContact CE2-CB 3.75Å
281	F	98.8	Very high	96.3	Very high	3 Å²	3	63.2 Å²	63.2	1%	0.013	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	130.3	177	-161.6	-76.6	0	0	0	108.9	C315 Y320 V321 F322 M326 I330 V347 L351 P358 A359	F281-C315 HydrophobicContact CE1-CB 3.85Å; F281-Y320 AromaticContact CE1-CD2 3.88Å; F281-Y320 HydrophobicContact CE1-CD2 3.88Å; F281-Y320 AromaticContact CE1-CG 3.93Å; F281-Y320 HydrophobicContact CE1-CG 3.93Å; F281-Y320 AromaticContact CE2-CD2 3.78Å; F281-Y320 HydrophobicContact CE2-CD2 3.78Å; F281-Y320 AromaticContact CE2-CE2 3.89Å; F281-Y320 HydrophobicContact CE2-CE2 3.89Å; F281-Y320 HydrophobicContact CZ-CD1 4.3Å; F281-Y320 AromaticContact CZ-CD2 3.19Å; F281-Y320 HydrophobicContact CZ-CD2 3.19Å; F281-Y320 AromaticContact CZ-CE2 3.51Å; F281-Y320 HydrophobicContact CZ-CE2 3.51Å; F281-Y320 AromaticContact CZ-CG 3.64Å; F281-Y320 HydrophobicContact CZ-CG 3.64Å; F281-V321 CarbonylContact C-O 3.52Å; F281-V321 WeakPolarHBondContact CA-O 3.39Å; F281-F322 HydrophobicContact CB-CB 4.46Å; F281-F322 HydrophobicContact CD2-CB 3.5Å; F281-F322 HydrophobicContact CD2-CD1 4.38Å; F281-F322 HydrophobicContact CD2-CG 4.15Å; F281-F322 HydrophobicContact CE2-CB 4.01Å; F281-F322 HydrophobicContact CE2-CD1 4.01Å; F281-F322 HydrophobicContact CE2-CG 4.19Å; F281-F322 HydrophobicContact CG-CB 4.19Å; F281-M326 HydrophobicContact CD2-CE 4.45Å; F281-I330 HydrophobicContact CD2-CD1 4.05Å; F281-I330 HydrophobicContact CE2-CD1 3.82Å; F281-V347 HydrophobicContact CE2-CG1 3.83Å; F281-V347 HydrophobicContact CZ-CG1 3.67Å; F281-L351 HydrophobicContact CB-CD1 4.35Å; F281-L351 HydrophobicContact CB-CD2 4.47Å; F281-L351 HydrophobicContact CD1-CD1 3.73Å; F281-L351 HydrophobicContact CD2-CD1 3.96Å; F281-L351 HydrophobicContact CD2-CD2 3.95Å; F281-L351 HydrophobicContact CE1-CD1 3.92Å; F281-L351 HydrophobicContact CE2-CD1 4.17Å; F281-L351 HydrophobicContact CE2-CD2 4.46Å; F281-L351 HydrophobicContact CG-CD1 3.75Å; F281-L351 HydrophobicContact CG-CD2 4.25Å; F281-L351 HydrophobicContact CZ-CD1 4.13Å; F281-P358 HydrophobicContact CD1-CB 4.36Å; F281-P358 CarbonylContact O-C 3.56Å; F281-P358 WeakPolarHBondContact O-CA 3.3Å; F281-A359 PolarHBondContact O-N 2.73Å
282	T	98.6	Very high	96.5	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	157.5	-178.6	-173.5	0	0	0	0	111.3	L269 Y280 Y320 V321 A359 F367	L269-T282 HydrophobicContact CD2-CG2 4.12Å; Y280-T282 HydrophobicContact CE1-CG2 3.64Å; Y280-T282 VanDerWaalsContact OH-CG2 3.26Å; Y280-T282 WeakPolarHBondContact OH-CG2 3.41Å; T282-Y320 WeakPolarHBondContact O-CA 3.37Å; T282-Y320 WeakPolarHBondContact O-CB 3.49Å; T282-V321 HydrophobicContact CG2-CB 4.07Å; T282-V321 PolarHBondContact N-O 2.96Å; T282-V321 PolarHBondContact O-N 3Å; T282-A359 PolarHBondContact OG1-O 2.69Å; T282-F367 HydrophobicContact CG2-CE2 4.33Å; T282-F367 HydrophobicContact CG2-CZ 4.18Å
283	G	98.3	Very high	96.7	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.6	-151.9	175.4	0	0	0	0	0	110.1	L285 C315 P361	G283-L285 WeakPolarHBondContact O-CD1 3.36Å; G283-L285 PolarHBondContact O-N 2.91Å; G283-C315 PolarHBondContact N-SG 2.91Å; G283-C315 VanDerWaalsContact N-SG 3.43Å; G283-P361 WeakPolarHBondContact O-CD 3.38Å
284	Y	98.1	Very high	97	Very high	51 Å²	51	62 Å²	62	20%	0.2	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	110.8	165.6	-171.7	-91.9	0	0	0	109.9	M286 C315 S316 F367 H369 W370	Y284-M286 HydrophobicContact CD1-CG 4.47Å; Y284-M286 HydrophobicContact CD1-SD 3.68Å; Y284-M286 HydrophobicContact CE1-SD 3.69Å; Y284-M286 PolarHBondContact O-N 2.73Å; Y284-C315 CarbonylContact O-C 3.55Å; Y284-C315 VanDerWaalsContact O-CA 3.24Å; Y284-C315 WeakPolarHBondContact O-CA 3.38Å; Y284-S316 PolarHBondContact O-N 2.86Å; Y284-F367 VanDerWaalsContact CB-O 3.32Å; Y284-F367 WeakPolarHBondContact CB-O 3.22Å; Y284-F367 WeakPolarHBondContact CD2-O 3.44Å; Y284-H369 AromaticContact CD1-CE1 3.59Å; Y284-H369 AromaticContact CD1-ND1 3.17Å; Y284-H369 WeakPolarHBondContact CD1-ND1 3.37Å; Y284-H369 AromaticContact CD2-ND1 3.91Å; Y284-H369 AromaticContact CE1-CE1 3.19Å; Y284-H369 WeakPolarHBondContact CE1-CE1 3.3Å; Y284-H369 AromaticContact CE1-ND1 3.29Å; Y284-H369 VanDerWaalsContact CE1-ND1 3.29Å; Y284-H369 WeakPolarHBondContact CE1-ND1 3.19Å; Y284-H369 AromaticContact CE2-ND1 3.99Å; Y284-H369 AromaticContact CG-ND1 3.49Å; Y284-H369 AromaticContact CZ-CE1 3.52Å; Y284-H369 AromaticContact CZ-ND1 3.69Å; Y284-W370 HydrophobicContact CD2-CH2 4.39Å; Y284-W370 HydrophobicContact CD2-CZ3 4.13Å; Y284-W370 AromaticContact CE2-CH2 3.72Å; Y284-W370 HydrophobicContact CE2-CH2 3.72Å; Y284-W370 AromaticContact CE2-CZ3 3.55Å; Y284-W370 HydrophobicContact CE2-CZ3 3.55Å; Y284-W370 AromaticContact CZ-CZ3 3.8Å
285	L	97.9	Very high	97.2	Very high	23 Å²	23	65.2 Å²	65.2	12%	0.12	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	118.8	-173.6	-82.5	63.4	0	0	0	111.6	G283 R287 I313 P358 P360	G283-L285 WeakPolarHBondContact O-CD1 3.36Å; G283-L285 PolarHBondContact O-N 2.91Å; L285-R287 HydrophobicContact CB-CG 4.47Å; L285-I313 HydrophobicContact CB-CG2 4.45Å; L285-I313 HydrophobicContact CD2-CG2 4.34Å; L285-I313 HydrophobicContact CG-CG2 4.3Å; L285-P358 HydrophobicContact CD1-CB 4.37Å; L285-P358 HydrophobicContact CD2-CB 4.22Å; L285-P358 HydrophobicContact CG-CB 4.11Å; L285-P360 HydrophobicContact CD2-CB 4.29Å
286	M	97.3	Very high	97.2	Very high	21 Å²	21	67 Å²	67	10%	0.103	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	108	174.1	-59.1	-65.6	-81.2	0	0	108.5	Y284 Y289 F314	Y284-M286 HydrophobicContact CD1-CG 4.47Å; Y284-M286 HydrophobicContact CD1-SD 3.68Å; Y284-M286 HydrophobicContact CE1-SD 3.69Å; Y284-M286 PolarHBondContact O-N 2.73Å; M286-Y289 HydrophobicContact CB-CD2 3.84Å; M286-Y289 HydrophobicContact CB-CE2 4Å; M286-Y289 HydrophobicContact CE-CD1 4.1Å; M286-Y289 HydrophobicContact CE-CD2 4.02Å; M286-Y289 HydrophobicContact CE-CE1 3.58Å; M286-Y289 HydrophobicContact CE-CE2 3.5Å; M286-Y289 VanDerWaalsContact CE-CE2 3.5Å; M286-Y289 HydrophobicContact CE-CG 4.3Å; M286-Y289 HydrophobicContact SD-CE2 3.9Å; M286-F314 HydrophobicContact CB-CD1 3.95Å; M286-F314 HydrophobicContact CB-CD2 3.9Å; M286-F314 HydrophobicContact CB-CE1 3.65Å; M286-F314 HydrophobicContact CB-CE2 3.6Å; M286-F314 HydrophobicContact CB-CG 4.07Å; M286-F314 HydrophobicContact CB-CZ 3.46Å; M286-F314 VanDerWaalsContact CB-CZ 3.46Å; M286-F314 WeakPolarHBondContact CB-O 3.39Å; M286-F314 HydrophobicContact CE-CZ 4.42Å; M286-F314 HydrophobicContact CG-CD2 4Å; M286-F314 HydrophobicContact CG-CE2 3.58Å; M286-F314 HydrophobicContact CG-CZ 3.88Å; M286-F314 PolarHBondContact N-O 3.39Å; M286-F314 PolarHBondContact O-N 3.45Å
287	R	96.4	Very high	97.4	Very high	135 Å²	135	65.9 Å²	65.9	51%	0.509	32%	0.321	S	S	.	.			trans	-113	134.7	-175.6	-60.5	-178.5	-178.2	-90.2	5.3	111.1	L285 Y289 I313	L285-R287 HydrophobicContact CB-CG 4.47Å; R287-Y289 VanDerWaalsContact C-N 3.26Å; R287-Y289 WeakPolarHBondContact O-CD2 3.46Å; R287-Y289 PolarHBondContact O-N 3.4Å; R287-I313 HydrophobicContact CG-CG1 4.35Å; R287-I313 HydrophobicContact CG-CG2 4.26Å
288	G	94.5	Very high	97.3	Very high	45 Å²	45	67.4 Å²	67.4	46%	0.464	33%	0.327	S	S	.	.	S	Bend	trans	70.1	16.8	173.7	0	0	0	0	0	114.8	R310	G288-R310 PolarHBondContact O-NH1 3.32Å
289	Y	96.8	Very high	97.2	Very high	109 Å²	109	67.2 Å²	67.2	43%	0.427	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-71	139.1	176.2	-78.6	-99.6	0	0	0	110.9	M286 R287 Y311	M286-Y289 HydrophobicContact CB-CD2 3.84Å; M286-Y289 HydrophobicContact CB-CE2 4Å; M286-Y289 HydrophobicContact CE-CD1 4.1Å; M286-Y289 HydrophobicContact CE-CD2 4.02Å; M286-Y289 HydrophobicContact CE-CE1 3.58Å; M286-Y289 HydrophobicContact CE-CE2 3.5Å; M286-Y289 VanDerWaalsContact CE-CE2 3.5Å; M286-Y289 HydrophobicContact CE-CG 4.3Å; M286-Y289 HydrophobicContact SD-CE2 3.9Å; R287-Y289 VanDerWaalsContact C-N 3.26Å; R287-Y289 WeakPolarHBondContact O-CD2 3.46Å; R287-Y289 PolarHBondContact O-N 3.4Å; Y289-Y311 PolarHBondContact O-N 3.36Å
290	A	97.3	Very high	97.2	Very high	52 Å²	52	63 Å²	63	43%	0.43	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-100.3	151.3	174.7	0	0	0	0	0	110.2	N292 E309	A290-N292 PolarHBondContact O-N 2.79Å; A290-E309 VanDerWaalsContact CB-O 3.31Å; A290-E309 WeakPolarHBondContact CB-O 3.44Å
291	P	97.8	Very high	97.1	Very high	11 Å²	11	62.2 Å²	62.2	7%	0.071	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-59.3	131.9	172.8	-18.2	29.2	0	0	0	111.5	R293 M301 Y306 S308 E309 Y311	P291-R293 VanDerWaalsContact CB-CZ 3.48Å; P291-R293 PolarHBondContact O-N 3.46Å; P291-M301 HydrophobicContact CB-CB 3.79Å; P291-M301 HydrophobicContact CB-CG 3.98Å; P291-Y306 HydrophobicContact CG-CD1 3.62Å; P291-Y306 HydrophobicContact CG-CE1 3.89Å; P291-S308 WeakPolarHBondContact CG-O 3.4Å; P291-E309 WeakPolarHBondContact CD-O 3.15Å; P291-Y311 VanDerWaalsContact CA-CZ 3.48Å; P291-Y311 WeakPolarHBondContact CA-OH 3.46Å; P291-Y311 HydrophobicContact CB-CE1 3.98Å; P291-Y311 HydrophobicContact CB-CE2 4.22Å; P291-Y311 WeakPolarHBondContact CB-OH 3.41Å; P291-Y311 HydrophobicContact CG-CD1 4.17Å; P291-Y311 HydrophobicContact CG-CE1 3.63Å; P291-Y311 HydrophobicContact CG-CE2 4.28Å
292	N	97.8	Very high	97	Very high	53 Å²	53	63.5 Å²	63.5	28%	0.283	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-74.6	118.1	175.8	-173.8	-19.5	0	0	0	109.3	A290 N294 S297 W299 Y300 M301	A290-N292 PolarHBondContact O-N 2.79Å; N292-N294 VanDerWaalsContact OD1-CB 3.3Å; N292-N294 WeakPolarHBondContact OD1-CB 3.24Å; N292-N294 PolarHBondContact OD1-N 3.49Å; N292-S297 WeakPolarHBondContact ND2-CB 3.26Å; N292-S297 PolarHBondContact ND2-OG 3.3Å; N292-W299 HydrophobicContact CB-CB 4.37Å; N292-W299 WeakPolarHBondContact CB-O 3.43Å; N292-Y300 CarbonylContact O-C 3.56Å; N292-Y300 WeakPolarHBondContact O-CA 3.44Å; N292-M301 PolarHBondContact O-N 2.85Å
293	R	97.2	Very high	96.8	Very high	86 Å²	86	66 Å²	66	33%	0.325	32%	0.324	S	S	.	.			trans	-95.7	3.6	-178.3	-53.6	-54.5	-170.2	-177.2	2.5	113.9	P291 K295 Y300 M301 P302 Y306 S308	P291-R293 VanDerWaalsContact CB-CZ 3.48Å; P291-R293 PolarHBondContact O-N 3.46Å; R293-K295 PolarHBondContact O-N 3.34Å; R293-Y300 WeakPolarHBondContact O-CE2 3.26Å; R293-M301 VanDerWaalsContact CD-O 3.24Å; R293-M301 WeakPolarHBondContact CD-O 3.11Å; R293-M301 PolarHBondContact NH1-O 3.05Å; R293-P302 VanDerWaalsContact NH1-C 3.32Å; R293-P302 PolarHBondContact NH1-O 3.26Å; R293-Y306 VanDerWaalsContact CZ-O 3.3Å; R293-Y306 PolarHBondContact NH1-O 3.07Å; R293-Y306 PolarHBondContact NH2-O 2.91Å; R293-S308 PolarHBondContact NH2-O 3.29Å
294	N	97.6	Very high	96.6	Very high	86 Å²	86	73.1 Å²	73.1	46%	0.46	36%	0.357	S	S	.	.			trans	-77.8	114	173.5	-180	2.5	0	0	0	110.3	N292 D296 S297 Y300	N292-N294 VanDerWaalsContact OD1-CB 3.3Å; N292-N294 WeakPolarHBondContact OD1-CB 3.24Å; N292-N294 PolarHBondContact OD1-N 3.49Å; N294-D296 PolarHBondContact O-N 3.19Å; N294-D296 PolarHBondContact OD1-N 2.95Å; N294-S297 WeakPolarHBondContact O-CB 3.45Å; N294-S297 PolarHBondContact O-N 3.19Å; N294-Y300 VanDerWaalsContact C-CD2 3.49Å; N294-Y300 VanDerWaalsContact O-CB 3.31Å; N294-Y300 WeakPolarHBondContact O-CB 3.4Å; N294-Y300 WeakPolarHBondContact O-CD2 3.43Å
295	K	96.8	Very high	96.3	Very high	159 Å²	159	72.7 Å²	72.7	69%	0.691	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-24.1	-179.1	-67.8	-177.5	179.7	-178.3	0	114.2	R293 S297 Y300	R293-K295 PolarHBondContact O-N 3.34Å; K295-S297 VanDerWaalsContact C-N 3.31Å; K295-Y300 HydrophobicContact CG-CD1 4.49Å; K295-Y300 HydrophobicContact CG-CD2 4.23Å; K295-Y300 HydrophobicContact CG-CE1 4.02Å; K295-Y300 HydrophobicContact CG-CE2 3.72Å
296	D	96.4	Very high	96.2	Very high	152 Å²	152	72.1 Å²	72.1	81%	0.813	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-6.4	179.6	-58.1	-37.2	0	0	0	112.7	N294	N294-D296 PolarHBondContact O-N 3.19Å; N294-D296 PolarHBondContact OD1-N 2.95Å
297	S	96.4	Very high	96.1	Very high	24 Å²	24	74.5 Å²	74.5	17%	0.168	37%	0.371	C	S	.	.	S	Bend	trans	-82.4	136.9	176.8	-170.1	0	0	0	0	110.9	N292 N294 K295 W299 Y300	N292-S297 WeakPolarHBondContact ND2-CB 3.26Å; N292-S297 PolarHBondContact ND2-OG 3.3Å; N294-S297 WeakPolarHBondContact O-CB 3.45Å; N294-S297 PolarHBondContact O-N 3.19Å; K295-S297 VanDerWaalsContact C-N 3.31Å; S297-W299 PolarHBondContact O-N 3.05Å; S297-W299 PolarHBondContact OG-N 2.82Å; S297-Y300 WeakPolarHBondContact O-CB 3.41Å; S297-Y300 PolarHBondContact O-N 2.88Å
298	K	94.6	Very high	96	Very high	123 Å²	123	68.9 Å²	68.9	54%	0.535	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-14.8	166.5	68.9	172	-177.4	174.9	0	113.9
299	W	96.4	Very high	96.1	Very high	127 Å²	127	74.4 Å²	74.4	48%	0.481	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	12.2	176.8	-56.3	-42	0	0	0	113.1	Y227 N292 S297 M301	Y227-W299 PolarHBondContact OH-NE1 2.76Å; N292-W299 HydrophobicContact CB-CB 4.37Å; N292-W299 WeakPolarHBondContact CB-O 3.43Å; S297-W299 PolarHBondContact O-N 3.05Å; S297-W299 PolarHBondContact OG-N 2.82Å; W299-M301 PolarHBondContact O-N 2.68Å
