A0A096ND10_PAPAN Loading...

Beta-1,4-galactosyltransferase

Required for the biosynthesis of the tetrasaccharide linkage region of proteoglycans, especially for small proteoglycans in skin fibroblasts. Responsible for the synthesis of complex-type N-linked oligosaccharides in many glycoproteins as well as the carbohydrate moieties of glycolipids.

AlphaFold DB (A0A2K5NBZ4), UniProt , Accession A0A096ND10, Species PAPAN (Papio anubis, Olive baboon), Gene B4GALT7, Length 327 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	37.7	Very low	249 Å²	249	177 Å²	177	100%	1.227	90%	0.898	S	S	*	*				0	107.7	0	-132.5	167.9	-177.8	0	0	107.4
2	F	37.2	Very low	38.3	Very low	204 Å²	204	170.7 Å²	170.7	90%	0.895	88%	0.878	S	S	*	*			trans	-76	177.2	167.1	-91.3	-75.8	0	0	0	109.6
3	P	55.5	Low	37.4	Very low	114 Å²	114	176.7 Å²	176.7	74%	0.74	88%	0.883	S	S	*	*			cis	-136.6	-179	-22.6	28.9	-7.5	0	0	0	112.6
4	S	36.7	Very low	37.1	Very low	118 Å²	118	175.7 Å²	175.7	83%	0.825	87%	0.874	S	S	*	*			trans	-165.5	125	133.7	-172.5	0	0	0	0	112.6
5	R	40.2	Very low	37	Very low	246 Å²	246	172.9 Å²	172.9	93%	0.928	86%	0.864	S	S	*	*	P	Polyproline II helix	trans	-93.9	134.8	175.1	-108	178	171.8	-177.9	-2.7	109.2
6	R	39.6	Very low	36.7	Very low	251 Å²	251	166.1 Å²	166.1	95%	0.947	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-88.3	143.7	168.6	-73.6	-176.9	-179	-174	0.3	111.6
7	K	37.7	Very low	36.6	Very low	212 Å²	212	169.2 Å²	169.2	92%	0.922	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-92.3	154.4	165.6	-75.9	-180	174.4	179.1	0	110.7
8	A	33.7	Very low	36.3	Very low	102 Å²	102	166.1 Å²	166.1	84%	0.843	85%	0.846	S	S	*	*			trans	-179.7	149.5	147.3	0	0	0	0	0	107.2
9	A	34	Very low	36.3	Very low	98 Å²	98	168.1 Å²	168.1	81%	0.81	84%	0.842	S	S	*	*			cis	-163.1	150.3	-10.7	0	0	0	0	0	106.5
10	Q	32.8	Very low	36.1	Very low	183 Å²	183	167 Å²	167	86%	0.855	84%	0.838	S	S	*	*			trans	-84.7	157	165.8	-71.9	168.2	-41.4	0	0	109.6
11	L	32.4	Very low	36.1	Very low	170 Å²	170	167.5 Å²	167.5	89%	0.89	84%	0.843	S	S	*	*			trans	175.3	164.1	131.8	-92.3	172	0	0	0	110.9
12	P	45.7	Very low	36.2	Very low	101 Å²	101	161.2 Å²	161.2	66%	0.656	82%	0.824	S	S	*	*			trans	-127.1	177.1	-130	42.7	-27.1	0	0	0	114.1
13	W	26.2	Very low	35.9	Very low	249 Å²	249	154.9 Å²	154.9	94%	0.943	82%	0.815	S	S	*	*			trans	-163.2	117.7	151	-148.5	-96	0	0	0	112.6
14	E	32.8	Very low	35.3	Very low	163 Å²	163	155.3 Å²	155.3	76%	0.762	82%	0.821	S	S	*	*			trans	-95	164.8	152.1	-63.4	-168.7	120.8	0	0	107.2