300	Y	97.4	Very high	96.1	Very high	46 Å²	46	76.4 Å²	76.4	18%	0.18	37%	0.373	C	S	.	.	B	Isolated β-bridge	trans	-56.6	124.4	-179.6	174.7	-121.7	0	0	0	111.6	N292 R293 N294 K295 S297 P302 H341	N292-Y300 CarbonylContact O-C 3.56Å; N292-Y300 WeakPolarHBondContact O-CA 3.44Å; R293-Y300 WeakPolarHBondContact O-CE2 3.26Å; N294-Y300 VanDerWaalsContact C-CD2 3.49Å; N294-Y300 VanDerWaalsContact O-CB 3.31Å; N294-Y300 WeakPolarHBondContact O-CB 3.4Å; N294-Y300 WeakPolarHBondContact O-CD2 3.43Å; K295-Y300 HydrophobicContact CG-CD1 4.49Å; K295-Y300 HydrophobicContact CG-CD2 4.23Å; K295-Y300 HydrophobicContact CG-CE1 4.02Å; K295-Y300 HydrophobicContact CG-CE2 3.72Å; S297-Y300 WeakPolarHBondContact O-CB 3.41Å; S297-Y300 PolarHBondContact O-N 2.88Å; Y300-P302 HydrophobicContact CD1-CG 4.26Å; Y300-P302 HydrophobicContact CE1-CB 4.2Å; Y300-P302 HydrophobicContact CE1-CG 3.63Å; Y300-H341 PolarHBondContact O-CE1 2.98Å; Y300-H341 PolarHBondContact O-NE2 2.78Å
301	M	97.3	Very high	96.1	Very high	0 Å²	0	74.9 Å²	74.9	0%	0	36%	0.357	C	S	.	.			trans	-116.2	113.5	173.1	-176.3	60.4	66.4	0	0	109.1	P291 N292 R293 W299 L305 Y306 Y311 L340 L342	P291-M301 HydrophobicContact CB-CB 3.79Å; P291-M301 HydrophobicContact CB-CG 3.98Å; N292-M301 PolarHBondContact O-N 2.85Å; R293-M301 VanDerWaalsContact CD-O 3.24Å; R293-M301 WeakPolarHBondContact CD-O 3.11Å; R293-M301 PolarHBondContact NH1-O 3.05Å; W299-M301 PolarHBondContact O-N 2.68Å; M301-L305 HydrophobicContact SD-CB 4.37Å; M301-L305 HydrophobicContact SD-CD2 3.85Å; M301-L305 HydrophobicContact SD-CG 4.13Å; M301-Y306 HydrophobicContact CG-CG 4.47Å; M301-Y311 VanDerWaalsContact CB-OH 3.25Å; M301-Y311 WeakPolarHBondContact CB-OH 3.4Å; M301-Y311 HydrophobicContact CG-CE1 4.49Å; M301-Y311 WeakPolarHBondContact CG-OH 3.35Å; M301-L340 HydrophobicContact CE-CB 4.25Å; M301-L340 HydrophobicContact CE-CD1 4.04Å; M301-L340 HydrophobicContact CE-CD2 4.42Å; M301-L340 HydrophobicContact CE-CG 4.49Å; M301-L340 HydrophobicContact SD-CD2 4.19Å; M301-L342 HydrophobicContact CE-CB 4.38Å; M301-L342 HydrophobicContact CE-CD1 3.81Å; M301-L342 HydrophobicContact CE-CG 4.01Å
302	P	95.3	Very high	96.1	Very high	30 Å²	30	75.5 Å²	75.5	20%	0.195	36%	0.361	C	S	.	.			trans	-61	138	176.5	-18.3	27.3	0	0	0	112.1	R293 Y300 E304 L305 Y306	R293-P302 VanDerWaalsContact NH1-C 3.32Å; R293-P302 PolarHBondContact NH1-O 3.26Å; Y300-P302 HydrophobicContact CD1-CG 4.26Å; Y300-P302 HydrophobicContact CE1-CB 4.2Å; Y300-P302 HydrophobicContact CE1-CG 3.63Å; P302-E304 VanDerWaalsContact CB-OE2 3.29Å; P302-E304 WeakPolarHBondContact CB-OE2 3.19Å; P302-E304 PolarHBondContact O-N 2.98Å; P302-L305 HydrophobicContact CB-CB 3.99Å; P302-L305 HydrophobicContact CG-CB 4.12Å; P302-L305 HydrophobicContact CG-CD2 4.48Å; P302-L305 PolarHBondContact O-N 3.37Å; P302-L305 VanDerWaalsContact O-N 3.1Å; P302-Y306 PolarHBondContact O-N 3.33Å
303	P	95.6	Very high	96.1	Very high	54 Å²	54	75.4 Å²	75.4	35%	0.351	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-33.3	172.4	-24.5	34.8	0	0	0	113.2	L305 Y306 P307	P303-L305 PolarHBondContact O-N 3.13Å; P303-Y306 CarbonylContact O-C 3.59Å; P303-Y306 VanDerWaalsContact O-C 3.26Å; P303-P307 WeakPolarHBondContact O-CA 3.34Å; P303-P307 WeakPolarHBondContact O-CB 3.35Å
304	E	94.2	Very high	96.2	Very high	149 Å²	149	71.7 Å²	71.7	70%	0.696	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-24.5	179.5	-51.3	74.6	-160.2	0	0	112.2	P302	P302-E304 VanDerWaalsContact CB-OE2 3.29Å; P302-E304 WeakPolarHBondContact CB-OE2 3.19Å; P302-E304 PolarHBondContact O-N 2.98Å
305	L	92.1	Very high	96.2	Very high	41 Å²	41	67.7 Å²	67.7	22%	0.215	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-37.2	179	-175.7	61.4	0	0	0	111.7	M301 P302 P303 R338 L340	M301-L305 HydrophobicContact SD-CB 4.37Å; M301-L305 HydrophobicContact SD-CD2 3.85Å; M301-L305 HydrophobicContact SD-CG 4.13Å; P302-L305 HydrophobicContact CB-CB 3.99Å; P302-L305 HydrophobicContact CG-CB 4.12Å; P302-L305 HydrophobicContact CG-CD2 4.48Å; P302-L305 PolarHBondContact O-N 3.37Å; P302-L305 VanDerWaalsContact O-N 3.1Å; P303-L305 PolarHBondContact O-N 3.13Å; L305-R338 HydrophobicContact CD1-CG 4.25Å; L305-L340 HydrophobicContact CD1-CD2 3.72Å; L305-L340 HydrophobicContact CD2-CD2 3.62Å; L305-L340 HydrophobicContact CG-CD2 3.37Å
306	Y	95.4	Very high	96.3	Very high	11 Å²	11	60.6 Å²	60.6	4%	0.043	30%	0.295	C	S	.	.			trans	-143.3	95.1	175.3	-169.9	-88.6	0	0	0	108.9	P291 R293 M301 P302 P303 S308 R310 Y311 P312 L340 I349	P291-Y306 HydrophobicContact CG-CD1 3.62Å; P291-Y306 HydrophobicContact CG-CE1 3.89Å; R293-Y306 VanDerWaalsContact CZ-O 3.3Å; R293-Y306 PolarHBondContact NH1-O 3.07Å; R293-Y306 PolarHBondContact NH2-O 2.91Å; M301-Y306 HydrophobicContact CG-CG 4.47Å; P302-Y306 PolarHBondContact O-N 3.33Å; P303-Y306 CarbonylContact O-C 3.59Å; P303-Y306 VanDerWaalsContact O-C 3.26Å; Y306-S308 WeakPolarHBondContact CD1-O 3.35Å; Y306-S308 VanDerWaalsContact CE1-CB 3.44Å; Y306-S308 WeakPolarHBondContact CE1-O 3.37Å; Y306-R310 WeakPolarHBondContact CE1-O 3.47Å; Y306-R310 PolarHBondContact OH-O 3.1Å; Y306-Y311 HydrophobicContact CD1-CD1 4.05Å; Y306-Y311 AromaticContact CD1-CE1 3.75Å; Y306-Y311 HydrophobicContact CD1-CE1 3.75Å; Y306-Y311 AromaticContact CE1-CD1 3.54Å; Y306-Y311 HydrophobicContact CE1-CD1 3.54Å; Y306-Y311 AromaticContact CE1-CE1 3.75Å; Y306-Y311 HydrophobicContact CE1-CE1 3.75Å; Y306-Y311 HydrophobicContact CE2-CD1 4.25Å; Y306-Y311 HydrophobicContact CG-CE1 4.14Å; Y306-Y311 AromaticContact CZ-CD1 3.67Å; Y306-P312 WeakPolarHBondContact OH-CD 3.4Å; Y306-L340 HydrophobicContact CD2-CD1 4.12Å; Y306-I349 HydrophobicContact CD2-CD1 4.03Å; Y306-I349 HydrophobicContact CE2-CD1 3.6Å; Y306-I349 HydrophobicContact CE2-CG1 4.25Å
307	P	94.5	Very high	96.2	Very high	71 Å²	71	53.7 Å²	53.7	46%	0.461	26%	0.26	S	S	.	.			trans	-77.8	-27	-173	29.8	-36	0	0	0	112.8	E127 P303	E127-P307 VanDerWaalsContact CD-CG 3.46Å; E127-P307 HydrophobicContact CG-CG 4.33Å; E127-P307 VanDerWaalsContact OE1-CG 3.26Å; E127-P307 WeakPolarHBondContact OE1-CG 3.29Å; P303-P307 WeakPolarHBondContact O-CA 3.34Å; P303-P307 WeakPolarHBondContact O-CB 3.35Å
308	S	95	Very high	96.2	Very high	17 Å²	17	53.2 Å²	53.2	12%	0.119	26%	0.256	C	S	.	.	S	Bend	trans	-54.9	141.7	177.6	-73.6	0	0	0	0	112.5	E127 P291 R293 Y306 R310	E127-S308 PolarHBondContact OE2-OG 3.42Å; P291-S308 WeakPolarHBondContact CG-O 3.4Å; R293-S308 PolarHBondContact NH2-O 3.29Å; Y306-S308 WeakPolarHBondContact CD1-O 3.35Å; Y306-S308 VanDerWaalsContact CE1-CB 3.44Å; Y306-S308 WeakPolarHBondContact CE1-O 3.37Å; S308-R310 VanDerWaalsContact C-N 3.32Å; S308-R310 PolarHBondContact O-N 3.39Å
309	E	96.1	Very high	96.4	Very high	162 Å²	162	47.4 Å²	47.4	76%	0.757	23%	0.231	S	C	*	.	S	Bend	trans	-77.3	-16.9	-175.5	-63.2	-168.7	153.8	0	0	114	A290 P291	A290-E309 VanDerWaalsContact CB-O 3.31Å; A290-E309 WeakPolarHBondContact CB-O 3.44Å; P291-E309 WeakPolarHBondContact CD-O 3.15Å
310	R	97	Very high	96.5	Very high	151 Å²	151	41.4 Å²	41.4	57%	0.57	21%	0.208	S	C	*	.	S	Bend	trans	-134.9	146.1	-177.2	-62.4	-70.2	178.7	165.3	-1.7	110.1	G288 Y306 S308	G288-R310 PolarHBondContact O-NH1 3.32Å; Y306-R310 WeakPolarHBondContact CE1-O 3.47Å; Y306-R310 PolarHBondContact OH-O 3.1Å; S308-R310 VanDerWaalsContact C-N 3.32Å; S308-R310 PolarHBondContact O-N 3.39Å
311	Y	97.8	Very high	96.6	Very high	19 Å²	19	39.2 Å²	39.2	8%	0.075	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-78.8	151.7	165.9	-62.3	-48.7	0	0	0	110.6	Y289 P291 M301 Y306 F314 V345	Y289-Y311 PolarHBondContact O-N 3.36Å; P291-Y311 VanDerWaalsContact CA-CZ 3.48Å; P291-Y311 WeakPolarHBondContact CA-OH 3.46Å; P291-Y311 HydrophobicContact CB-CE1 3.98Å; P291-Y311 HydrophobicContact CB-CE2 4.22Å; P291-Y311 WeakPolarHBondContact CB-OH 3.41Å; P291-Y311 HydrophobicContact CG-CD1 4.17Å; P291-Y311 HydrophobicContact CG-CE1 3.63Å; P291-Y311 HydrophobicContact CG-CE2 4.28Å; M301-Y311 VanDerWaalsContact CB-OH 3.25Å; M301-Y311 WeakPolarHBondContact CB-OH 3.4Å; M301-Y311 HydrophobicContact CG-CE1 4.49Å; M301-Y311 WeakPolarHBondContact CG-OH 3.35Å; Y306-Y311 HydrophobicContact CD1-CD1 4.05Å; Y306-Y311 AromaticContact CD1-CE1 3.75Å; Y306-Y311 HydrophobicContact CD1-CE1 3.75Å; Y306-Y311 AromaticContact CE1-CD1 3.54Å; Y306-Y311 HydrophobicContact CE1-CD1 3.54Å; Y306-Y311 AromaticContact CE1-CE1 3.75Å; Y306-Y311 HydrophobicContact CE1-CE1 3.75Å; Y306-Y311 HydrophobicContact CE2-CD1 4.25Å; Y306-Y311 HydrophobicContact CG-CE1 4.14Å; Y306-Y311 AromaticContact CZ-CD1 3.67Å; Y311-F314 HydrophobicContact CD2-CE1 4.14Å; Y311-F314 HydrophobicContact CG-CE1 4.49Å; Y311-V345 HydrophobicContact CD1-CG1 3.36Å; Y311-V345 HydrophobicContact CD2-CG1 4.17Å; Y311-V345 HydrophobicContact CD2-CG2 3.96Å; Y311-V345 HydrophobicContact CE1-CG1 3.48Å; Y311-V345 VanDerWaalsContact CE1-CG1 3.48Å; Y311-V345 HydrophobicContact CE2-CG1 4.24Å; Y311-V345 HydrophobicContact CE2-CG2 3.91Å; Y311-V345 HydrophobicContact CG-CG1 3.72Å; Y311-V345 HydrophobicContact CG-CG2 4.3Å
312	P	97.6	Very high	96.6	Very high	24 Å²	24	39.2 Å²	39.2	16%	0.156	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-59.9	169.6	163.2	28.8	-35	0	0	0	110.2	Y306 F314 I349 A352	Y306-P312 WeakPolarHBondContact OH-CD 3.4Å; P312-F314 WeakPolarHBondContact O-CD1 3.45Å; P312-F314 PolarHBondContact O-N 2.68Å; P312-I349 HydrophobicContact CG-CB 4.49Å; P312-I349 HydrophobicContact CG-CG1 3.8Å; P312-A352 HydrophobicContact CB-CB 3.9Å; P312-A352 HydrophobicContact CG-CB 4.26Å
313	I	97.9	Very high	96.8	Very high	51 Å²	51	37.8 Å²	37.8	26%	0.262	19%	0.19	S	C	.	.	P	Polyproline II helix	trans	-64.5	128.9	173.3	-60.8	158.7	0	0	0	108.4	L285 R287 P358	L285-I313 HydrophobicContact CB-CG2 4.45Å; L285-I313 HydrophobicContact CD2-CG2 4.34Å; L285-I313 HydrophobicContact CG-CG2 4.3Å; R287-I313 HydrophobicContact CG-CG1 4.35Å; R287-I313 HydrophobicContact CG-CG2 4.26Å; I313-P358 HydrophobicContact CG2-CG 4.15Å
314	F	98.2	Very high	96.9	Very high	9 Å²	9	35.5 Å²	35.5	4%	0.039	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	163.2	176.6	65.2	-83.4	0	0	0	110.6	M286 Y311 P312 D344 V345	M286-F314 HydrophobicContact CB-CD1 3.95Å; M286-F314 HydrophobicContact CB-CD2 3.9Å; M286-F314 HydrophobicContact CB-CE1 3.65Å; M286-F314 HydrophobicContact CB-CE2 3.6Å; M286-F314 HydrophobicContact CB-CG 4.07Å; M286-F314 HydrophobicContact CB-CZ 3.46Å; M286-F314 VanDerWaalsContact CB-CZ 3.46Å; M286-F314 WeakPolarHBondContact CB-O 3.39Å; M286-F314 HydrophobicContact CE-CZ 4.42Å; M286-F314 HydrophobicContact CG-CD2 4Å; M286-F314 HydrophobicContact CG-CE2 3.58Å; M286-F314 HydrophobicContact CG-CZ 3.88Å; M286-F314 PolarHBondContact N-O 3.39Å; M286-F314 PolarHBondContact O-N 3.45Å; Y311-F314 HydrophobicContact CD2-CE1 4.14Å; Y311-F314 HydrophobicContact CG-CE1 4.49Å; P312-F314 WeakPolarHBondContact O-CD1 3.45Å; P312-F314 PolarHBondContact O-N 2.68Å; F314-D344 WeakPolarHBondContact CB-O 3.43Å; F314-D344 HydrophobicContact CD2-CB 3.99Å; F314-D344 HydrophobicContact CE2-CB 4.36Å; F314-V345 HydrophobicContact CD1-CG2 4.39Å; F314-V345 HydrophobicContact CD2-CG2 4.33Å; F314-V345 HydrophobicContact CE1-CG2 4.05Å; F314-V345 HydrophobicContact CE2-CG2 3.97Å; F314-V345 HydrophobicContact CZ-CG2 3.83Å
315	C	98.3	Very high	97.1	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.014	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	143.1	170.6	-67.1	0	0	0	0	110	F281 G283 Y284 G317 Y320 D344	F281-C315 HydrophobicContact CE1-CB 3.85Å; G283-C315 PolarHBondContact N-SG 2.91Å; G283-C315 VanDerWaalsContact N-SG 3.43Å; Y284-C315 CarbonylContact O-C 3.55Å; Y284-C315 VanDerWaalsContact O-CA 3.24Å; Y284-C315 WeakPolarHBondContact O-CA 3.38Å; C315-G317 PolarHBondContact O-N 2.99Å; C315-Y320 HydrophobicContact CB-CD1 4.41Å; C315-Y320 HydrophobicContact CB-CG 4.38Å; C315-D344 WeakPolarHBondContact O-CB 3.33Å
316	S	97.8	Very high	97.4	Very high	9 Å²	9	28.3 Å²	28.3	6%	0.063	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.3	134	174.1	175.4	0	0	0	0	112.5	Y284 T318 G319 H369	Y284-S316 PolarHBondContact O-N 2.86Å; S316-T318 PolarHBondContact O-N 3.32Å; S316-T318 VanDerWaalsContact O-N 3.08Å; S316-T318 PolarHBondContact OG-N 2.89Å; S316-T318 PolarHBondContact OG-OG1 3.44Å; S316-G319 PolarHBondContact O-N 3.1Å; S316-H369 WeakPolarHBondContact OG-CB 3.37Å
317	G	95.9	Very high	97.6	Very high	8 Å²	8	27.8 Å²	27.8	8%	0.082	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	-18.7	178.9	0	0	0	0	0	115.3	K253 C315 G319 D344	K253-G317 PolarHBondContact NZ-O 2.85Å; C315-G317 PolarHBondContact O-N 2.99Å; G317-G319 PolarHBondContact O-N 2.88Å; G317-G319 VanDerWaalsContact O-N 3.16Å; G317-D344 PolarHBondContact N-OD2 3.03Å; G317-D344 VanDerWaalsContact N-OD2 3.1Å
318	T	96.4	Very high	97.7	Very high	14 Å²	14	29.4 Å²	29.4	9%	0.086	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	-24.2	177.3	55.5	0	0	0	0	113.7	T254 M258 S316 H369 H386	T254-T318 PolarHBondContact OG1-O 3.45Å; M258-T318 WeakPolarHBondContact CE-O 3.42Å; M258-T318 WeakPolarHBondContact CG-O 3.4Å; M258-T318 HydrophobicContact SD-CG2 4.41Å; S316-T318 PolarHBondContact O-N 3.32Å; S316-T318 VanDerWaalsContact O-N 3.08Å; S316-T318 PolarHBondContact OG-N 2.89Å; S316-T318 PolarHBondContact OG-OG1 3.44Å; T318-H369 HydrophobicContact CG2-CB 3.92Å; T318-H369 WeakPolarHBondContact OG1-CA 3.37Å; T318-H369 VanDerWaalsContact OG1-CB 3.23Å; T318-H369 WeakPolarHBondContact OG1-CB 3.2Å; T318-H386 HydrophobicContact CG2-CB 4.42Å
319	G	97.8	Very high	97.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.9	125.2	178	0	0	0	0	0	113.8	K253 S316 G317	K253-G319 VanDerWaalsContact O-CA 3.32Å; K253-G319 WeakPolarHBondContact O-CA 3.47Å; S316-G319 PolarHBondContact O-N 3.1Å; G317-G319 PolarHBondContact O-N 2.88Å; G317-G319 VanDerWaalsContact O-N 3.16Å
320	Y	98.8	Very high	98	Very high	1 Å²	1	23.4 Å²	23.4	0%	0.004	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	157.4	175	56.8	-105	0	0	0	111.2	T234 M238 M252 K253 F281 T282 C315 F322 E343	T234-Y320 WeakPolarHBondContact CG2-OH 3.24Å; M238-Y320 HydrophobicContact CE-CE2 4.05Å; M252-Y320 WeakPolarHBondContact CA-O 3.23Å; M252-Y320 WeakPolarHBondContact CG-O 3.35Å; K253-Y320 HydrophobicContact CB-CD2 4.15Å; K253-Y320 HydrophobicContact CB-CE1 4.23Å; K253-Y320 HydrophobicContact CB-CE2 3.54Å; K253-Y320 HydrophobicContact CD-CD1 4.45Å; K253-Y320 HydrophobicContact CD-CE1 3.66Å; K253-Y320 HydrophobicContact CG-CE1 4.38Å; K253-Y320 HydrophobicContact CG-CE2 4.38Å; K253-Y320 PolarHBondContact N-O 3.42Å; K253-Y320 PolarHBondContact O-N 3.35Å; K253-Y320 VanDerWaalsContact O-N 3.07Å; F281-Y320 AromaticContact CE1-CD2 3.88Å; F281-Y320 HydrophobicContact CE1-CD2 3.88Å; F281-Y320 AromaticContact CE1-CG 3.93Å; F281-Y320 HydrophobicContact CE1-CG 3.93Å; F281-Y320 AromaticContact CE2-CD2 3.78Å; F281-Y320 HydrophobicContact CE2-CD2 3.78Å; F281-Y320 AromaticContact CE2-CE2 3.89Å; F281-Y320 HydrophobicContact CE2-CE2 3.89Å; F281-Y320 HydrophobicContact CZ-CD1 4.3Å; F281-Y320 AromaticContact CZ-CD2 3.19Å; F281-Y320 HydrophobicContact CZ-CD2 3.19Å; F281-Y320 AromaticContact CZ-CE2 3.51Å; F281-Y320 HydrophobicContact CZ-CE2 3.51Å; F281-Y320 AromaticContact CZ-CG 3.64Å; F281-Y320 HydrophobicContact CZ-CG 3.64Å; T282-Y320 WeakPolarHBondContact O-CA 3.37Å; T282-Y320 WeakPolarHBondContact O-CB 3.49Å; C315-Y320 HydrophobicContact CB-CD1 4.41Å; C315-Y320 HydrophobicContact CB-CG 4.38Å; Y320-F322 AromaticContact CD2-CD1 3.84Å; Y320-F322 HydrophobicContact CD2-CD1 3.84Å; Y320-F322 HydrophobicContact CD2-CE1 4.07Å; Y320-F322 AromaticContact CE2-CD1 3.88Å; Y320-F322 HydrophobicContact CE2-CD1 3.88Å; Y320-F322 AromaticContact CE2-CE1 3.7Å; Y320-F322 HydrophobicContact CE2-CE1 3.7Å; Y320-E343 PolarHBondContact OH-OE1 3.39Å
321	V	98.7	Very high	98	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	139.1	-174.6	-177.6	0	0	0	0	109.6	V251 M252 L265 L270 F281 T282 F367	V251-V321 CarbonylContact O-C 3.58Å; V251-V321 WeakPolarHBondContact O-CA 3.23Å; M252-V321 HydrophobicContact CB-CG2 4.02Å; M252-V321 HydrophobicContact CG-CG2 3.88Å; M252-V321 HydrophobicContact SD-CG2 4.14Å; L265-V321 HydrophobicContact CD1-CG1 4.47Å; L265-V321 HydrophobicContact CD1-CG2 3.79Å; L265-V321 HydrophobicContact CD2-CG2 4.27Å; L270-V321 HydrophobicContact CD1-CG1 4.34Å; L270-V321 HydrophobicContact CD2-CG1 3.91Å; F281-V321 CarbonylContact C-O 3.52Å; F281-V321 WeakPolarHBondContact CA-O 3.39Å; T282-V321 HydrophobicContact CG2-CB 4.07Å; T282-V321 PolarHBondContact N-O 2.96Å; T282-V321 PolarHBondContact O-N 3Å; V321-F367 HydrophobicContact CG2-CE1 4Å; V321-F367 HydrophobicContact CG2-CZ 4.04Å
322	F	98.8	Very high	97.9	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	157	179.9	54.1	-81.9	0	0	0	111.6	M238 Y250 V251 K253 Y280 F281 Y320 M326 A327	M238-F322 HydrophobicContact CE-CE1 4.02Å; M238-F322 HydrophobicContact CE-CZ 3.85Å; M238-F322 HydrophobicContact CG-CZ 4.12Å; Y250-F322 CarbonylContact C-O 3.55Å; Y250-F322 WeakPolarHBondContact CA-O 3.41Å; V251-F322 HydrophobicContact CB-CD1 4.34Å; V251-F322 HydrophobicContact CB-CD2 3.93Å; V251-F322 HydrophobicContact CB-CE1 3.91Å; V251-F322 HydrophobicContact CB-CE2 3.49Å; V251-F322 VanDerWaalsContact CB-CE2 3.49Å; V251-F322 HydrophobicContact CB-CG 4.37Å; V251-F322 HydrophobicContact CB-CZ 3.48Å; V251-F322 VanDerWaalsContact CB-CZ 3.48Å; V251-F322 HydrophobicContact CG1-CE1 3.82Å; V251-F322 HydrophobicContact CG1-CE2 3.84Å; V251-F322 HydrophobicContact CG1-CZ 3.34Å; V251-F322 HydrophobicContact CG2-CD2 4.36Å; V251-F322 HydrophobicContact CG2-CE2 3.87Å; V251-F322 HydrophobicContact CG2-CZ 4.26Å; V251-F322 PolarHBondContact N-O 3.1Å; V251-F322 WeakPolarHBondContact O-CD1 3.48Å; V251-F322 PolarHBondContact O-N 3.4Å; K253-F322 HydrophobicContact CB-CE1 4.46Å; Y280-F322 CarbonylContact O-C 3.6Å; Y280-F322 WeakPolarHBondContact O-CA 3.2Å; Y280-F322 WeakPolarHBondContact O-CB 3.46Å; F281-F322 HydrophobicContact CB-CB 4.46Å; F281-F322 HydrophobicContact CD2-CB 3.5Å; F281-F322 HydrophobicContact CD2-CD1 4.38Å; F281-F322 HydrophobicContact CD2-CG 4.15Å; F281-F322 HydrophobicContact CE2-CB 4.01Å; F281-F322 HydrophobicContact CE2-CD1 4.01Å; F281-F322 HydrophobicContact CE2-CG 4.19Å; F281-F322 HydrophobicContact CG-CB 4.19Å; Y320-F322 AromaticContact CD2-CD1 3.84Å; Y320-F322 HydrophobicContact CD2-CD1 3.84Å; Y320-F322 HydrophobicContact CD2-CE1 4.07Å; Y320-F322 AromaticContact CE2-CD1 3.88Å; Y320-F322 HydrophobicContact CE2-CD1 3.88Å; Y320-F322 AromaticContact CE2-CE1 3.7Å; Y320-F322 HydrophobicContact CE2-CE1 3.7Å; F322-M326 HydrophobicContact CB-CB 4.01Å; F322-M326 HydrophobicContact CB-CG 4.45Å; F322-M326 HydrophobicContact CD2-CB 3.78Å; F322-M326 HydrophobicContact CG-CB 4.3Å; F322-A327 HydrophobicContact CE2-CB 3.97Å
323	S	98.7	Very high	97.9	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	152.2	172.7	51.5	0	0	0	0	110.9	S249 K277 K279 Y280 D325 M326	S249-S323 WeakPolarHBondContact O-CA 3.23Å; K277-S323 WeakPolarHBondContact O-CB 3.47Å; K279-S323 PolarHBondContact N-OG 2.75Å; Y280-S323 PolarHBondContact N-OG 3.3Å; Y280-S323 PolarHBondContact O-N 2.86Å; Y280-S323 PolarHBondContact O-OG 2.56Å; S323-D325 VanDerWaalsContact C-N 3.27Å; S323-D325 WeakPolarHBondContact CB-OD1 3.36Å; S323-D325 PolarHBondContact O-N 3.06Å; S323-D325 PolarHBondContact OG-OD1 2.85Å; S323-M326 VanDerWaalsContact O-CB 3.31Å; S323-M326 WeakPolarHBondContact O-CB 3.38Å; S323-M326 PolarHBondContact O-N 3.03Å
324	G	98.2	Very high	97.8	Very high	7 Å²	7	17.9 Å²	17.9	7%	0.072	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-39.1	-173.9	0	0	0	0	0	114.5	V248 S249 M326 A327	V248-G324 WeakPolarHBondContact O-CA 3.41Å; S249-G324 PolarHBondContact O-N 2.59Å; G324-M326 PolarHBondContact O-N 3.12Å; G324-M326 VanDerWaalsContact O-N 3.17Å; G324-A327 WeakPolarHBondContact O-CB 3.43Å; G324-A327 PolarHBondContact O-N 2.95Å
325	D	98.4	Very high	97.5	Very high	38 Å²	38	19.7 Å²	19.7	20%	0.203	10%	0.103	C	C	.	.	H	α-helix	trans	-57.8	-29.4	177.1	66.5	-51.3	0	0	0	113.1	K279 S323 A327 E328 L329	K279-D325 WeakPolarHBondContact CG-OD2 3.3Å; K279-D325 PolarHBondContact N-OD1 3.38Å; K279-D325 PolarHBondContact N-OD2 3.44Å; S323-D325 VanDerWaalsContact C-N 3.27Å; S323-D325 WeakPolarHBondContact CB-OD1 3.36Å; S323-D325 PolarHBondContact O-N 3.06Å; S323-D325 PolarHBondContact OG-OD1 2.85Å; D325-A327 VanDerWaalsContact C-N 3.25Å; D325-A327 PolarHBondContact O-N 3.08Å; D325-E328 PolarHBondContact O-N 3.44Å; D325-L329 WeakPolarHBondContact O-CG 3.43Å; D325-L329 PolarHBondContact O-N 3.21Å
326	M	98.7	Very high	97.2	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-68.7	-22.9	179.4	-69.6	-64.9	-65.2	0	0	113.1	K279 F281 F322 S323 G324 L329 I330 L351 I356	K279-M326 VanDerWaalsContact CA-SD 3.59Å; K279-M326 HydrophobicContact CB-SD 4.25Å; F281-M326 HydrophobicContact CD2-CE 4.45Å; F322-M326 HydrophobicContact CB-CB 4.01Å; F322-M326 HydrophobicContact CB-CG 4.45Å; F322-M326 HydrophobicContact CD2-CB 3.78Å; F322-M326 HydrophobicContact CG-CB 4.3Å; S323-M326 VanDerWaalsContact O-CB 3.31Å; S323-M326 WeakPolarHBondContact O-CB 3.38Å; S323-M326 PolarHBondContact O-N 3.03Å; G324-M326 PolarHBondContact O-N 3.12Å; G324-M326 VanDerWaalsContact O-N 3.17Å; M326-L329 HydrophobicContact SD-CD1 3.85Å; M326-I330 HydrophobicContact CB-CD1 4.22Å; M326-I330 HydrophobicContact CE-CD1 4.04Å; M326-I330 HydrophobicContact CE-CG1 4.04Å; M326-I330 VanDerWaalsContact O-CB 3.29Å; M326-I330 WeakPolarHBondContact O-CB 3.38Å; M326-I330 WeakPolarHBondContact O-CD1 3.4Å; M326-I330 WeakPolarHBondContact O-CG1 3.39Å; M326-I330 PolarHBondContact O-N 2.97Å; M326-L351 HydrophobicContact CE-CD2 3.15Å; M326-I356 HydrophobicContact CE-CB 4.48Å; M326-I356 HydrophobicContact CE-CD1 3.76Å; M326-I356 HydrophobicContact CE-CG2 4.02Å; M326-I356 HydrophobicContact SD-CD1 3.54Å; M326-I356 VanDerWaalsContact SD-CD1 3.54Å
327	A	98.4	Very high	96.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59.8	-49.7	177	0	0	0	0	0	111.3	V241 F322 G324 D325 Y331	V241-A327 HydrophobicContact CB-CB 3.94Å; V241-A327 HydrophobicContact CG1-CB 3.75Å; F322-A327 HydrophobicContact CE2-CB 3.97Å; G324-A327 WeakPolarHBondContact O-CB 3.43Å; G324-A327 PolarHBondContact O-N 2.95Å; D325-A327 VanDerWaalsContact C-N 3.25Å; D325-A327 PolarHBondContact O-N 3.08Å; A327-Y331 VanDerWaalsContact O-CB 3.29Å; A327-Y331 WeakPolarHBondContact O-CB 3.27Å; A327-Y331 PolarHBondContact O-N 2.75Å; A327-Y331 VanDerWaalsContact O-N 3.09Å
328	E	97.9	Very high	96.6	Very high	105 Å²	105	27.9 Å²	27.9	49%	0.491	14%	0.136	S	C	.	.	H	α-helix	trans	-68.8	-46.8	177.9	-176.1	175.9	-160.4	0	0	111.1	A242 D325 I330 Y331 Q332	A242-E328 HydrophobicContact CB-CB 3.81Å; A242-E328 HydrophobicContact CB-CG 4.34Å; D325-E328 PolarHBondContact O-N 3.44Å; E328-I330 VanDerWaalsContact C-N 3.35Å; E328-I330 PolarHBondContact O-N 3.22Å; E328-Y331 PolarHBondContact O-N 2.87Å; E328-Q332 HydrophobicContact CG-CG 4.09Å; E328-Q332 WeakPolarHBondContact O-CB 3.34Å; E328-Q332 WeakPolarHBondContact O-CG 3.48Å; E328-Q332 PolarHBondContact O-N 3.43Å
329	L	98.5	Very high	96.4	Very high	54 Å²	54	30.6 Å²	30.6	28%	0.283	15%	0.145	S	C	.	.	H	α-helix	trans	-58	-46.3	-178.8	-68.8	172.9	0	0	0	112	K279 D325 M326 A333 L354 I356	K279-L329 HydrophobicContact CG-CD1 4.19Å; D325-L329 WeakPolarHBondContact O-CG 3.43Å; D325-L329 PolarHBondContact O-N 3.21Å; M326-L329 HydrophobicContact SD-CD1 3.85Å; L329-A333 WeakPolarHBondContact O-CB 3.37Å; L329-A333 PolarHBondContact O-N 3.28Å; L329-L354 HydrophobicContact CB-CD1 3.9Å; L329-L354 HydrophobicContact CB-CD2 4.39Å; L329-I356 HydrophobicContact CD1-CD1 4.48Å
330	I	98.4	Very high	96.2	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-66.4	-45.2	178.3	-66.6	165.3	0	0	0	110.2	M238 F281 M326 E328 Q332 A333 S334 V347 C350 L351 L354	M238-I330 HydrophobicContact CE-CD1 4.07Å; M238-I330 HydrophobicContact CE-CG2 4.27Å; M238-I330 HydrophobicContact SD-CB 3.99Å; M238-I330 HydrophobicContact SD-CD1 4.32Å; M238-I330 HydrophobicContact SD-CG2 3.51Å; M238-I330 VanDerWaalsContact SD-CG2 3.51Å; F281-I330 HydrophobicContact CD2-CD1 4.05Å; F281-I330 HydrophobicContact CE2-CD1 3.82Å; M326-I330 HydrophobicContact CB-CD1 4.22Å; M326-I330 HydrophobicContact CE-CD1 4.04Å; M326-I330 HydrophobicContact CE-CG1 4.04Å; M326-I330 VanDerWaalsContact O-CB 3.29Å; M326-I330 WeakPolarHBondContact O-CB 3.38Å; M326-I330 WeakPolarHBondContact O-CD1 3.4Å; M326-I330 WeakPolarHBondContact O-CG1 3.39Å; M326-I330 PolarHBondContact O-N 2.97Å; E328-I330 VanDerWaalsContact C-N 3.35Å; E328-I330 PolarHBondContact O-N 3.22Å; I330-Q332 PolarHBondContact O-N 3.38Å; I330-A333 PolarHBondContact O-N 3.15Å; I330-S334 WeakPolarHBondContact O-CB 3.17Å; I330-S334 PolarHBondContact O-N 3.23Å; I330-V347 HydrophobicContact CD1-CG1 4.29Å; I330-C350 HydrophobicContact CG2-CB 3.93Å; I330-L351 HydrophobicContact CD1-CD2 4.07Å; I330-L351 HydrophobicContact CG1-CD2 4.12Å; I330-L354 HydrophobicContact CG1-CD1 4.37Å
331	Y	96.9	Very high	95.9	Very high	16 Å²	16	32 Å²	32	6%	0.063	15%	0.152	C	C	.	.	H	α-helix	trans	-59.9	-47.6	179	-179.8	-103.2	0	0	0	111.6	Q137 L235 N239 A327 E328 A333 S334 L335	Q137-Y331 WeakPolarHBondContact CG-OH 3.48Å; Q137-Y331 PolarHBondContact NE2-OH 3.25Å; L235-Y331 HydrophobicContact CB-CD2 4.44Å; N239-Y331 HydrophobicContact CB-CD1 4.44Å; N239-Y331 HydrophobicContact CB-CD2 3.72Å; N239-Y331 HydrophobicContact CB-CE1 4.41Å; N239-Y331 HydrophobicContact CB-CE2 3.68Å; N239-Y331 HydrophobicContact CB-CG 4.12Å; N239-Y331 WeakPolarHBondContact OD1-CE1 3.11Å; N239-Y331 VanDerWaalsContact OD1-CZ 3.31Å; A327-Y331 VanDerWaalsContact O-CB 3.29Å; A327-Y331 WeakPolarHBondContact O-CB 3.27Å; A327-Y331 PolarHBondContact O-N 2.75Å; A327-Y331 VanDerWaalsContact O-N 3.09Å; E328-Y331 PolarHBondContact O-N 2.87Å; Y331-A333 PolarHBondContact O-N 2.79Å; Y331-S334 WeakPolarHBondContact O-CB 3.32Å; Y331-S334 PolarHBondContact O-N 3.43Å; Y331-S334 VanDerWaalsContact O-N 3.17Å; Y331-S334 PolarHBondContact O-OG 3.04Å; Y331-L335 HydrophobicContact CE1-CD1 4.26Å; Y331-L335 HydrophobicContact CE1-CD2 4.3Å; Y331-L335 HydrophobicContact CE1-CG 4.49Å; Y331-L335 HydrophobicContact CE2-CD2 4.43Å; Y331-L335 PolarHBondContact O-N 2.71Å
332	Q	96.1	Very high	95.9	Very high	101 Å²	101	32.4 Å²	32.4	47%	0.472	15%	0.154	S	C	.	.	H	α-helix	trans	-63.6	-41.8	178	-68	-62	-18.9	0	0	112.4	E328 I330 S334 L335	E328-Q332 HydrophobicContact CG-CG 4.09Å; E328-Q332 WeakPolarHBondContact O-CB 3.34Å; E328-Q332 WeakPolarHBondContact O-CG 3.48Å; E328-Q332 PolarHBondContact O-N 3.43Å; I330-Q332 PolarHBondContact O-N 3.38Å; Q332-S334 VanDerWaalsContact C-N 3.28Å; Q332-S334 PolarHBondContact O-N 2.81Å; Q332-L335 PolarHBondContact O-N 2.79Å