15	D	36.2	Very low	35.5	Very low	134 Å²	134	157.3 Å²	157.3	72%	0.717	82%	0.822	S	S	*	*			cis	-173.4	159.9	31	-154.4	-3.1	0	0	0	111.6
16	G	32.3	Very low	35.7	Very low	64 Å²	64	151.7 Å²	151.7	66%	0.66	82%	0.817	S	S	*	*			trans	77.9	151.7	144.6	0	0	0	0	0	122.1
17	R	35.6	Very low	36.3	Very low	219 Å²	219	151 Å²	151	83%	0.826	82%	0.815	S	S	*	*			cis	175.9	140.8	-17.9	-128.6	-175.9	-157.6	-156.4	2.9	109.2
18	S	30.2	Very low	37.3	Very low	113 Å²	113	150.3 Å²	150.3	79%	0.79	81%	0.811	S	S	*	*			trans	-167	115.8	137	71	0	0	0	0	109
19	R	35.8	Very low	38.2	Very low	203 Å²	203	150 Å²	150	77%	0.766	80%	0.802	S	S	*	*				52.9	128	87.4	-75.3	-168	-175.7	-169.6	4	112.6
20	L	33.8	Very low	40.1	Very low	146 Å²	146	148.6 Å²	148.6	76%	0.764	79%	0.787	S	S	*	*			cis	-170.1	152	19.2	-98.8	148.7	0	0	0	106.8
21	L	36.1	Very low	41.9	Very low	178 Å²	178	145.8 Å²	145.8	93%	0.932	78%	0.782	S	S	*	*			trans	-168.7	124.6	137.4	-98.6	173	0	0	0	109.3
22	S	35.8	Very low	44	Very low	118 Å²	118	144 Å²	144	83%	0.825	77%	0.767	S	S	*	*			trans	-85.9	140.3	-179.6	55.9	0	0	0	0	111.7
23	G	31.3	Very low	45.3	Very low	70 Å²	70	144.5 Å²	144.5	72%	0.722	76%	0.76	S	S	*	*			trans	-163.2	112.3	167.1	0	0	0	0	0	110.3
24	S	42.1	Very low	47.7	Very low	123 Å²	123	137.9 Å²	137.9	86%	0.86	74%	0.742	S	S	*	*			trans	-58.5	126.4	-175.9	45.8	0	0	0	0	114.7
25	L	42.2	Very low	49.9	Very low	161 Å²	161	136.3 Å²	136.3	84%	0.843	73%	0.734	S	S	*	*			trans	-124.1	126.7	163.9	-97	127.8	0	0	0	109.9	R27	L25-R27 PolarHBondContact O-N 2.98Å
26	P	43.1	Very low	52.1	Low	127 Å²	127	132.5 Å²	132.5	83%	0.825	72%	0.715	S	S	*	*			trans	-75	120.6	178.2	29	-30.2	0	0	0	110.7	K28	P26-K28 PolarHBondContact O-N 2.94Å
27	R	52.2	Low	54.4	Low	238 Å²	238	131.8 Å²	131.8	90%	0.898	70%	0.703	S	S	*	*			trans	-63.8	122.5	165.6	-94.3	173	158	172.1	-5.8	110.2	L25	L25-R27 PolarHBondContact O-N 2.98Å
28	K	58.8	Low	56.6	Low	196 Å²	196	125.1 Å²	125.1	85%	0.852	69%	0.689	S	S	*	*				150.1	74.4	129.8	-79.6	172.6	-173.9	-176.9	0	110.7	P26	P26-K28 PolarHBondContact O-N 2.94Å
29	C	53.6	Low	59.2	Low	97 Å²	97	124 Å²	124	66%	0.655	67%	0.674	S	S	*	*			trans	-99.1	92.1	155.8	-149.5	0	0	0	0	106.5
30	S	73.7	Confident	61.6	Low	68 Å²	68	119 Å²	119	48%	0.476	66%	0.662	S	S	.	*			trans	-61.3	144	173.6	173.6	0	0	0	0	108.9	F32 H33	S30-F32 PolarHBondContact O-N 3.31Å; S30-F32 WeakPolarHBondContact OG-CB 3.37Å; S30-F32 PolarHBondContact OG-N 2.88Å; S30-H33 WeakPolarHBondContact O-CB 3.27Å; S30-H33 PolarHBondContact O-N 3.3Å