333	A	96.8	Very high	95.8	Very high	8 Å²	8	32.8 Å²	32.8	7%	0.066	16%	0.156	C	C	.	.	H	α-helix	trans	-59.2	-41.6	174.3	0	0	0	0	0	111.5	L329 I330 Y331 L335 S336 I337 C350 K353 L354	L329-A333 WeakPolarHBondContact O-CB 3.37Å; L329-A333 PolarHBondContact O-N 3.28Å; I330-A333 PolarHBondContact O-N 3.15Å; Y331-A333 PolarHBondContact O-N 2.79Å; A333-L335 PolarHBondContact O-N 2.74Å; A333-S336 PolarHBondContact O-N 3.36Å; A333-S336 PolarHBondContact O-OG 2.8Å; A333-I337 HydrophobicContact CB-CD1 4.5Å; A333-I337 WeakPolarHBondContact O-CG1 3.3Å; A333-C350 HydrophobicContact CB-CB 4.27Å; A333-K353 HydrophobicContact CB-CD 4.45Å; A333-L354 HydrophobicContact CB-CD1 4.21Å; A333-L354 HydrophobicContact CB-CD2 4.14Å; A333-L354 HydrophobicContact CB-CG 4.04Å
334	S	95.8	Very high	95.8	Very high	4 Å²	4	34.4 Å²	34.4	3%	0.028	17%	0.165	C	C	.	.	H	α-helix	trans	-59.5	-31.6	-178.1	82.6	0	0	0	0	113.7	I330 Y331 Q332 S336 I337 Y346	I330-S334 WeakPolarHBondContact O-CB 3.17Å; I330-S334 PolarHBondContact O-N 3.23Å; Y331-S334 WeakPolarHBondContact O-CB 3.32Å; Y331-S334 PolarHBondContact O-N 3.43Å; Y331-S334 VanDerWaalsContact O-N 3.17Å; Y331-S334 PolarHBondContact O-OG 3.04Å; Q332-S334 VanDerWaalsContact C-N 3.28Å; Q332-S334 PolarHBondContact O-N 2.81Å; S334-S336 PolarHBondContact O-N 2.97Å; S334-I337 PolarHBondContact O-N 3.28Å; S334-Y346 WeakPolarHBondContact CA-OH 3.35Å; S334-Y346 WeakPolarHBondContact CB-OH 3.39Å; S334-Y346 PolarHBondContact O-OH 2.92Å
335	L	92.6	Very high	95.8	Very high	46 Å²	46	34.3 Å²	34.3	24%	0.241	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-20	-179.1	-60.9	-178.6	0	0	0	113.4	Y331 Q332 A333	Y331-L335 HydrophobicContact CE1-CD1 4.26Å; Y331-L335 HydrophobicContact CE1-CD2 4.3Å; Y331-L335 HydrophobicContact CE1-CG 4.49Å; Y331-L335 HydrophobicContact CE2-CD2 4.43Å; Y331-L335 PolarHBondContact O-N 2.71Å; Q332-L335 PolarHBondContact O-N 2.79Å; A333-L335 PolarHBondContact O-N 2.74Å
336	S	91.6	Very high	95.8	Very high	37 Å²	37	32.5 Å²	32.5	26%	0.259	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-2.1	179.5	65.7	0	0	0	0	114	A333 S334 K353	A333-S336 PolarHBondContact O-N 3.36Å; A333-S336 PolarHBondContact O-OG 2.8Å; S334-S336 PolarHBondContact O-N 2.97Å; S336-K353 VanDerWaalsContact OG-CE 3.24Å; S336-K353 WeakPolarHBondContact OG-CE 3.42Å; S336-K353 PolarHBondContact OG-NZ 3.15Å
337	I	91.3	Very high	95.8	Very high	11 Å²	11	32.7 Å²	32.7	6%	0.056	15%	0.154	C	C	.	.	S	Bend	trans	-111.8	126.3	-176.2	-59.2	162.4	0	0	0	108.5	A333 S334 R339 Y346 I349 C350 K353	A333-I337 HydrophobicContact CB-CD1 4.5Å; A333-I337 WeakPolarHBondContact O-CG1 3.3Å; S334-I337 PolarHBondContact O-N 3.28Å; I337-R339 PolarHBondContact O-N 2.94Å; I337-R339 VanDerWaalsContact O-N 3.13Å; I337-Y346 HydrophobicContact CB-CE2 4.17Å; I337-Y346 HydrophobicContact CG2-CD2 4.47Å; I337-Y346 HydrophobicContact CG2-CE2 3.7Å; I337-Y346 PolarHBondContact O-OH 3.07Å; I337-I349 HydrophobicContact CD1-CG2 4.29Å; I337-I349 HydrophobicContact CG2-CG2 3.98Å; I337-C350 HydrophobicContact CD1-CB 4.3Å; I337-K353 HydrophobicContact CD1-CB 4.17Å; I337-K353 HydrophobicContact CD1-CD 3.73Å; I337-K353 HydrophobicContact CG1-CD 3.82Å
338	R	90.8	Very high	95.8	Very high	143 Å²	143	32.8 Å²	32.8	54%	0.54	15%	0.154	S	C	.	.			trans	-53.1	121.3	174.4	-175.5	174.9	-176.5	176.5	1.9	110.4	L305 L340 Y346	L305-R338 HydrophobicContact CD1-CG 4.25Å; R338-L340 PolarHBondContact O-N 3.44Å; R338-Y346 WeakPolarHBondContact O-CE2 3.24Å
339	R	90.7	Very high	95.9	Very high	72 Å²	72	28.1 Å²	28.1	27%	0.272	13%	0.133	S	C	.	.			trans	-60.5	134	-175.6	-165.4	178.1	-63.6	139	1.6	111.7	T231 I337	T231-R339 HydrophobicContact CG2-CG 3.71Å; I337-R339 PolarHBondContact O-N 2.94Å; I337-R339 VanDerWaalsContact O-N 3.13Å
340	L	93.4	Very high	95.9	Very high	8 Å²	8	25.5 Å²	25.5	4%	0.042	12%	0.119	C	C	.	.			trans	-111.3	155.7	171.1	-55.2	-177.3	0	0	0	109.7	T231 M301 L305 Y306 R338 Y346 I349	T231-L340 WeakPolarHBondContact CB-O 3.42Å; T231-L340 PolarHBondContact OG1-O 3.01Å; M301-L340 HydrophobicContact CE-CB 4.25Å; M301-L340 HydrophobicContact CE-CD1 4.04Å; M301-L340 HydrophobicContact CE-CD2 4.42Å; M301-L340 HydrophobicContact CE-CG 4.49Å; M301-L340 HydrophobicContact SD-CD2 4.19Å; L305-L340 HydrophobicContact CD1-CD2 3.72Å; L305-L340 HydrophobicContact CD2-CD2 3.62Å; L305-L340 HydrophobicContact CG-CD2 3.37Å; Y306-L340 HydrophobicContact CD2-CD1 4.12Å; R338-L340 PolarHBondContact O-N 3.44Å; L340-Y346 HydrophobicContact CB-CD2 3.94Å; L340-Y346 HydrophobicContact CG-CD2 4Å; L340-I349 HydrophobicContact CD1-CD1 3.43Å; L340-I349 VanDerWaalsContact CD1-CD1 3.43Å
341	H	93.8	Very high	95.9	Very high	21 Å²	21	25.6 Å²	25.6	10%	0.097	12%	0.12	C	C	.	.	S	Bend	trans	-83.6	-23.5	-179.1	69.9	-77.9	0	0	0	113.6	Y228 Y300 E343	Y228-H341 HydrophobicContact CD1-CB 3.7Å; Y228-H341 AromaticContact CD1-CD2 3.55Å; Y228-H341 AromaticContact CD1-CG 3.59Å; Y228-H341 AromaticContact CE1-CD2 3.67Å; Y228-H341 HydrophobicContact CG-CB 4.42Å; Y228-H341 VanDerWaalsContact O-CB 3.32Å; Y228-H341 WeakPolarHBondContact O-CB 3.25Å; Y300-H341 PolarHBondContact O-CE1 2.98Å; Y300-H341 PolarHBondContact O-NE2 2.78Å; H341-E343 PolarHBondContact O-N 3.44Å; H341-E343 VanDerWaalsContact O-N 3.15Å
342	L	97.6	Very high	95.9	Very high	9 Å²	9	26.6 Å²	26.6	5%	0.047	13%	0.132	C	C	.	.			trans	-77.7	95.9	172	-59.2	-176.9	0	0	0	108.8	Y227 M301 D344 V345 Y346	Y227-L342 HydrophobicContact CE1-CD2 4.4Å; M301-L342 HydrophobicContact CE-CB 4.38Å; M301-L342 HydrophobicContact CE-CD1 3.81Å; M301-L342 HydrophobicContact CE-CG 4.01Å; L342-D344 PolarHBondContact O-N 2.88Å; L342-V345 HydrophobicContact CB-CB 3.93Å; L342-V345 HydrophobicContact CB-CG2 4.01Å; L342-V345 HydrophobicContact CD1-CG2 4.23Å; L342-V345 PolarHBondContact O-N 3.15Å; L342-Y346 WeakPolarHBondContact O-CB 3.27Å; L342-Y346 PolarHBondContact O-N 3.32Å
343	E	97.8	Very high	96	Very high	8 Å²	8	24.8 Å²	24.8	4%	0.037	12%	0.122	C	C	.	.	H	α-helix	trans	-59.3	-45.4	-171.9	177.5	-94.5	153.6	0	0	113.7	L230 T231 T234 K253 Y320 H341 Y346 V347	L230-E343 HydrophobicContact CB-CB 3.91Å; L230-E343 HydrophobicContact CB-CG 4.49Å; T231-E343 VanDerWaalsContact OG1-CA 3.27Å; T231-E343 WeakPolarHBondContact OG1-CA 3.29Å; T234-E343 WeakPolarHBondContact CB-OE1 3.47Å; T234-E343 HydrophobicContact CG2-CG 4.27Å; T234-E343 WeakPolarHBondContact CG2-OE1 3.49Å; T234-E343 WeakPolarHBondContact OG1-CG 3.48Å; T234-E343 PolarHBondContact OG1-OE1 3.47Å; K253-E343 IonicContact NZ-OE2 2.71Å; K253-E343 PolarHBondContact NZ-OE2 3.45Å; Y320-E343 PolarHBondContact OH-OE1 3.39Å; H341-E343 PolarHBondContact O-N 3.44Å; H341-E343 VanDerWaalsContact O-N 3.15Å; E343-Y346 PolarHBondContact O-N 3.08Å; E343-V347 WeakPolarHBondContact O-CG2 3.42Å; E343-V347 PolarHBondContact O-N 3.23Å
344	D	98.3	Very high	96	Very high	35 Å²	35	27 Å²	27	19%	0.187	13%	0.132	C	C	.	.	H	α-helix	trans	-66.4	-43.5	-179.4	55.1	-6.5	0	0	0	112.7	F314 C315 G317 L342 Y346 V347 G348	F314-D344 WeakPolarHBondContact CB-O 3.43Å; F314-D344 HydrophobicContact CD2-CB 3.99Å; F314-D344 HydrophobicContact CE2-CB 4.36Å; C315-D344 WeakPolarHBondContact O-CB 3.33Å; G317-D344 PolarHBondContact N-OD2 3.03Å; G317-D344 VanDerWaalsContact N-OD2 3.1Å; L342-D344 PolarHBondContact O-N 2.88Å; D344-Y346 VanDerWaalsContact C-N 3.34Å; D344-V347 PolarHBondContact O-N 3.02Å; D344-G348 PolarHBondContact O-N 2.88Å
345	V	98.4	Very high	96.2	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.024	17%	0.168	C	C	.	.	H	α-helix	trans	-60	-45	170.7	174.9	0	0	0	0	110.7	Y311 F314 L342 V347 G348 I349	Y311-V345 HydrophobicContact CD1-CG1 3.36Å; Y311-V345 HydrophobicContact CD2-CG1 4.17Å; Y311-V345 HydrophobicContact CD2-CG2 3.96Å; Y311-V345 HydrophobicContact CE1-CG1 3.48Å; Y311-V345 VanDerWaalsContact CE1-CG1 3.48Å; Y311-V345 HydrophobicContact CE2-CG1 4.24Å; Y311-V345 HydrophobicContact CE2-CG2 3.91Å; Y311-V345 HydrophobicContact CG-CG1 3.72Å; Y311-V345 HydrophobicContact CG-CG2 4.3Å; F314-V345 HydrophobicContact CD1-CG2 4.39Å; F314-V345 HydrophobicContact CD2-CG2 4.33Å; F314-V345 HydrophobicContact CE1-CG2 4.05Å; F314-V345 HydrophobicContact CE2-CG2 3.97Å; F314-V345 HydrophobicContact CZ-CG2 3.83Å; L342-V345 HydrophobicContact CB-CB 3.93Å; L342-V345 HydrophobicContact CB-CG2 4.01Å; L342-V345 HydrophobicContact CD1-CG2 4.23Å; L342-V345 PolarHBondContact O-N 3.15Å; V345-V347 PolarHBondContact O-N 3.35Å; V345-G348 WeakPolarHBondContact O-CA 3.49Å; V345-G348 PolarHBondContact O-N 3Å; V345-G348 VanDerWaalsContact O-N 3.14Å; V345-I349 HydrophobicContact CG1-CD1 4.1Å; V345-I349 WeakPolarHBondContact O-CG1 3.33Å; V345-I349 PolarHBondContact O-N 3.07Å
346	Y	98.4	Very high	96.4	Very high	1 Å²	1	35.3 Å²	35.3	0%	0.004	16%	0.161	C	C	.	.	H	α-helix	trans	-63	-42.9	-179.3	-175.4	-95.9	0	0	0	112.3	T231 L235 S334 I337 R338 L340 L342 E343 D344 G348 I349 C350	T231-Y346 HydrophobicContact CG2-CD1 3.26Å; T231-Y346 HydrophobicContact CG2-CD2 4.3Å; T231-Y346 HydrophobicContact CG2-CE1 3.7Å; T231-Y346 HydrophobicContact CG2-CG 3.58Å; L235-Y346 HydrophobicContact CD1-CE1 3.9Å; L235-Y346 HydrophobicContact CD2-CE1 4.35Å; L235-Y346 HydrophobicContact CG-CE1 4.48Å; S334-Y346 WeakPolarHBondContact CA-OH 3.35Å; S334-Y346 WeakPolarHBondContact CB-OH 3.39Å; S334-Y346 PolarHBondContact O-OH 2.92Å; I337-Y346 HydrophobicContact CB-CE2 4.17Å; I337-Y346 HydrophobicContact CG2-CD2 4.47Å; I337-Y346 HydrophobicContact CG2-CE2 3.7Å; I337-Y346 PolarHBondContact O-OH 3.07Å; R338-Y346 WeakPolarHBondContact O-CE2 3.24Å; L340-Y346 HydrophobicContact CB-CD2 3.94Å; L340-Y346 HydrophobicContact CG-CD2 4Å; L342-Y346 WeakPolarHBondContact O-CB 3.27Å; L342-Y346 PolarHBondContact O-N 3.32Å; E343-Y346 PolarHBondContact O-N 3.08Å; D344-Y346 VanDerWaalsContact C-N 3.34Å; Y346-G348 VanDerWaalsContact C-N 3.31Å; Y346-G348 PolarHBondContact O-N 3.1Å; Y346-I349 PolarHBondContact O-N 3.26Å; Y346-C350 PolarHBondContact O-N 3.13Å; Y346-C350 PolarHBondContact O-SG 3.24Å
347	V	98.6	Very high	96.7	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.024	18%	0.182	C	C	.	.	H	α-helix	trans	-61.5	-41.9	172.7	172.7	0	0	0	0	110.3	T234 M238 F281 I330 E343 D344 V345 I349 C350 L351	T234-V347 HydrophobicContact CG2-CG2 4.24Å; M238-V347 HydrophobicContact CE-CG1 4.45Å; M238-V347 HydrophobicContact CE-CG2 4.18Å; F281-V347 HydrophobicContact CE2-CG1 3.83Å; F281-V347 HydrophobicContact CZ-CG1 3.67Å; I330-V347 HydrophobicContact CD1-CG1 4.29Å; E343-V347 WeakPolarHBondContact O-CG2 3.42Å; E343-V347 PolarHBondContact O-N 3.23Å; D344-V347 PolarHBondContact O-N 3.02Å; V345-V347 PolarHBondContact O-N 3.35Å; V347-I349 VanDerWaalsContact C-N 3.31Å; V347-I349 PolarHBondContact O-N 3.43Å; V347-C350 WeakPolarHBondContact O-CA 3.48Å; V347-C350 WeakPolarHBondContact O-CB 3.3Å; V347-C350 PolarHBondContact O-N 3.05Å; V347-C350 VanDerWaalsContact O-N 3.08Å; V347-L351 HydrophobicContact CG1-CD1 4.49Å; V347-L351 HydrophobicContact CG1-CG 4.48Å; V347-L351 WeakPolarHBondContact O-CG 3.48Å; V347-L351 PolarHBondContact O-N 3.1Å
348	G	98.4	Very high	97	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-57.4	-39	173	0	0	0	0	0	114.2	D344 V345 Y346 L351 A352	D344-G348 PolarHBondContact O-N 2.88Å; V345-G348 WeakPolarHBondContact O-CA 3.49Å; V345-G348 PolarHBondContact O-N 3Å; V345-G348 VanDerWaalsContact O-N 3.14Å; Y346-G348 VanDerWaalsContact C-N 3.31Å; Y346-G348 PolarHBondContact O-N 3.1Å; G348-L351 PolarHBondContact O-N 3.27Å; G348-A352 PolarHBondContact O-N 2.88Å
349	I	98.4	Very high	97.3	Very high	7 Å²	7	34.3 Å²	34.3	4%	0.036	17%	0.168	C	C	.	.	H	α-helix	trans	-67	-39.1	174.2	-64.3	163.3	0	0	0	111	Y306 P312 I337 L340 V345 Y346 V347 L351 A352 K353	Y306-I349 HydrophobicContact CD2-CD1 4.03Å; Y306-I349 HydrophobicContact CE2-CD1 3.6Å; Y306-I349 HydrophobicContact CE2-CG1 4.25Å; P312-I349 HydrophobicContact CG-CB 4.49Å; P312-I349 HydrophobicContact CG-CG1 3.8Å; I337-I349 HydrophobicContact CD1-CG2 4.29Å; I337-I349 HydrophobicContact CG2-CG2 3.98Å; L340-I349 HydrophobicContact CD1-CD1 3.43Å; L340-I349 VanDerWaalsContact CD1-CD1 3.43Å; V345-I349 HydrophobicContact CG1-CD1 4.1Å; V345-I349 WeakPolarHBondContact O-CG1 3.33Å; V345-I349 PolarHBondContact O-N 3.07Å; Y346-I349 PolarHBondContact O-N 3.26Å; V347-I349 VanDerWaalsContact C-N 3.31Å; V347-I349 PolarHBondContact O-N 3.43Å; I349-L351 VanDerWaalsContact C-N 3.34Å; I349-L351 PolarHBondContact O-N 2.77Å; I349-A352 PolarHBondContact O-N 3.26Å; I349-K353 PolarHBondContact O-N 3.33Å
350	C	98.6	Very high	97.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.8	-42.5	174	-62.1	0	0	0	0	111.4	I330 A333 I337 Y346 V347 K353 L354	I330-C350 HydrophobicContact CG2-CB 3.93Å; A333-C350 HydrophobicContact CB-CB 4.27Å; I337-C350 HydrophobicContact CD1-CB 4.3Å; Y346-C350 PolarHBondContact O-N 3.13Å; Y346-C350 PolarHBondContact O-SG 3.24Å; V347-C350 WeakPolarHBondContact O-CA 3.48Å; V347-C350 WeakPolarHBondContact O-CB 3.3Å; V347-C350 PolarHBondContact O-N 3.05Å; V347-C350 VanDerWaalsContact O-N 3.08Å; C350-K353 VanDerWaalsContact O-CB 3.3Å; C350-K353 WeakPolarHBondContact O-CB 3.34Å; C350-K353 PolarHBondContact O-N 2.81Å; C350-L354 WeakPolarHBondContact O-CG 3.48Å; C350-L354 PolarHBondContact O-N 2.95Å; C350-L354 VanDerWaalsContact O-N 3.13Å