31	V	71.4	Confident	63.9	Low	124 Å²	124	118 Å²	118	75%	0.752	66%	0.656	S	S	*	*	H	α-helix	trans	-47.2	-29.3	172.3	176.1	0	0	0	0	111.5	H33 L34 F35	V31-H33 PolarHBondContact O-N 3.34Å; V31-L34 PolarHBondContact O-N 3.36Å; V31-F35 WeakPolarHBondContact O-CB 3.36Å; V31-F35 PolarHBondContact O-N 3.02Å
32	F	75.7	Confident	66.1	Low	133 Å²	133	111.1 Å²	111.1	58%	0.583	63%	0.628	S	S	*	*	H	α-helix	trans	-58.8	-42	172.6	-172.6	-101.8	0	0	0	114.1	S30 F35 V36	S30-F32 PolarHBondContact O-N 3.31Å; S30-F32 WeakPolarHBondContact OG-CB 3.37Å; S30-F32 PolarHBondContact OG-N 2.88Å; F32-F35 PolarHBondContact O-N 2.63Å; F32-V36 HydrophobicContact CD1-CG2 4.26Å; F32-V36 HydrophobicContact CE1-CG2 3.89Å; F32-V36 HydrophobicContact CE2-CG2 4.43Å; F32-V36 HydrophobicContact CZ-CG2 3.98Å; F32-V36 VanDerWaalsContact O-CG2 3.32Å; F32-V36 WeakPolarHBondContact O-CG2 3.41Å; F32-V36 PolarHBondContact O-N 3.22Å
33	H	73.7	Confident	68.2	Low	111 Å²	111	109 Å²	109	51%	0.514	61%	0.613	S	S	.	*	H	α-helix	trans	-68.7	-35.7	177.6	-73.5	-64.6	0	0	0	112.2	S30 V31 A37	S30-H33 WeakPolarHBondContact O-CB 3.27Å; S30-H33 PolarHBondContact O-N 3.3Å; V31-H33 PolarHBondContact O-N 3.34Å; H33-A37 WeakPolarHBondContact O-CB 3.13Å; H33-A37 PolarHBondContact O-N 2.81Å
34	L	74.8	Confident	70.5	Confident	109 Å²	109	112.9 Å²	112.9	57%	0.571	61%	0.61	S	S	*	*	H	α-helix	trans	-65.9	-41.9	172.6	-115.2	103.9	0	0	0	111.4	V31 A37 C38	V31-L34 PolarHBondContact O-N 3.36Å; L34-A37 PolarHBondContact O-N 3.22Å; L34-C38 PolarHBondContact O-N 3.49Å; L34-C38 PolarHBondContact O-SG 3.04Å; L34-C38 VanDerWaalsContact O-SG 3.38Å
35	F	79.9	Confident	72.2	Confident	131 Å²	131	110.5 Å²	110.5	58%	0.575	59%	0.594	S	S	*	*	H	α-helix	trans	-62.6	-44.9	177.6	-179.8	-103.4	0	0	0	112.1	V31 F32 C38 L39	V31-F35 WeakPolarHBondContact O-CB 3.36Å; V31-F35 PolarHBondContact O-N 3.02Å; F32-F35 PolarHBondContact O-N 2.63Å; F35-C38 PolarHBondContact O-N 2.69Å; F35-L39 HydrophobicContact CD1-CD1 3.9Å; F35-L39 HydrophobicContact CE1-CD1 3.29Å; F35-L39 HydrophobicContact CE2-CD1 4.34Å; F35-L39 HydrophobicContact CZ-CD1 3.55Å; F35-L39 PolarHBondContact O-N 3.16Å
36	V	82.7	Confident	73.9	Confident	54 Å²	54	108.5 Å²	108.5	33%	0.327	58%	0.583	S	S	.	*	H	α-helix	trans	-64.6	-40.8	176.3	173.5	0	0	0	0	111.2	F32 L39 L40	F32-V36 HydrophobicContact CD1-CG2 4.26Å; F32-V36 HydrophobicContact CE1-CG2 3.89Å; F32-V36 HydrophobicContact CE2-CG2 4.43Å; F32-V36 HydrophobicContact CZ-CG2 3.98Å; F32-V36 VanDerWaalsContact O-CG2 3.32Å; F32-V36 WeakPolarHBondContact O-CG2 3.41Å; F32-V36 PolarHBondContact O-N 3.22Å; V36-L39 PolarHBondContact O-N 3.43Å; V36-L40 HydrophobicContact CG1-CD1 4.05Å; V36-L40 HydrophobicContact CG1-CG 4.44Å; V36-L40 WeakPolarHBondContact O-CG 3.02Å; V36-L40 PolarHBondContact O-N 3.08Å