351	L	98.7	Very high	97.6	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-61.6	-43.8	175.1	-66.5	179.8	0	0	0	111.9	F281 M326 I330 V347 G348 I349 K353 L354 R355 I356 P358	F281-L351 HydrophobicContact CB-CD1 4.35Å; F281-L351 HydrophobicContact CB-CD2 4.47Å; F281-L351 HydrophobicContact CD1-CD1 3.73Å; F281-L351 HydrophobicContact CD2-CD1 3.96Å; F281-L351 HydrophobicContact CD2-CD2 3.95Å; F281-L351 HydrophobicContact CE1-CD1 3.92Å; F281-L351 HydrophobicContact CE2-CD1 4.17Å; F281-L351 HydrophobicContact CE2-CD2 4.46Å; F281-L351 HydrophobicContact CG-CD1 3.75Å; F281-L351 HydrophobicContact CG-CD2 4.25Å; F281-L351 HydrophobicContact CZ-CD1 4.13Å; M326-L351 HydrophobicContact CE-CD2 3.15Å; I330-L351 HydrophobicContact CD1-CD2 4.07Å; I330-L351 HydrophobicContact CG1-CD2 4.12Å; V347-L351 HydrophobicContact CG1-CD1 4.49Å; V347-L351 HydrophobicContact CG1-CG 4.48Å; V347-L351 WeakPolarHBondContact O-CG 3.48Å; V347-L351 PolarHBondContact O-N 3.1Å; G348-L351 PolarHBondContact O-N 3.27Å; I349-L351 VanDerWaalsContact C-N 3.34Å; I349-L351 PolarHBondContact O-N 2.77Å; L351-K353 VanDerWaalsContact C-N 3.31Å; L351-K353 PolarHBondContact O-N 3.36Å; L351-L354 CarbonylContact O-C 3Å; L351-L354 PolarHBondContact O-N 3.21Å; L351-L354 VanDerWaalsContact O-N 3.14Å; L351-R355 PolarHBondContact O-N 3.23Å; L351-I356 WeakPolarHBondContact CB-O 3.33Å; L351-I356 HydrophobicContact CD2-CG2 4.4Å; L351-I356 PolarHBondContact O-N 2.94Å; L351-P358 HydrophobicContact CD1-CG 3.85Å
352	A	98.1	Very high	97.6	Very high	38 Å²	38	39.9 Å²	39.9	31%	0.314	22%	0.216	S	C	.	.	H	α-helix	trans	-60.4	-39.2	174.4	0	0	0	0	0	112.1	P312 G348 I349 L354 R355	P312-A352 HydrophobicContact CB-CB 3.9Å; P312-A352 HydrophobicContact CG-CB 4.26Å; G348-A352 PolarHBondContact O-N 2.88Å; I349-A352 PolarHBondContact O-N 3.26Å; A352-L354 VanDerWaalsContact C-N 3.29Å; A352-L354 PolarHBondContact O-N 3.4Å; A352-R355 PolarHBondContact O-N 3.35Å; A352-R355 VanDerWaalsContact O-N 3.08Å
353	K	97.4	Very high	97.4	Very high	63 Å²	63	43.2 Å²	43.2	27%	0.274	23%	0.234	S	C	.	.	H	α-helix	trans	-57.2	-43.8	173.3	-169	152.3	-171.6	149.6	0	112.7	M128 A333 S336 I337 I349 C350 L351 R355	M128-K353 HydrophobicContact CE-CB 3.05Å; M128-K353 HydrophobicContact CE-CD 3.57Å; M128-K353 HydrophobicContact CE-CG 3.29Å; M128-K353 PolarHBondContact O-NZ 3.24Å; A333-K353 HydrophobicContact CB-CD 4.45Å; S336-K353 VanDerWaalsContact OG-CE 3.24Å; S336-K353 WeakPolarHBondContact OG-CE 3.42Å; S336-K353 PolarHBondContact OG-NZ 3.15Å; I337-K353 HydrophobicContact CD1-CB 4.17Å; I337-K353 HydrophobicContact CD1-CD 3.73Å; I337-K353 HydrophobicContact CG1-CD 3.82Å; I349-K353 PolarHBondContact O-N 3.33Å; C350-K353 VanDerWaalsContact O-CB 3.3Å; C350-K353 WeakPolarHBondContact O-CB 3.34Å; C350-K353 PolarHBondContact O-N 2.81Å; L351-K353 VanDerWaalsContact C-N 3.31Å; L351-K353 PolarHBondContact O-N 3.36Å; K353-R355 PolarHBondContact O-N 3.5Å
354	L	98.1	Very high	97	Very high	53 Å²	53	48.2 Å²	48.2	28%	0.277	26%	0.258	S	S	.	.	H	α-helix	trans	-77.9	-6.3	-178.5	-64.2	166	0	0	0	112.5	L329 I330 A333 C350 L351 A352 I356	L329-L354 HydrophobicContact CB-CD1 3.9Å; L329-L354 HydrophobicContact CB-CD2 4.39Å; I330-L354 HydrophobicContact CG1-CD1 4.37Å; A333-L354 HydrophobicContact CB-CD1 4.21Å; A333-L354 HydrophobicContact CB-CD2 4.14Å; A333-L354 HydrophobicContact CB-CG 4.04Å; C350-L354 WeakPolarHBondContact O-CG 3.48Å; C350-L354 PolarHBondContact O-N 2.95Å; C350-L354 VanDerWaalsContact O-N 3.13Å; L351-L354 CarbonylContact O-C 3Å; L351-L354 PolarHBondContact O-N 3.21Å; L351-L354 VanDerWaalsContact O-N 3.14Å; A352-L354 VanDerWaalsContact C-N 3.29Å; A352-L354 PolarHBondContact O-N 3.4Å; L354-I356 VanDerWaalsContact C-N 3.26Å; L354-I356 HydrophobicContact CB-CB 4.46Å; L354-I356 HydrophobicContact CB-CD1 3.83Å; L354-I356 HydrophobicContact CB-CG1 4Å; L354-I356 HydrophobicContact CD1-CD1 4.41Å; L354-I356 PolarHBondContact O-N 3.48Å
355	R	98.1	Very high	96.7	Very high	207 Å²	207	52 Å²	52	78%	0.781	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	41.9	-172.1	-54.9	179	177.9	172.6	-0.9	111.8	L351 A352 K353	L351-R355 PolarHBondContact O-N 3.23Å; A352-R355 PolarHBondContact O-N 3.35Å; A352-R355 VanDerWaalsContact O-N 3.08Å; K353-R355 PolarHBondContact O-N 3.5Å
356	I	98.1	Very high	96.7	Very high	19 Å²	19	52.2 Å²	52.2	10%	0.097	27%	0.273	C	S	.	.			trans	-113.8	115.1	177.6	-64.4	172.7	0	0	0	107.6	K279 M326 L329 L351 L354	K279-I356 HydrophobicContact CB-CD1 4.02Å; K279-I356 HydrophobicContact CD-CD1 4.18Å; K279-I356 HydrophobicContact CG-CD1 4.13Å; M326-I356 HydrophobicContact CE-CB 4.48Å; M326-I356 HydrophobicContact CE-CD1 3.76Å; M326-I356 HydrophobicContact CE-CG2 4.02Å; M326-I356 HydrophobicContact SD-CD1 3.54Å; M326-I356 VanDerWaalsContact SD-CD1 3.54Å; L329-I356 HydrophobicContact CD1-CD1 4.48Å; L351-I356 WeakPolarHBondContact CB-O 3.33Å; L351-I356 HydrophobicContact CD2-CG2 4.4Å; L351-I356 PolarHBondContact O-N 2.94Å; L354-I356 VanDerWaalsContact C-N 3.26Å; L354-I356 HydrophobicContact CB-CB 4.46Å; L354-I356 HydrophobicContact CB-CD1 3.83Å; L354-I356 HydrophobicContact CB-CG1 4Å; L354-I356 HydrophobicContact CD1-CD1 4.41Å; L354-I356 PolarHBondContact O-N 3.48Å
357	D	96.6	Very high	96.6	Very high	132 Å²	132	52.2 Å²	52.2	71%	0.706	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-84.4	135.4	174.2	-72.1	-40.2	0	0	0	110.7	A359	D357-A359 PolarHBondContact O-N 3.15Å
358	P	97.8	Very high	96.6	Very high	7 Å²	7	52.3 Å²	52.3	5%	0.045	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-56.2	127.3	168.8	-24	33.2	0	0	0	111.1	F281 L285 I313 L351	F281-P358 HydrophobicContact CD1-CB 4.36Å; F281-P358 CarbonylContact O-C 3.56Å; F281-P358 WeakPolarHBondContact O-CA 3.3Å; L285-P358 HydrophobicContact CD1-CB 4.37Å; L285-P358 HydrophobicContact CD2-CB 4.22Å; L285-P358 HydrophobicContact CG-CB 4.11Å; I313-P358 HydrophobicContact CG2-CG 4.15Å; L351-P358 HydrophobicContact CD1-CG 3.85Å
359	A	97.9	Very high	96.5	Very high	31 Å²	31	54.8 Å²	54.8	26%	0.256	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-71.7	131.2	175.2	0	0	0	0	0	109.6	Y280 F281 T282 D357	Y280-A359 HydrophobicContact CD2-CB 4.12Å; Y280-A359 HydrophobicContact CE2-CB 3.75Å; F281-A359 PolarHBondContact O-N 2.73Å; T282-A359 PolarHBondContact OG1-O 2.69Å; D357-A359 PolarHBondContact O-N 3.15Å
360	P	96.7	Very high	96.4	Very high	89 Å²	89	58.7 Å²	58.7	58%	0.578	30%	0.299	S	S	*	.	P	Polyproline II helix	trans	-64	136.2	171.9	26.6	-32.1	0	0	0	109.6	L285	L285-P360 HydrophobicContact CD2-CB 4.29Å
361	P	94.5	Very high	96.3	Very high	17 Å²	17	61.8 Å²	61.8	11%	0.11	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-63.8	157.4	172.8	29.4	-35.8	0	0	0	109.7	G283 N363 F367	G283-P361 WeakPolarHBondContact O-CD 3.38Å; P361-N363 WeakPolarHBondContact CG-O 3.32Å; P361-N363 PolarHBondContact O-N 2.73Å; P361-F367 HydrophobicContact CB-CD2 3.98Å; P361-F367 HydrophobicContact CB-CE2 4.08Å; P361-F367 HydrophobicContact CG-CD2 4.21Å
362	P	93.8	Very high	96.3	Very high	111 Å²	111	62.5 Å²	62.5	72%	0.721	32%	0.316	S	S	*	.	S	Bend	trans	-54.5	-25.4	176.8	-26.2	34.3	0	0	0	113.7	L269	L269-P362 HydrophobicContact CD1-CG 4.08Å
363	N	93.1	Very high	96.2	Very high	80 Å²	80	64.4 Å²	64.4	43%	0.428	33%	0.326	S	S	.	.	S	Bend	trans	-146.5	129.8	172	179.5	-25.4	0	0	0	108.8	P361 F365 L366	P361-N363 WeakPolarHBondContact CG-O 3.32Å; P361-N363 PolarHBondContact O-N 2.73Å; N363-F365 PolarHBondContact O-N 2.65Å; N363-F365 WeakPolarHBondContact OD1-CB 3.47Å; N363-F365 VanDerWaalsContact OD1-CD2 3.3Å; N363-F365 WeakPolarHBondContact OD1-CD2 3.16Å; N363-F365 PolarHBondContact OD1-N 3.1Å; N363-L366 HydrophobicContact CB-CD1 4.43Å; N363-L366 HydrophobicContact CB-CG 4.13Å; N363-L366 WeakPolarHBondContact O-CB 3.42Å; N363-L366 WeakPolarHBondContact O-CG 3.4Å; N363-L366 PolarHBondContact O-N 3.33Å; N363-L366 VanDerWaalsContact O-N 3.15Å
364	E	88.3	Confident	96.1	Very high	113 Å²	113	64 Å²	64	53%	0.528	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-60.8	-28.1	-179.3	64.4	-176.3	-178.8	0	0	113.5	L366	E364-L366 PolarHBondContact O-N 3.37Å
365	F	93.3	Very high	95.9	Very high	113 Å²	113	63.1 Å²	63.1	50%	0.496	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-79.3	2.7	179	-59.9	-69.8	0	0	0	113.9	N363 N368 W370	N363-F365 PolarHBondContact O-N 2.65Å; N363-F365 WeakPolarHBondContact OD1-CB 3.47Å; N363-F365 VanDerWaalsContact OD1-CD2 3.3Å; N363-F365 WeakPolarHBondContact OD1-CD2 3.16Å; N363-F365 PolarHBondContact OD1-N 3.1Å; F365-N368 PolarHBondContact O-ND2 2.84Å; F365-W370 HydrophobicContact CD1-CH2 4.43Å; F365-W370 HydrophobicContact CD1-CZ2 4.1Å; F365-W370 HydrophobicContact CE1-CZ2 4.33Å
366	L	97.1	Very high	95.7	Very high	9 Å²	9	53.9 Å²	53.9	5%	0.047	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-70.8	-41.2	170.1	-67.3	-180	0	0	0	111	Y264 N363 E364 H381 I383 T384	Y264-L366 HydrophobicContact CE1-CD1 4.46Å; Y264-L366 HydrophobicContact CE1-CD2 3.59Å; N363-L366 HydrophobicContact CB-CD1 4.43Å; N363-L366 HydrophobicContact CB-CG 4.13Å; N363-L366 WeakPolarHBondContact O-CB 3.42Å; N363-L366 WeakPolarHBondContact O-CG 3.4Å; N363-L366 PolarHBondContact O-N 3.33Å; N363-L366 VanDerWaalsContact O-N 3.15Å; E364-L366 PolarHBondContact O-N 3.37Å; L366-H381 WeakPolarHBondContact CD2-O 3.3Å; L366-I383 HydrophobicContact CB-CD1 4.08Å; L366-I383 HydrophobicContact CB-CG1 4.22Å; L366-I383 HydrophobicContact CD1-CD1 4.36Å; L366-I383 WeakPolarHBondContact O-CA 3.19Å; L366-I383 WeakPolarHBondContact O-CB 3.42Å; L366-I383 PolarHBondContact O-N 2.68Å; L366-T384 PolarHBondContact O-N 3.28Å
367	F	97.8	Very high	95.4	Very high	1 Å²	1	54.1 Å²	54.1	0%	0.004	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-104.5	89.9	-180	-69.2	-89.9	0	0	0	109.4	L269 T282 Y284 V321 P361 I383 T384	L269-F367 HydrophobicContact CD2-CE2 3.78Å; L269-F367 HydrophobicContact CD2-CZ 3.66Å; T282-F367 HydrophobicContact CG2-CE2 4.33Å; T282-F367 HydrophobicContact CG2-CZ 4.18Å; Y284-F367 VanDerWaalsContact CB-O 3.32Å; Y284-F367 WeakPolarHBondContact CB-O 3.22Å; Y284-F367 WeakPolarHBondContact CD2-O 3.44Å; V321-F367 HydrophobicContact CG2-CE1 4Å; V321-F367 HydrophobicContact CG2-CZ 4.04Å; P361-F367 HydrophobicContact CB-CD2 3.98Å; P361-F367 HydrophobicContact CB-CE2 4.08Å; P361-F367 HydrophobicContact CG-CD2 4.21Å; F367-I383 HydrophobicContact CE1-CG2 4.07Å; F367-I383 HydrophobicContact CE2-CD1 3.87Å; F367-I383 HydrophobicContact CZ-CD1 3.86Å; F367-I383 HydrophobicContact CZ-CG2 4.37Å; F367-T384 VanDerWaalsContact C-OG1 3.3Å; F367-T384 VanDerWaalsContact CA-OG1 3.29Å; F367-T384 WeakPolarHBondContact CA-OG1 3.42Å; F367-T384 HydrophobicContact CD1-CG2 3.8Å; F367-T384 HydrophobicContact CE1-CG2 4.33Å
368	N	97.9	Very high	95.4	Very high	7 Å²	7	52.5 Å²	52.5	4%	0.037	28%	0.279	C	S	.	.			trans	-90.6	121.1	175.7	-51.7	-94.4	0	0	0	109.5	F365 W370 V372 T384	F365-N368 PolarHBondContact O-ND2 2.84Å; N368-W370 HydrophobicContact CB-CD2 4.16Å; N368-W370 HydrophobicContact CB-CZ2 4.18Å; N368-W370 WeakPolarHBondContact OD1-CZ2 3.23Å; N368-V372 HydrophobicContact CB-CG2 3.58Å; N368-T384 VanDerWaalsContact CB-O 3.28Å; N368-T384 WeakPolarHBondContact CB-O 3.34Å; N368-T384 PolarHBondContact N-O 2.97Å; N368-T384 PolarHBondContact N-OG1 2.87Å; N368-T384 PolarHBondContact ND2-O 3.4Å; N368-T384 PolarHBondContact O-OG1 3.04Å
369	H	95.9	Very high	95.3	Very high	53 Å²	53	52.2 Å²	52.2	25%	0.245	28%	0.277	C	S	.	.	S	Bend	trans	-86.7	5	172.1	68.6	-89	0	0	0	112.8	Y284 S316 T318 H386	Y284-H369 AromaticContact CD1-CE1 3.59Å; Y284-H369 AromaticContact CD1-ND1 3.17Å; Y284-H369 WeakPolarHBondContact CD1-ND1 3.37Å; Y284-H369 AromaticContact CD2-ND1 3.91Å; Y284-H369 AromaticContact CE1-CE1 3.19Å; Y284-H369 WeakPolarHBondContact CE1-CE1 3.3Å; Y284-H369 AromaticContact CE1-ND1 3.29Å; Y284-H369 VanDerWaalsContact CE1-ND1 3.29Å; Y284-H369 WeakPolarHBondContact CE1-ND1 3.19Å; Y284-H369 AromaticContact CE2-ND1 3.99Å; Y284-H369 AromaticContact CG-ND1 3.49Å; Y284-H369 AromaticContact CZ-CE1 3.52Å; Y284-H369 AromaticContact CZ-ND1 3.69Å; S316-H369 WeakPolarHBondContact OG-CB 3.37Å; T318-H369 HydrophobicContact CG2-CB 3.92Å; T318-H369 WeakPolarHBondContact OG1-CA 3.37Å; T318-H369 VanDerWaalsContact OG1-CB 3.23Å; T318-H369 WeakPolarHBondContact OG1-CB 3.2Å; H369-H386 PolarHBondContact O-ND1 2.97Å; H369-H386 VanDerWaalsContact O-ND1 3.08Å
370	W	97.1	Very high	95.1	Very high	89 Å²	89	52 Å²	52	34%	0.337	27%	0.273	S	S	.	.	S	Bend	trans	-120.6	170.7	175.9	60.7	88.2	0	0	0	111.2	Y284 F365 N368 V372 S385 H386	Y284-W370 HydrophobicContact CD2-CH2 4.39Å; Y284-W370 HydrophobicContact CD2-CZ3 4.13Å; Y284-W370 AromaticContact CE2-CH2 3.72Å; Y284-W370 HydrophobicContact CE2-CH2 3.72Å; Y284-W370 AromaticContact CE2-CZ3 3.55Å; Y284-W370 HydrophobicContact CE2-CZ3 3.55Å; Y284-W370 AromaticContact CZ-CZ3 3.8Å; F365-W370 HydrophobicContact CD1-CH2 4.43Å; F365-W370 HydrophobicContact CD1-CZ2 4.1Å; F365-W370 HydrophobicContact CE1-CZ2 4.33Å; N368-W370 HydrophobicContact CB-CD2 4.16Å; N368-W370 HydrophobicContact CB-CZ2 4.18Å; N368-W370 WeakPolarHBondContact OD1-CZ2 3.23Å; W370-V372 PolarHBondContact O-N 3.06Å; W370-S385 PolarHBondContact O-OG 2.94Å; W370-H386 PolarHBondContact O-N 3.24Å; W370-H386 VanDerWaalsContact O-N 3.13Å
371	R	97	Very high	95	Very high	64 Å²	64	52.8 Å²	52.8	24%	0.242	27%	0.269	C	S	.	.			trans	-72	111.5	174.1	-172.8	91.1	-171.7	85.7	-10.2	110.4	Y379 S385 H386 Q387 F388 E392	R371-Y379 PolarHBondContact NH1-OH 2.8Å; R371-S385 PolarHBondContact NH1-OG 3.28Å; R371-H386 WeakPolarHBondContact CA-O 3.31Å; R371-H386 VanDerWaalsContact CD-O 3.23Å; R371-H386 WeakPolarHBondContact CD-O 3.5Å; R371-Q387 WeakPolarHBondContact CD-O 3.33Å; R371-F388 VanDerWaalsContact CZ-CZ 3.43Å; R371-F388 VanDerWaalsContact NH2-CE1 3.27Å; R371-F388 VanDerWaalsContact NH2-CZ 3.28Å; R371-E392 IonicContact CZ-OE1 3.67Å; R371-E392 IonicContact NE-OE1 3.59Å; R371-E392 VanDerWaalsContact NH2-CD 3.33Å; R371-E392 IonicContact NH2-OE1 3.51Å; R371-E392 PolarHBondContact NH2-OE1 3.39Å; R371-E392 IonicContact NH2-OE2 3.52Å
372	V	97.1	Very high	95	Very high	17 Å²	17	52.3 Å²	52.3	10%	0.103	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-82.3	130.4	169.5	-178.7	0	0	0	0	109.2	N368 W370 Y374 K378 Y379 L382 S385	N368-V372 HydrophobicContact CB-CG2 3.58Å; W370-V372 PolarHBondContact O-N 3.06Å; V372-Y374 PolarHBondContact O-N 3Å; V372-K378 HydrophobicContact CG1-CB 4.47Å; V372-K378 HydrophobicContact CG1-CD 4.11Å; V372-Y379 HydrophobicContact CB-CE2 4.15Å; V372-Y379 HydrophobicContact CG1-CE2 4.15Å; V372-Y379 WeakPolarHBondContact O-CE2 3.29Å; V372-Y379 PolarHBondContact O-OH 3.18Å; V372-L382 HydrophobicContact CB-CD2 4.01Å; V372-L382 HydrophobicContact CG1-CD2 3.95Å; V372-L382 HydrophobicContact CG2-CD2 4.01Å; V372-S385 PolarHBondContact N-OG 3.14Å
373	S	96.3	Very high	95.2	Very high	77 Å²	77	47 Å²	47	54%	0.538	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-59.9	130.4	177.1	56.3	0	0	0	0	111.7	S375 K378	S373-S375 PolarHBondContact O-N 3.37Å; S373-K378 WeakPolarHBondContact O-CD 3.29Å; S373-K378 PolarHBondContact OG-NZ 3.42Å
374	Y	95	Very high	95.5	Very high	55 Å²	55	43.2 Å²	43.2	22%	0.216	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-71.9	131.9	-169.8	-177.8	-99.9	0	0	0	113.2	V372 Y379 Y396 H399 L400	V372-Y374 PolarHBondContact O-N 3Å; Y374-Y379 AromaticContact CD2-CD1 3.98Å; Y374-Y379 HydrophobicContact CD2-CD1 3.98Å; Y374-Y379 AromaticContact CD2-CD2 3.6Å; Y374-Y379 HydrophobicContact CD2-CD2 3.6Å; Y374-Y379 HydrophobicContact CD2-CE1 4.15Å; Y374-Y379 AromaticContact CD2-CE2 3.79Å; Y374-Y379 HydrophobicContact CD2-CE2 3.79Å; Y374-Y379 AromaticContact CD2-CG 3.71Å; Y374-Y379 HydrophobicContact CD2-CG 3.71Å; Y374-Y379 HydrophobicContact CE2-CD1 4.17Å; Y374-Y379 HydrophobicContact CE2-CD2 4.19Å; Y374-Y379 AromaticContact CE2-CG 3.89Å; Y374-Y379 HydrophobicContact CE2-CG 3.89Å; Y374-Y379 HydrophobicContact CG-CD2 4.44Å; Y374-Y379 HydrophobicContact CG-CE2 4.43Å; Y374-Y396 HydrophobicContact CD1-CD1 4.11Å; Y374-Y396 HydrophobicContact CD1-CD2 4.04Å; Y374-Y396 HydrophobicContact CD1-CE1 4.17Å; Y374-Y396 HydrophobicContact CD1-CE2 4.08Å; Y374-Y396 HydrophobicContact CD1-CG 4.07Å; Y374-Y396 HydrophobicContact CD2-CD1 4.46Å; Y374-Y396 AromaticContact CD2-CD2 3.27Å; Y374-Y396 HydrophobicContact CD2-CD2 3.27Å; Y374-Y396 AromaticContact CD2-CE2 3.91Å; Y374-Y396 HydrophobicContact CD2-CE2 3.91Å; Y374-Y396 AromaticContact CD2-CG 3.62Å; Y374-Y396 HydrophobicContact CD2-CG 3.62Å; Y374-Y396 HydrophobicContact CE1-CD1 4.17Å; Y374-Y396 HydrophobicContact CE1-CG 4.18Å; Y374-Y396 AromaticContact CE2-CD2 3.9Å; Y374-Y396 HydrophobicContact CE2-CD2 3.9Å; Y374-Y396 AromaticContact CE2-CG 3.74Å; Y374-Y396 HydrophobicContact CE2-CG 3.74Å; Y374-Y396 HydrophobicContact CG-CD1 4.25Å; Y374-Y396 AromaticContact CG-CD2 3.35Å; Y374-Y396 HydrophobicContact CG-CD2 3.35Å; Y374-Y396 HydrophobicContact CG-CE1 4.37Å; Y374-Y396 AromaticContact CG-CE2 3.48Å; Y374-Y396 HydrophobicContact CG-CE2 3.48Å; Y374-Y396 VanDerWaalsContact CG-CE2 3.48Å; Y374-Y396 AromaticContact CG-CG 3.78Å; Y374-Y396 HydrophobicContact CG-CG 3.78Å; Y374-Y396 PolarHBondContact OH-O 3.49Å; Y374-H399 AromaticContact CE1-ND1 3.48Å; Y374-H399 WeakPolarHBondContact CE1-ND1 3.44Å; Y374-H399 AromaticContact CZ-ND1 3.59Å; Y374-H399 WeakPolarHBondContact OH-CB 3.48Å; Y374-H399 PolarHBondContact OH-ND1 3.15Å; Y374-L400 PolarHBondContact OH-N 3.23Å
375	S	94.3	Very high	96	Very high	34 Å²	34	37.8 Å²	37.8	24%	0.238	19%	0.186	C	C	.	.			trans	-154.9	148.5	158.3	59.8	0	0	0	0	106.1	S373 C377 K378 Y379	S373-S375 PolarHBondContact O-N 3.37Å; S375-C377 PolarHBondContact O-N 3.09Å; S375-K378 PolarHBondContact O-N 3.04Å; S375-K378 WeakPolarHBondContact OG-CB 3.5Å; S375-K378 VanDerWaalsContact OG-CG 3.29Å; S375-K378 WeakPolarHBondContact OG-CG 3.34Å; S375-K378 PolarHBondContact OG-N 3.19Å; S375-Y379 WeakPolarHBondContact O-CD2 3.32Å; S375-Y379 PolarHBondContact O-N 3.15Å; S375-Y379 VanDerWaalsContact O-N 3.1Å
376	S	93.4	Very high	96.2	Very high	14 Å²	14	34 Å²	34	10%	0.098	17%	0.169	C	C	.	.	H	α-helix	trans	-53.9	-41.5	176.5	43.6	0	0	0	0	111.3	K378 Y379 S380 L400 A407	S376-K378 PolarHBondContact O-N 3.44Å; S376-Y379 PolarHBondContact O-N 2.87Å; S376-S380 WeakPolarHBondContact O-CB 3.3Å; S376-S380 PolarHBondContact O-N 3.21Å; S376-S380 PolarHBondContact O-OG 2.76Å; S376-L400 WeakPolarHBondContact O-CD1 3.35Å; S376-A407 PolarHBondContact OG-O 2.93Å; S376-A407 VanDerWaalsContact OG-O 3.06Å
377	C	93.4	Very high	96.2	Very high	24 Å²	24	37.4 Å²	37.4	16%	0.162	19%	0.185	C	C	.	.	H	α-helix	trans	-61.2	-45.1	178.9	-170	0	0	0	0	114.4	S375 S380 H381 A407 C408 S411	S375-C377 PolarHBondContact O-N 3.09Å; C377-S380 PolarHBondContact O-OG 2.97Å; C377-H381 PolarHBondContact O-ND1 3.35Å; C377-A407 WeakPolarHBondContact CA-O 3.35Å; C377-A407 VanDerWaalsContact CB-O 3.25Å; C377-A407 WeakPolarHBondContact CB-O 3.42Å; C377-A407 PolarHBondContact N-O 3.04Å; C377-A407 VanDerWaalsContact N-O 3.08Å; C377-C408 WeakPolarHBondContact CA-SG 3.33Å; C377-C408 HydrophobicContact CB-CB 3.92Å; C377-C408 WeakPolarHBondContact CB-SG 3.41Å; C377-C408 VanDerWaalsContact SG-CA 3.53Å; C377-C408 WeakPolarHBondContact SG-CB 3.42Å; C377-C408 CovalentContact SG-SG 2.05Å; C377-C408 PolarHBondContact SG-SG 3.34Å; C377-S411 WeakPolarHBondContact CB-OG 3.36Å
378	K	94.9	Very high	96.2	Very high	98 Å²	98	37.7 Å²	37.7	43%	0.426	19%	0.186	S	C	.	.	H	α-helix	trans	-66.4	-44	178.5	-72.3	176.9	-175.5	-177.2	0	110.7	V372 S373 S375 S376 S380 H381 L382	V372-K378 HydrophobicContact CG1-CB 4.47Å; V372-K378 HydrophobicContact CG1-CD 4.11Å; S373-K378 WeakPolarHBondContact O-CD 3.29Å; S373-K378 PolarHBondContact OG-NZ 3.42Å; S375-K378 PolarHBondContact O-N 3.04Å; S375-K378 WeakPolarHBondContact OG-CB 3.5Å; S375-K378 VanDerWaalsContact OG-CG 3.29Å; S375-K378 WeakPolarHBondContact OG-CG 3.34Å; S375-K378 PolarHBondContact OG-N 3.19Å; S376-K378 PolarHBondContact O-N 3.44Å; K378-S380 VanDerWaalsContact C-N 3.27Å; K378-S380 PolarHBondContact O-N 3.09Å; K378-H381 PolarHBondContact O-N 2.94Å; K378-L382 WeakPolarHBondContact O-CG 3.35Å; K378-L382 PolarHBondContact O-N 3.12Å
379	Y	95.6	Very high	96.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-72.8	-20.8	-175.4	-83.4	-109.7	0	0	0	113.2	F259 N261 R371 V372 Y374 S375 S376 H381 L382 S385 F388	F259-Y379 HydrophobicContact CB-CE1 4.23Å; F259-Y379 AromaticContact CD1-CD1 3.59Å; F259-Y379 HydrophobicContact CD1-CD1 3.59Å; F259-Y379 AromaticContact CD1-CE1 3.71Å; F259-Y379 HydrophobicContact CD1-CE1 3.71Å; F259-Y379 AromaticContact CD2-CD1 3.98Å; F259-Y379 HydrophobicContact CD2-CD1 3.98Å; F259-Y379 HydrophobicContact CD2-CE1 4.09Å; F259-Y379 AromaticContact CE1-CD1 3.5Å; F259-Y379 HydrophobicContact CE1-CD1 3.5Å; F259-Y379 HydrophobicContact CE1-CE1 4.13Å; F259-Y379 HydrophobicContact CE1-CG 4.47Å; F259-Y379 AromaticContact CE2-CD1 3.86Å; F259-Y379 HydrophobicContact CE2-CD1 3.86Å; F259-Y379 HydrophobicContact CE2-CE1 4.44Å; F259-Y379 AromaticContact CG-CD1 3.87Å; F259-Y379 HydrophobicContact CG-CD1 3.87Å; F259-Y379 AromaticContact CG-CE1 3.74Å; F259-Y379 HydrophobicContact CG-CE1 3.74Å; F259-Y379 AromaticContact CZ-CD1 3.67Å; F259-Y379 HydrophobicContact CZ-CD1 3.67Å; F259-Y379 HydrophobicContact CZ-CE1 4.49Å; N261-Y379 PolarHBondContact ND2-O 2.9Å; R371-Y379 PolarHBondContact NH1-OH 2.8Å; V372-Y379 HydrophobicContact CB-CE2 4.15Å; V372-Y379 HydrophobicContact CG1-CE2 4.15Å; V372-Y379 WeakPolarHBondContact O-CE2 3.29Å; V372-Y379 PolarHBondContact O-OH 3.18Å; Y374-Y379 AromaticContact CD2-CD1 3.98Å; Y374-Y379 HydrophobicContact CD2-CD1 3.98Å; Y374-Y379 AromaticContact CD2-CD2 3.6Å; Y374-Y379 HydrophobicContact CD2-CD2 3.6Å; Y374-Y379 HydrophobicContact CD2-CE1 4.15Å; Y374-Y379 AromaticContact CD2-CE2 3.79Å; Y374-Y379 HydrophobicContact CD2-CE2 3.79Å; Y374-Y379 AromaticContact CD2-CG 3.71Å; Y374-Y379 HydrophobicContact CD2-CG 3.71Å; Y374-Y379 HydrophobicContact CE2-CD1 4.17Å; Y374-Y379 HydrophobicContact CE2-CD2 4.19Å; Y374-Y379 AromaticContact CE2-CG 3.89Å; Y374-Y379 HydrophobicContact CE2-CG 3.89Å; Y374-Y379 HydrophobicContact CG-CD2 4.44Å; Y374-Y379 HydrophobicContact CG-CE2 4.43Å; S375-Y379 WeakPolarHBondContact O-CD2 3.32Å; S375-Y379 PolarHBondContact O-N 3.15Å; S375-Y379 VanDerWaalsContact O-N 3.1Å; S376-Y379 PolarHBondContact O-N 2.87Å; Y379-H381 VanDerWaalsContact C-N 3.25Å; Y379-H381 PolarHBondContact O-N 3.48Å; Y379-L382 HydrophobicContact CD1-CD1 4.39Å; Y379-L382 HydrophobicContact CD2-CD2 4.23Å; Y379-L382 HydrophobicContact CE2-CD2 4.27Å; Y379-L382 HydrophobicContact CG-CD2 4.43Å; Y379-S385 WeakPolarHBondContact OH-CB 3.21Å; Y379-S385 PolarHBondContact OH-OG 3.17Å; Y379-F388 HydrophobicContact CE1-CE2 4.18Å; Y379-F388 AromaticContact CE1-CZ 3.58Å; Y379-F388 HydrophobicContact CE1-CZ 3.58Å; Y379-F388 AromaticContact CZ-CZ 3.9Å; Y379-F388 WeakPolarHBondContact OH-CZ 3.44Å
380	S	94.3	Very high	96.3	Very high	27 Å²	27	42.5 Å²	42.5	19%	0.189	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-5.4	169.8	72.8	0	0	0	0	114.1	Y264 S376 C377 K378	Y264-S380 WeakPolarHBondContact CD2-O 3.17Å; S376-S380 WeakPolarHBondContact O-CB 3.3Å; S376-S380 PolarHBondContact O-N 3.21Å; S376-S380 PolarHBondContact O-OG 2.76Å; C377-S380 PolarHBondContact O-OG 2.97Å; K378-S380 VanDerWaalsContact C-N 3.27Å; K378-S380 PolarHBondContact O-N 3.09Å
381	H	94.1	Very high	96.4	Very high	106 Å²	106	44.8 Å²	44.8	49%	0.491	23%	0.23	S	C	.	.	S	Bend	trans	-129.7	12.1	-175	-66.8	93	0	0	0	114.4	L366 C377 K378 Y379 C408	L366-H381 WeakPolarHBondContact CD2-O 3.3Å; C377-H381 PolarHBondContact O-ND1 3.35Å; K378-H381 PolarHBondContact O-N 2.94Å; Y379-H381 VanDerWaalsContact C-N 3.25Å; Y379-H381 PolarHBondContact O-N 3.48Å; H381-C408 PolarHBondContact CE1-SG 3.46Å
382	L	96.4	Very high	96.4	Very high	6 Å²	6	44.2 Å²	44.2	3%	0.031	23%	0.23	C	C	.	.			trans	-122.6	163	171.9	60.5	77.1	0	0	0	109.8	F259 N261 V372 K378 Y379	F259-L382 HydrophobicContact CD1-CD1 4Å; F259-L382 HydrophobicContact CE1-CD1 3.99Å; N261-L382 WeakPolarHBondContact CB-O 3.38Å; V372-L382 HydrophobicContact CB-CD2 4.01Å; V372-L382 HydrophobicContact CG1-CD2 3.95Å; V372-L382 HydrophobicContact CG2-CD2 4.01Å; K378-L382 WeakPolarHBondContact O-CG 3.35Å; K378-L382 PolarHBondContact O-N 3.12Å; Y379-L382 HydrophobicContact CD1-CD1 4.39Å; Y379-L382 HydrophobicContact CD2-CD2 4.23Å; Y379-L382 HydrophobicContact CE2-CD2 4.27Å; Y379-L382 HydrophobicContact CG-CD2 4.43Å
383	I	98	Very high	96.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.226	C	C	.	.	S	Bend	trans	-96.6	-50	172.2	-63.6	173.5	0	0	0	109.7	I260 N261 Y264 L265 L269 L366 F367	I260-I383 CarbonylContact C-O 3.51Å; I260-I383 VanDerWaalsContact CA-O 3.28Å; I260-I383 WeakPolarHBondContact CA-O 3.43Å; N261-I383 PolarHBondContact N-O 3.07Å; Y264-I383 HydrophobicContact CD1-CD1 4.35Å; Y264-I383 HydrophobicContact CD1-CG1 3.74Å; Y264-I383 HydrophobicContact CE1-CG1 4.28Å; L265-I383 HydrophobicContact CB-CG2 4.09Å; L265-I383 HydrophobicContact CD1-CD1 4.21Å; L265-I383 HydrophobicContact CD1-CG2 4.38Å; L269-I383 HydrophobicContact CB-CD1 4.02Å; L269-I383 HydrophobicContact CD2-CD1 3.6Å; L269-I383 HydrophobicContact CG-CD1 4.35Å; L366-I383 HydrophobicContact CB-CD1 4.08Å; L366-I383 HydrophobicContact CB-CG1 4.22Å; L366-I383 HydrophobicContact CD1-CD1 4.36Å; L366-I383 WeakPolarHBondContact O-CA 3.19Å; L366-I383 WeakPolarHBondContact O-CB 3.42Å; L366-I383 PolarHBondContact O-N 2.68Å; F367-I383 HydrophobicContact CE1-CG2 4.07Å; F367-I383 HydrophobicContact CE2-CD1 3.87Å; F367-I383 HydrophobicContact CZ-CD1 3.86Å; F367-I383 HydrophobicContact CZ-CG2 4.37Å
384	T	98.2	Very high	96.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	146.6	-175.8	74.6	0	0	0	0	113.1	M252 M258 F259 I260 L366 F367 N368	M252-T384 HydrophobicContact CE-CG2 3.85Å; M258-T384 HydrophobicContact CE-CG2 4.46Å; F259-T384 WeakPolarHBondContact O-CA 3.38Å; I260-T384 HydrophobicContact CD1-CG2 3.8Å; L366-T384 PolarHBondContact O-N 3.28Å; F367-T384 VanDerWaalsContact C-OG1 3.3Å; F367-T384 VanDerWaalsContact CA-OG1 3.29Å; F367-T384 WeakPolarHBondContact CA-OG1 3.42Å; F367-T384 HydrophobicContact CD1-CG2 3.8Å; F367-T384 HydrophobicContact CE1-CG2 4.33Å; N368-T384 VanDerWaalsContact CB-O 3.28Å; N368-T384 WeakPolarHBondContact CB-O 3.34Å; N368-T384 PolarHBondContact N-O 2.97Å; N368-T384 PolarHBondContact N-OG1 2.87Å; N368-T384 PolarHBondContact ND2-O 3.4Å; N368-T384 PolarHBondContact O-OG1 3.04Å
385	S	98.4	Very high	96.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	138.9	159.6	174.1	0	0	0	0	109.1	F259 W370 R371 V372 Y379	F259-S385 PolarHBondContact N-O 3.13Å; F259-S385 PolarHBondContact O-N 3.46Å; F259-S385 VanDerWaalsContact O-N 3.08Å; W370-S385 PolarHBondContact O-OG 2.94Å; R371-S385 PolarHBondContact NH1-OG 3.28Å; V372-S385 PolarHBondContact N-OG 3.14Å; Y379-S385 WeakPolarHBondContact OH-CB 3.21Å; Y379-S385 PolarHBondContact OH-OG 3.17Å
386	H	98	Very high	96.8	Very high	33 Å²	33	46.9 Å²	46.9	15%	0.153	23%	0.228	C	C	.	.			trans	-97.3	167.7	-172	-178.6	-143.3	0	0	0	112.9	D257 M258 T318 H369 W370 R371	D257-H386 IonicContact OD1-CD2 3.19Å; D257-H386 IonicContact OD1-NE2 2.73Å; D257-H386 IonicContact OD2-CD2 2.85Å; D257-H386 IonicContact OD2-NE2 2.9Å; D257-H386 PolarHBondContact OD2-NE2 2.86Å; M258-H386 HydrophobicContact CE-CB 3.96Å; M258-H386 WeakPolarHBondContact SD-CA 3.14Å; M258-H386 HydrophobicContact SD-CB 3.55Å; M258-H386 VanDerWaalsContact SD-CB 3.55Å; M258-H386 PolarHBondContact SD-CD2 3.47Å; T318-H386 HydrophobicContact CG2-CB 4.42Å; H369-H386 PolarHBondContact O-ND1 2.97Å; H369-H386 VanDerWaalsContact O-ND1 3.08Å; W370-H386 PolarHBondContact O-N 3.24Å; W370-H386 VanDerWaalsContact O-N 3.13Å; R371-H386 WeakPolarHBondContact CA-O 3.31Å; R371-H386 VanDerWaalsContact CD-O 3.23Å; R371-H386 WeakPolarHBondContact CD-O 3.5Å
387	Q	96.7	Very high	97	Very high	81 Å²	81	46.7 Å²	46.7	38%	0.379	23%	0.225	S	C	.	.			trans	69.5	54	173.2	-54.8	179.4	-30.2	0	0	114.9	D257 R371	D257-Q387 PolarHBondContact O-N 2.95Å; R371-Q387 WeakPolarHBondContact CD-O 3.33Å
388	F	97.9	Very high	97.1	Very high	6 Å²	6	49.3 Å²	49.3	3%	0.026	24%	0.237	C	C	.	.			trans	-100.5	131.6	176.1	-84.3	-95.5	0	0	0	112.8	D257 F259 R371 Y379 E392 L393 Y396	D257-F388 PolarHBondContact O-N 2.91Å; F259-F388 HydrophobicContact CB-CD1 4.5Å; F259-F388 HydrophobicContact CB-CD2 3.65Å; F259-F388 HydrophobicContact CB-CE1 4.17Å; F259-F388 HydrophobicContact CB-CE2 3.27Å; F259-F388 HydrophobicContact CB-CG 4.24Å; F259-F388 HydrophobicContact CB-CZ 3.55Å; F259-F388 HydrophobicContact CD2-CZ 4.37Å; F259-F388 HydrophobicContact CG-CE2 4.3Å; F259-F388 HydrophobicContact CG-CZ 4.17Å; R371-F388 VanDerWaalsContact CZ-CZ 3.43Å; R371-F388 VanDerWaalsContact NH2-CE1 3.27Å; R371-F388 VanDerWaalsContact NH2-CZ 3.28Å; Y379-F388 HydrophobicContact CE1-CE2 4.18Å; Y379-F388 AromaticContact CE1-CZ 3.58Å; Y379-F388 HydrophobicContact CE1-CZ 3.58Å; Y379-F388 AromaticContact CZ-CZ 3.9Å; Y379-F388 WeakPolarHBondContact OH-CZ 3.44Å; F388-E392 HydrophobicContact CD1-CG 4.26Å; F388-E392 HydrophobicContact CE1-CG 4.43Å; F388-L393 HydrophobicContact CB-CB 4.34Å; F388-L393 HydrophobicContact CB-CD1 4.43Å; F388-L393 HydrophobicContact CD1-CB 4.15Å; F388-L393 HydrophobicContact CD1-CD1 4.02Å; F388-L393 HydrophobicContact CG-CD1 4.23Å; F388-Y396 AromaticContact CE1-CD2 3.62Å; F388-Y396 HydrophobicContact CE1-CD2 3.62Å; F388-Y396 HydrophobicContact CE1-CE2 4.36Å; F388-Y396 HydrophobicContact CE1-CG 4.34Å; F388-Y396 HydrophobicContact CZ-CD2 4.18Å
389	Q	98.1	Very high	97.1	Very high	136 Å²	136	48.6 Å²	48.6	64%	0.636	24%	0.235	S	C	*	.			trans	-82.2	150.7	163.3	-64.8	-60.8	-35.7	0	0	110.4	N391 E392 L393	Q389-N391 PolarHBondContact O-N 3.07Å; Q389-E392 HydrophobicContact CB-CB 4.4Å; Q389-E392 WeakPolarHBondContact O-CB 3.39Å; Q389-E392 PolarHBondContact O-N 3.3Å; Q389-E392 VanDerWaalsContact O-N 3.07Å; Q389-L393 PolarHBondContact O-N 3.41Å
390	P	98.4	Very high	97	Very high	26 Å²	26	48.8 Å²	48.8	17%	0.169	24%	0.236	C	C	.	.	H	α-helix	trans	-53.2	-47.6	-175.1	-28.9	35.7	0	0	0	114.2	D168 A169 A172 E392 L393 I394	D168-P390 HydrophobicContact CB-CB 4.27Å; D168-P390 HydrophobicContact CB-CG 4.05Å; A169-P390 HydrophobicContact CB-CG 4.21Å; A172-P390 HydrophobicContact CB-CB 3.75Å; P390-E392 VanDerWaalsContact C-N 3.34Å; P390-E392 PolarHBondContact O-N 3.28Å; P390-L393 WeakPolarHBondContact O-CB 3.34Å; P390-L393 PolarHBondContact O-N 3.37Å; P390-I394 WeakPolarHBondContact O-CG1 3.23Å; P390-I394 PolarHBondContact O-N 2.99Å; P390-I394 VanDerWaalsContact O-N 3.1Å
391	N	98.2	Very high	96.9	Very high	136 Å²	136	50.5 Å²	50.5	73%	0.727	24%	0.241	S	C	*	.	H	α-helix	trans	-66.6	-35.9	-179.8	-67.4	-20.1	0	0	0	112.7	Q389 K395	Q389-N391 PolarHBondContact O-N 3.07Å; N391-K395 WeakPolarHBondContact O-CB 3.44Å; N391-K395 PolarHBondContact O-N 3.31Å; N391-K395 VanDerWaalsContact O-N 3.1Å
392	E	97.4	Very high	96.8	Very high	52 Å²	52	50.9 Å²	50.9	24%	0.243	25%	0.251	C	S	.	.	H	α-helix	trans	-68.8	-41.1	176.7	-172.4	-176.6	-168.9	0	0	110.8	R371 F388 Q389 P390 K395 Y396	R371-E392 IonicContact CZ-OE1 3.67Å; R371-E392 IonicContact NE-OE1 3.59Å; R371-E392 VanDerWaalsContact NH2-CD 3.33Å; R371-E392 IonicContact NH2-OE1 3.51Å; R371-E392 PolarHBondContact NH2-OE1 3.39Å; R371-E392 IonicContact NH2-OE2 3.52Å; F388-E392 HydrophobicContact CD1-CG 4.26Å; F388-E392 HydrophobicContact CE1-CG 4.43Å; Q389-E392 HydrophobicContact CB-CB 4.4Å; Q389-E392 WeakPolarHBondContact O-CB 3.39Å; Q389-E392 PolarHBondContact O-N 3.3Å; Q389-E392 VanDerWaalsContact O-N 3.07Å; P390-E392 VanDerWaalsContact C-N 3.34Å; P390-E392 PolarHBondContact O-N 3.28Å; E392-K395 PolarHBondContact O-N 2.66Å; E392-Y396 HydrophobicContact CG-CD1 4.38Å; E392-Y396 HydrophobicContact CG-CD2 4.09Å; E392-Y396 HydrophobicContact CG-CE1 4.12Å; E392-Y396 HydrophobicContact CG-CE2 3.83Å; E392-Y396 HydrophobicContact CG-CG 4.35Å; E392-Y396 WeakPolarHBondContact O-CB 3.47Å; E392-Y396 PolarHBondContact O-N 3.16Å; E392-Y396 VanDerWaalsContact OE1-CE2 3.3Å; E392-Y396 WeakPolarHBondContact OE1-CE2 3.43Å; E392-Y396 PolarHBondContact OE1-OH 2.98Å
393	L	98.5	Very high	96.4	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-57.5	-51.8	176.5	-177.3	62.9	0	0	0	111.1	A172 I173 T176 F259 F388 Q389 P390 K395 Y396 W397	A172-L393 HydrophobicContact CB-CD2 4.29Å; I173-L393 HydrophobicContact CG1-CD2 3.99Å; T176-L393 HydrophobicContact CG2-CG 4.42Å; F259-L393 HydrophobicContact CB-CD1 4.02Å; F259-L393 HydrophobicContact CD2-CD1 3.92Å; F259-L393 HydrophobicContact CG-CD1 4.44Å; F388-L393 HydrophobicContact CB-CB 4.34Å; F388-L393 HydrophobicContact CB-CD1 4.43Å; F388-L393 HydrophobicContact CD1-CB 4.15Å; F388-L393 HydrophobicContact CD1-CD1 4.02Å; F388-L393 HydrophobicContact CG-CD1 4.23Å; Q389-L393 PolarHBondContact O-N 3.41Å; P390-L393 WeakPolarHBondContact O-CB 3.34Å; P390-L393 PolarHBondContact O-N 3.37Å; L393-K395 PolarHBondContact O-N 2.97Å; L393-Y396 PolarHBondContact O-N 3.45Å; L393-W397 WeakPolarHBondContact O-CB 3.27Å; L393-W397 PolarHBondContact O-N 3.08Å
394	I	98.4	Very high	95.5	Very high	38 Å²	38	56.8 Å²	56.8	20%	0.195	28%	0.279	C	S	.	.	H	α-helix	trans	-58.1	-48.7	177.6	-65.3	166.6	0	0	0	110.7	A172 T176 P390 Y396 W397 N398	A172-I394 HydrophobicContact CB-CD1 3.82Å; A172-I394 HydrophobicContact CB-CG1 3.85Å; T176-I394 HydrophobicContact CG2-CB 4.33Å; T176-I394 HydrophobicContact CG2-CG1 3.95Å; P390-I394 WeakPolarHBondContact O-CG1 3.23Å; P390-I394 PolarHBondContact O-N 2.99Å; P390-I394 VanDerWaalsContact O-N 3.1Å; I394-Y396 PolarHBondContact O-N 3.49Å; I394-W397 PolarHBondContact O-N 3.29Å; I394-N398 WeakPolarHBondContact O-CB 3.49Å; I394-N398 VanDerWaalsContact O-CG 3.22Å; I394-N398 PolarHBondContact O-N 3.38Å; I394-N398 PolarHBondContact O-ND2 2.86Å
395	K	97.6	Very high	94.7	Very high	147 Å²	147	65.2 Å²	65.2	64%	0.639	32%	0.318	S	S	*	.	H	α-helix	trans	-57.8	-49	179.9	-177	-177	178.6	176.7	0	111.9	N391 E392 L393 H399	N391-K395 WeakPolarHBondContact O-CB 3.44Å; N391-K395 PolarHBondContact O-N 3.31Å; N391-K395 VanDerWaalsContact O-N 3.1Å; E392-K395 PolarHBondContact O-N 2.66Å; L393-K395 PolarHBondContact O-N 2.97Å; K395-H399 WeakPolarHBondContact O-CB 3.21Å; K395-H399 PolarHBondContact O-N 2.86Å
396	Y	96.9	Very high	94.1	Very high	51 Å²	51	69.9 Å²	69.9	20%	0.2	34%	0.343	C	S	.	.	H	α-helix	trans	-75.3	-34.4	-173.8	-74.9	11.4	0	0	0	112.1	Y374 F388 E392 L393 I394 L400	Y374-Y396 HydrophobicContact CD1-CD1 4.11Å; Y374-Y396 HydrophobicContact CD1-CD2 4.04Å; Y374-Y396 HydrophobicContact CD1-CE1 4.17Å; Y374-Y396 HydrophobicContact CD1-CE2 4.08Å; Y374-Y396 HydrophobicContact CD1-CG 4.07Å; Y374-Y396 HydrophobicContact CD2-CD1 4.46Å; Y374-Y396 AromaticContact CD2-CD2 3.27Å; Y374-Y396 HydrophobicContact CD2-CD2 3.27Å; Y374-Y396 AromaticContact CD2-CE2 3.91Å; Y374-Y396 HydrophobicContact CD2-CE2 3.91Å; Y374-Y396 AromaticContact CD2-CG 3.62Å; Y374-Y396 HydrophobicContact CD2-CG 3.62Å; Y374-Y396 HydrophobicContact CE1-CD1 4.17Å; Y374-Y396 HydrophobicContact CE1-CG 4.18Å; Y374-Y396 AromaticContact CE2-CD2 3.9Å; Y374-Y396 HydrophobicContact CE2-CD2 3.9Å; Y374-Y396 AromaticContact CE2-CG 3.74Å; Y374-Y396 HydrophobicContact CE2-CG 3.74Å; Y374-Y396 HydrophobicContact CG-CD1 4.25Å; Y374-Y396 AromaticContact CG-CD2 3.35Å; Y374-Y396 HydrophobicContact CG-CD2 3.35Å; Y374-Y396 HydrophobicContact CG-CE1 4.37Å; Y374-Y396 AromaticContact CG-CE2 3.48Å; Y374-Y396 HydrophobicContact CG-CE2 3.48Å; Y374-Y396 VanDerWaalsContact CG-CE2 3.48Å; Y374-Y396 AromaticContact CG-CG 3.78Å; Y374-Y396 HydrophobicContact CG-CG 3.78Å; Y374-Y396 PolarHBondContact OH-O 3.49Å; F388-Y396 AromaticContact CE1-CD2 3.62Å; F388-Y396 HydrophobicContact CE1-CD2 3.62Å; F388-Y396 HydrophobicContact CE1-CE2 4.36Å; F388-Y396 HydrophobicContact CE1-CG 4.34Å; F388-Y396 HydrophobicContact CZ-CD2 4.18Å; E392-Y396 HydrophobicContact CG-CD1 4.38Å; E392-Y396 HydrophobicContact CG-CD2 4.09Å; E392-Y396 HydrophobicContact CG-CE1 4.12Å; E392-Y396 HydrophobicContact CG-CE2 3.83Å; E392-Y396 HydrophobicContact CG-CG 4.35Å; E392-Y396 WeakPolarHBondContact O-CB 3.47Å; E392-Y396 PolarHBondContact O-N 3.16Å; E392-Y396 VanDerWaalsContact OE1-CE2 3.3Å; E392-Y396 WeakPolarHBondContact OE1-CE2 3.43Å; E392-Y396 PolarHBondContact OE1-OH 2.98Å; L393-Y396 PolarHBondContact O-N 3.45Å; I394-Y396 PolarHBondContact O-N 3.49Å; Y396-L400 WeakPolarHBondContact O-CB 3.38Å; Y396-L400 PolarHBondContact O-N 2.87Å
397	W	96.8	Very high	93.3	Very high	10 Å²	10	68.6 Å²	68.6	4%	0.038	34%	0.338	C	S	.	.	H	α-helix	trans	-61.4	-53.8	171.2	-177.5	-99.7	0	0	0	111	T176 W177 V182 F259 I260 L393 I394 H399 L400 Q401	T176-W397 VanDerWaalsContact CB-CG 3.46Å; T176-W397 HydrophobicContact CG2-CB 3.58Å; T176-W397 HydrophobicContact CG2-CG 3.66Å; W177-W397 HydrophobicContact CB-CE3 3.94Å; W177-W397 HydrophobicContact CB-CH2 3.84Å; W177-W397 HydrophobicContact CB-CZ2 4.47Å; W177-W397 HydrophobicContact CB-CZ3 3.54Å; V182-W397 HydrophobicContact CG1-CH2 4.07Å; V182-W397 HydrophobicContact CG1-CZ2 3.99Å; V182-W397 HydrophobicContact CG2-CZ2 3.82Å; F259-W397 HydrophobicContact CD2-CE3 4.45Å; F259-W397 AromaticContact CE2-CE3 3.6Å; F259-W397 HydrophobicContact CE2-CE3 3.6Å; F259-W397 HydrophobicContact CE2-CZ3 4.16Å; F259-W397 AromaticContact CZ-CE3 3.96Å; F259-W397 HydrophobicContact CZ-CE3 3.96Å; F259-W397 HydrophobicContact CZ-CZ3 4.05Å; I260-W397 WeakPolarHBondContact O-CZ3 3.32Å; L393-W397 WeakPolarHBondContact O-CB 3.27Å; L393-W397 PolarHBondContact O-N 3.08Å; I394-W397 PolarHBondContact O-N 3.29Å; W397-H399 VanDerWaalsContact C-N 3.31Å; W397-H399 PolarHBondContact O-N 3.31Å; W397-L400 WeakPolarHBondContact O-CA 3.39Å; W397-L400 WeakPolarHBondContact O-CB 3.16Å; W397-L400 PolarHBondContact O-N 3.49Å; W397-Q401 HydrophobicContact CD2-CG 4.3Å; W397-Q401 HydrophobicContact CG-CG 4.4Å; W397-Q401 HydrophobicContact CZ2-CG 4.22Å; W397-Q401 WeakPolarHBondContact O-CG 3.39Å; W397-Q401 PolarHBondContact O-N 2.9Å
398	N	95.8	Very high	92.8	Very high	79 Å²	79	66.8 Å²	66.8	42%	0.422	33%	0.334	S	S	.	.	H	α-helix	trans	-60.7	-41.5	-178.9	-70.1	-14.6	0	0	0	111.9	I394 L400 Q401 T402	I394-N398 WeakPolarHBondContact O-CB 3.49Å; I394-N398 VanDerWaalsContact O-CG 3.22Å; I394-N398 PolarHBondContact O-N 3.38Å; I394-N398 PolarHBondContact O-ND2 2.86Å; N398-L400 VanDerWaalsContact C-N 3.32Å; N398-L400 PolarHBondContact O-N 2.74Å; N398-Q401 PolarHBondContact O-N 3.44Å; N398-T402 WeakPolarHBondContact O-CG2 3.35Å; N398-T402 PolarHBondContact O-N 3.33Å; N398-T402 PolarHBondContact O-OG1 2.92Å
399	H	95.3	Very high	91.8	Very high	82 Å²	82	69.7 Å²	69.7	38%	0.38	35%	0.352	S	S	.	.	H	α-helix	trans	-66.3	-32.3	175.4	179.9	-92.7	0	0	0	113	Y374 K395 W397 T402 N403	Y374-H399 AromaticContact CE1-ND1 3.48Å; Y374-H399 WeakPolarHBondContact CE1-ND1 3.44Å; Y374-H399 AromaticContact CZ-ND1 3.59Å; Y374-H399 WeakPolarHBondContact OH-CB 3.48Å; Y374-H399 PolarHBondContact OH-ND1 3.15Å; K395-H399 WeakPolarHBondContact O-CB 3.21Å; K395-H399 PolarHBondContact O-N 2.86Å; W397-H399 VanDerWaalsContact C-N 3.31Å; W397-H399 PolarHBondContact O-N 3.31Å; H399-T402 PolarHBondContact O-OG1 3.22Å; H399-N403 PolarHBondContact CD2-ND2 3.04Å; H399-N403 VanDerWaalsContact CD2-ND2 3.28Å; H399-N403 PolarHBondContact CE1-ND2 3.18Å; H399-N403 PolarHBondContact NE2-ND2 3.27Å; H399-N403 WeakPolarHBondContact O-CB 3.43Å; H399-N403 PolarHBondContact O-N 2.89Å; H399-N403 PolarHBondContact O-ND2 3.25Å
400	L	94.5	Very high	90.1	Very high	5 Å²	5	67.8 Å²	67.8	3%	0.026	35%	0.346	C	S	.	.	H	α-helix	trans	-69.5	-46.2	173.8	177.2	66.1	0	0	0	111	F259 Y374 S376 Y396 W397 N398 N403 K404	F259-L400 HydrophobicContact CE2-CD2 4.29Å; F259-L400 HydrophobicContact CZ-CD2 3.65Å; Y374-L400 PolarHBondContact OH-N 3.23Å; S376-L400 WeakPolarHBondContact O-CD1 3.35Å; Y396-L400 WeakPolarHBondContact O-CB 3.38Å; Y396-L400 PolarHBondContact O-N 2.87Å; W397-L400 WeakPolarHBondContact O-CA 3.39Å; W397-L400 WeakPolarHBondContact O-CB 3.16Å; W397-L400 PolarHBondContact O-N 3.49Å; N398-L400 VanDerWaalsContact C-N 3.32Å; N398-L400 PolarHBondContact O-N 2.74Å; L400-N403 CarbonylContact O-C 3.49Å; L400-N403 PolarHBondContact O-N 3.15Å; L400-K404 WeakPolarHBondContact O-CA 3.44Å; L400-K404 PolarHBondContact O-N 3.35Å
401	Q	92.1	Very high	88.3	Confident	62 Å²	62	68.1 Å²	68.1	29%	0.29	35%	0.349	S	S	.	.	H	α-helix	trans	-64.4	-42.1	-178.5	-65.1	-53.2	-35.4	0	0	111.8	W397 N398 N403 K404	W397-Q401 HydrophobicContact CD2-CG 4.3Å; W397-Q401 HydrophobicContact CG-CG 4.4Å; W397-Q401 HydrophobicContact CZ2-CG 4.22Å; W397-Q401 WeakPolarHBondContact O-CG 3.39Å; W397-Q401 PolarHBondContact O-N 2.9Å; N398-Q401 PolarHBondContact O-N 3.44Å; Q401-N403 VanDerWaalsContact C-N 3.32Å; Q401-N403 PolarHBondContact O-N 3.43Å; Q401-K404 WeakPolarHBondContact O-CB 3.47Å; Q401-K404 PolarHBondContact O-N 2.95Å
402	T	91	Very high	86.4	Confident	114 Å²	114	64 Å²	64	70%	0.699	33%	0.334	S	S	*	.	H	α-helix	trans	-68	-29.9	176.9	53.2	0	0	0	0	113.3	N398 H399	N398-T402 WeakPolarHBondContact O-CG2 3.35Å; N398-T402 PolarHBondContact O-N 3.33Å; N398-T402 PolarHBondContact O-OG1 2.92Å; H399-T402 PolarHBondContact O-OG1 3.22Å
403	N	87.5	Confident	84.5	Confident	47 Å²	47	68.4 Å²	68.4	25%	0.251	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	12.3	-179.5	-70.8	-64.7	0	0	0	114.2	H399 L400 Q401 H405 N406 A407	H399-N403 PolarHBondContact CD2-ND2 3.04Å; H399-N403 VanDerWaalsContact CD2-ND2 3.28Å; H399-N403 PolarHBondContact CE1-ND2 3.18Å; H399-N403 PolarHBondContact NE2-ND2 3.27Å; H399-N403 WeakPolarHBondContact O-CB 3.43Å; H399-N403 PolarHBondContact O-N 2.89Å; H399-N403 PolarHBondContact O-ND2 3.25Å; L400-N403 CarbonylContact O-C 3.49Å; L400-N403 PolarHBondContact O-N 3.15Å; Q401-N403 VanDerWaalsContact C-N 3.32Å; Q401-N403 PolarHBondContact O-N 3.43Å; N403-H405 VanDerWaalsContact C-N 3.28Å; N403-H405 PolarHBondContact O-N 3.4Å; N403-H405 VanDerWaalsContact O-N 3.14Å; N403-N406 CarbonylContact O-C 3.49Å; N403-N406 PolarHBondContact O-N 2.95Å; N403-A407 WeakPolarHBondContact O-CA 3.34Å; N403-A407 PolarHBondContact O-N 2.94Å
404	K	80	Confident	82.6	Confident	84 Å²	84	74.4 Å²	74.4	37%	0.365	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-52.5	-42.7	-169	-172.4	174.9	170.8	-178.7	0	113.7	E263 L400 Q401	E263-K404 WeakPolarHBondContact OE1-CE 3.34Å; E263-K404 IonicContact OE1-NZ 2.6Å; E263-K404 PolarHBondContact OE1-NZ 2.92Å; E263-K404 WeakPolarHBondContact OE2-CE 3.35Å; E263-K404 IonicContact OE2-NZ 3.36Å; E263-K404 PolarHBondContact OE2-NZ 2.97Å; L400-K404 WeakPolarHBondContact O-CA 3.44Å; L400-K404 PolarHBondContact O-N 3.35Å; Q401-K404 WeakPolarHBondContact O-CB 3.47Å; Q401-K404 PolarHBondContact O-N 2.95Å
405	H	81.1	Confident	80.7	Confident	177 Å²	177	79.7 Å²	79.7	82%	0.819	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-76.3	-19.3	179.2	-60.1	-65.6	0	0	0	114.4	N403	N403-H405 VanDerWaalsContact C-N 3.28Å; N403-H405 PolarHBondContact O-N 3.4Å; N403-H405 VanDerWaalsContact O-N 3.14Å
406	N	85.3	Confident	78.6	Confident	97 Å²	97	78 Å²	78	52%	0.519	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-116.6	10.3	-175.9	-68.6	-42.4	0	0	0	113.2	N403 C408 V409	N403-N406 CarbonylContact O-C 3.49Å; N403-N406 PolarHBondContact O-N 2.95Å; N406-C408 PolarHBondContact O-N 3.43Å; N406-V409 HydrophobicContact CB-CG2 4.21Å; N406-V409 PolarHBondContact O-N 2.96Å
407	A	82.4	Confident	76.6	Confident	6 Å²	6	77.5 Å²	77.5	5%	0.05	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-37.1	-166.2	0	0	0	0	0	113.2	S376 C377 N403	S376-A407 PolarHBondContact OG-O 2.93Å; S376-A407 VanDerWaalsContact OG-O 3.06Å; C377-A407 WeakPolarHBondContact CA-O 3.35Å; C377-A407 VanDerWaalsContact CB-O 3.25Å; C377-A407 WeakPolarHBondContact CB-O 3.42Å; C377-A407 PolarHBondContact N-O 3.04Å; C377-A407 VanDerWaalsContact N-O 3.08Å; N403-A407 WeakPolarHBondContact O-CA 3.34Å; N403-A407 PolarHBondContact O-N 2.94Å
408	C	85.2	Confident	74.7	Confident	44 Å²	44	86.2 Å²	86.2	30%	0.297	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-2	-178.3	-66.1	0	0	0	0	115.7	C377 H381 N406 N410 S411 A412	C377-C408 WeakPolarHBondContact CA-SG 3.33Å; C377-C408 HydrophobicContact CB-CB 3.92Å; C377-C408 WeakPolarHBondContact CB-SG 3.41Å; C377-C408 VanDerWaalsContact SG-CA 3.53Å; C377-C408 WeakPolarHBondContact SG-CB 3.42Å; C377-C408 CovalentContact SG-SG 2.05Å; C377-C408 PolarHBondContact SG-SG 3.34Å; H381-C408 PolarHBondContact CE1-SG 3.46Å; N406-C408 PolarHBondContact O-N 3.43Å; C408-N410 VanDerWaalsContact C-N 3.33Å; C408-N410 PolarHBondContact O-N 3.43Å; C408-S411 PolarHBondContact O-N 2.98Å; C408-A412 PolarHBondContact O-N 3.01Å
409	V	77.1	Confident	72.6	Confident	66 Å²	66	89 Å²	89	40%	0.4	45%	0.453	S	S	.	.	H	α-helix	trans	-64.4	-39.8	-176.4	176.9	0	0	0	0	111.2	N406 A412 K413	N406-V409 HydrophobicContact CB-CG2 4.21Å; N406-V409 PolarHBondContact O-N 2.96Å; V409-A412 PolarHBondContact O-N 3.41Å; V409-K413 PolarHBondContact O-N 3.01Å
410	N	62.2	Low	70.5	Confident	97 Å²	97	94.3 Å²	94.3	52%	0.519	47%	0.47	S	S	.	.	H	α-helix	trans	-73.6	-32.5	179.3	-67	-24.7	0	0	0	112.6	C408 A412 K413 E414	C408-N410 VanDerWaalsContact C-N 3.33Å; C408-N410 PolarHBondContact O-N 3.43Å; N410-A412 VanDerWaalsContact C-N 3.31Å; N410-A412 PolarHBondContact O-N 2.98Å; N410-K413 PolarHBondContact O-N 3.5Å; N410-E414 PolarHBondContact O-N 3.37Å
411	S	60.4	Low	68.4	Low	33 Å²	33	100 Å²	100	23%	0.231	50%	0.496	C	S	.	.	H	α-helix	trans	-67.6	-30.9	176.2	-57.1	0	0	0	0	112.7	C377 C408 K415	C377-S411 WeakPolarHBondContact CB-OG 3.36Å; C408-S411 PolarHBondContact O-N 2.98Å; S411-K415 WeakPolarHBondContact O-CG 3.41Å; S411-K415 PolarHBondContact O-N 3.04Å; S411-K415 VanDerWaalsContact O-N 3.16Å
412	A	58.8	Low	66.5	Low	50 Å²	50	107 Å²	107	41%	0.413	52%	0.519	S	S	.	.	H	α-helix	trans	-69.1	-40.6	172.2	0	0	0	0	0	111.9	C408 V409 N410 K415 N416	C408-A412 PolarHBondContact O-N 3.01Å; V409-A412 PolarHBondContact O-N 3.41Å; N410-A412 VanDerWaalsContact C-N 3.31Å; N410-A412 PolarHBondContact O-N 2.98Å; A412-K415 PolarHBondContact O-N 3.35Å; A412-N416 WeakPolarHBondContact O-CB 3.44Å; A412-N416 PolarHBondContact O-N 2.99Å
413	K	57.1	Low	64.6	Low	144 Å²	144	109.6 Å²	109.6	63%	0.626	52%	0.521	S	S	*	.	H	α-helix	trans	-63.5	-41.9	175.9	-70.8	-179.7	179.5	177.5	0	112.3	V409 N410 N416 G417	V409-K413 PolarHBondContact O-N 3.01Å; N410-K413 PolarHBondContact O-N 3.5Å; K413-N416 PolarHBondContact O-N 3.07Å; K413-G417 PolarHBondContact O-N 3.34Å
414	E	58.5	Low	62.9	Low	130 Å²	130	113.8 Å²	113.8	61%	0.607	54%	0.543	S	S	*	.	H	α-helix	trans	-65	-41.9	175.5	-75.2	-176.8	170.1	0	0	112.9	N410 G417 R418	N410-E414 PolarHBondContact O-N 3.37Å; E414-G417 PolarHBondContact O-N 2.92Å; E414-R418 WeakPolarHBondContact O-CG 3.43Å; E414-R418 PolarHBondContact O-N 3.04Å
415	K	58.5	Low	61.7	Low	148 Å²	148	117.1 Å²	117.1	64%	0.643	56%	0.559	S	S	*	*	H	α-helix	trans	-63.6	-41.4	175.6	-78.6	-178	177.2	-178.2	0	111.9	S411 A412 R418 H419	S411-K415 WeakPolarHBondContact O-CG 3.41Å; S411-K415 PolarHBondContact O-N 3.04Å; S411-K415 VanDerWaalsContact O-N 3.16Å; A412-K415 PolarHBondContact O-N 3.35Å; K415-R418 PolarHBondContact O-N 3.31Å; K415-H419 PolarHBondContact O-N 3.42Å; K415-H419 PolarHBondContact O-ND1 2.89Å
416	N	53.7	Low	60.2	Low	113 Å²	113	111.2 Å²	111.2	60%	0.604	55%	0.547	S	S	*	.	H	α-helix	trans	-68.5	-38.9	176.5	-74.5	-9.4	0	0	0	112	A412 K413 H419 R420	A412-N416 WeakPolarHBondContact O-CB 3.44Å; A412-N416 PolarHBondContact O-N 2.99Å; K413-N416 PolarHBondContact O-N 3.07Å; N416-H419 PolarHBondContact O-N 3.09Å; N416-R420 WeakPolarHBondContact O-CB 3.35Å; N416-R420 PolarHBondContact O-N 3.43Å
417	G	54.9	Low	58.3	Low	39 Å²	39	115.1 Å²	115.1	40%	0.402	56%	0.562	S	S	.	*	H	α-helix	trans	-61.5	-44.3	173.4	0	0	0	0	0	112.6	K413 E414 R420 H421	K413-G417 PolarHBondContact O-N 3.34Å; E414-G417 PolarHBondContact O-N 2.92Å; G417-R420 PolarHBondContact O-N 3.4Å; G417-H421 PolarHBondContact O-N 2.92Å
418	R	56.5	Low	56.7	Low	193 Å²	193	126.3 Å²	126.3	73%	0.728	60%	0.603	S	S	*	*	H	α-helix	trans	-65.2	-38.8	175.1	-74.9	-177.4	-176.8	-178.6	2.8	113	E414 K415 R420 H421 R422	E414-R418 WeakPolarHBondContact O-CG 3.43Å; E414-R418 PolarHBondContact O-N 3.04Å; K415-R418 PolarHBondContact O-N 3.31Å; R418-R420 VanDerWaalsContact C-N 3.35Å; R418-H421 PolarHBondContact O-N 3.28Å; R418-R422 WeakPolarHBondContact O-CB 3.19Å; R418-R422 PolarHBondContact O-N 3.47Å
419	H	53.1	Low	54.3	Low	138 Å²	138	132 Å²	132	64%	0.639	63%	0.629	S	S	*	*	H	α-helix	trans	-64.3	-40	174.2	-84.4	66.5	0	0	0	112	K415 N416 R422 K423	K415-H419 PolarHBondContact O-N 3.42Å; K415-H419 PolarHBondContact O-ND1 2.89Å; N416-H419 PolarHBondContact O-N 3.09Å; H419-R422 PolarHBondContact O-N 3.34Å; H419-K423 PolarHBondContact O-N 2.98Å
420	R	50.9	Low	52.9	Low	194 Å²	194	138 Å²	138	73%	0.732	67%	0.67	S	S	*	*	H	α-helix	trans	-65.4	-42.4	177.5	-142.4	173.9	-177.6	-177.9	-0.5	111.7	N416 G417 R418 R422 K423 L424	N416-R420 WeakPolarHBondContact O-CB 3.35Å; N416-R420 PolarHBondContact O-N 3.43Å; G417-R420 PolarHBondContact O-N 3.4Å; R418-R420 VanDerWaalsContact C-N 3.35Å; R420-R422 VanDerWaalsContact C-N 3.34Å; R420-R422 PolarHBondContact O-N 3.34Å; R420-K423 PolarHBondContact O-N 2.98Å; R420-L424 WeakPolarHBondContact O-CD1 3.42Å; R420-L424 WeakPolarHBondContact O-CG 3.36Å; R420-L424 PolarHBondContact O-N 2.96Å
421	H	49.3	Very low	52.5	Low	123 Å²	123	140.1 Å²	140.1	57%	0.569	68%	0.677	S	S	*	*	H	α-helix	trans	-65.3	-35.7	175.7	-126.1	-65.2	0	0	0	113	G417 R418 L424 H425	G417-H421 PolarHBondContact O-N 2.92Å; R418-H421 PolarHBondContact O-N 3.28Å; H421-L424 PolarHBondContact O-N 3.11Å; H421-H425 AromaticContact ND1-CD2 3.79Å; H421-H425 AromaticContact ND1-NE2 3.89Å; H421-H425 PolarHBondContact O-CD2 3.22Å; H421-H425 PolarHBondContact O-N 2.99Å
422	R	52.2	Low	52	Low	209 Å²	209	145.7 Å²	145.7	79%	0.789	70%	0.701	S	S	*	*	H	α-helix	trans	-77.2	-29.8	179	-158.7	171.9	170.9	177.3	-3.8	112.6	R418 H419 R420 G426	R418-R422 WeakPolarHBondContact O-CB 3.19Å; R418-R422 PolarHBondContact O-N 3.47Å; H419-R422 PolarHBondContact O-N 3.34Å; R420-R422 VanDerWaalsContact C-N 3.34Å; R420-R422 PolarHBondContact O-N 3.34Å; R422-G426 PolarHBondContact O-N 3.44Å
423	K	52.8	Low	51.7	Low	170 Å²	170	151 Å²	151	74%	0.739	72%	0.717	S	S	*	*	H	α-helix	trans	-65.4	-43.6	167	-100.8	-173.3	172.8	-172.7	0	111.9	H419 R420 H425 G426	H419-K423 PolarHBondContact O-N 2.98Å; R420-K423 PolarHBondContact O-N 2.98Å; K423-H425 PolarHBondContact O-N 2.98Å; K423-G426 PolarHBondContact O-N 3.3Å; K423-G426 VanDerWaalsContact O-N 3.17Å
424	L	51.9	Low	51.3	Low	134 Å²	134	151.4 Å²	151.4	70%	0.702	72%	0.722	S	S	*	*	H	α-helix	trans	-63.8	-26.2	177.9	-80.1	157.9	0	0	0	113.9	R420 H421	R420-L424 WeakPolarHBondContact O-CD1 3.42Å; R420-L424 WeakPolarHBondContact O-CG 3.36Å; R420-L424 PolarHBondContact O-N 2.96Å; H421-L424 PolarHBondContact O-N 3.11Å
425	H	54.2	Low	50.9	Low	154 Å²	154	152.8 Å²	152.8	71%	0.713	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-0.5	175.4	-75.2	-60.3	0	0	0	114.4	H421 K423	H421-H425 AromaticContact ND1-CD2 3.79Å; H421-H425 AromaticContact ND1-NE2 3.89Å; H421-H425 PolarHBondContact O-CD2 3.22Å; H421-H425 PolarHBondContact O-N 2.99Å; K423-H425 PolarHBondContact O-N 2.98Å
426	G	49.2	Very low	50.4	Low	54 Å²	54	153.1 Å²	153.1	56%	0.557	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-10.4	-177.1	0	0	0	0	0	115	R422 K423 R428	R422-G426 PolarHBondContact O-N 3.44Å; K423-G426 PolarHBondContact O-N 3.3Å; K423-G426 VanDerWaalsContact O-N 3.17Å; G426-R428 PolarHBondContact O-N 3.15Å
427	E	45.1	Very low	50.2	Low	178 Å²	178	155.9 Å²	155.9	83%	0.832	74%	0.744	S	S	*	*			trans	-94.8	67.1	174.9	-72.4	-178.6	-179.4	0	0	110.8
428	R	49.6	Very low	49.8	Very low	242 Å²	242	164.9 Å²	164.9	91%	0.913	77%	0.77	S	S	*	*			trans	-133.1	91.6	148.6	-80.5	-169.4	-172.5	-178	1.5	107.1	G426	G426-R428 PolarHBondContact O-N 3.15Å
429	L	35	Very low	49.2	Very low	162 Å²	162	162.6 Å²	162.6	85%	0.848	77%	0.774	S	S	*	*			trans	-88	155.6	162.2	-87.1	164.8	0	0	0	108.5
430	P	47.6	Very low	48.9	Very low	193 Å²	193	164.8 Å²	164.8	100%	1.253	79%	0.786	S	S	*	*			trans	-69.3	0	-141.3	26.2	-35.9	0	0	0	116.7

Retrieved 430 of 430 residues in 623.4 ms (Link to these results)

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