37	A	81.4	Confident	75.4	Confident	48 Å²	48	107.3 Å²	107.3	40%	0.397	57%	0.569	S	S	.	*	H	α-helix	trans	-62.3	-42.9	175.8	0	0	0	0	0	112.2	H33 L34 L40 L41	H33-A37 WeakPolarHBondContact O-CB 3.13Å; H33-A37 PolarHBondContact O-N 2.81Å; L34-A37 PolarHBondContact O-N 3.22Å; A37-L40 PolarHBondContact O-N 2.95Å; A37-L41 WeakPolarHBondContact O-CB 3.46Å; A37-L41 WeakPolarHBondContact O-CG 3.46Å; A37-L41 PolarHBondContact O-N 2.89Å
38	C	81.4	Confident	76.3	Confident	80 Å²	80	104.8 Å²	104.8	54%	0.541	56%	0.56	S	S	.	*	H	α-helix	trans	-64.3	-39.5	175.8	-72.7	0	0	0	0	112.6	L34 F35 L41 G42	L34-C38 PolarHBondContact O-N 3.49Å; L34-C38 PolarHBondContact O-SG 3.04Å; L34-C38 VanDerWaalsContact O-SG 3.38Å; F35-C38 PolarHBondContact O-N 2.69Å; C38-L41 PolarHBondContact O-N 3.32Å; C38-G42 PolarHBondContact O-N 2.82Å
39	L	85.1	Confident	76.8	Confident	90 Å²	90	100.5 Å²	100.5	47%	0.471	55%	0.546	S	S	.	.	H	α-helix	trans	-62.8	-45.5	175	-104.6	158.5	0	0	0	111.7	F35 V36 G42 C43	F35-L39 HydrophobicContact CD1-CD1 3.9Å; F35-L39 HydrophobicContact CE1-CD1 3.29Å; F35-L39 HydrophobicContact CE2-CD1 4.34Å; F35-L39 HydrophobicContact CZ-CD1 3.55Å; F35-L39 PolarHBondContact O-N 3.16Å; V36-L39 PolarHBondContact O-N 3.43Å; L39-G42 PolarHBondContact O-N 3Å; L39-C43 PolarHBondContact O-N 3.09Å; L39-C43 PolarHBondContact O-SG 3.42Å; L39-C43 VanDerWaalsContact O-SG 3.34Å
40	L	84.4	Confident	77.6	Confident	98 Å²	98	102.4 Å²	102.4	51%	0.513	55%	0.545	S	S	.	.	H	α-helix	trans	-64	-42.5	178.1	-70.5	172.5	0	0	0	111.6	V36 A37 G42 C43 F44	V36-L40 HydrophobicContact CG1-CD1 4.05Å; V36-L40 HydrophobicContact CG1-CG 4.44Å; V36-L40 WeakPolarHBondContact O-CG 3.02Å; V36-L40 PolarHBondContact O-N 3.08Å; A37-L40 PolarHBondContact O-N 2.95Å; L40-G42 VanDerWaalsContact C-N 3.34Å; L40-G42 PolarHBondContact O-N 3.35Å; L40-C43 PolarHBondContact O-N 3.26Å; L40-F44 WeakPolarHBondContact O-CB 3.3Å; L40-F44 WeakPolarHBondContact O-CD2 3.26Å; L40-F44 PolarHBondContact O-N 3.06Å
41	L	82.9	Confident	77.3	Confident	124 Å²	124	105.1 Å²	105.1	65%	0.649	55%	0.553	S	S	*	*	H	α-helix	trans	-61.4	-41	174.2	-75.2	171.7	0	0	0	112.2	A37 C38 F44 S45	A37-L41 WeakPolarHBondContact O-CB 3.46Å; A37-L41 WeakPolarHBondContact O-CG 3.46Å; A37-L41 PolarHBondContact O-N 2.89Å; C38-L41 PolarHBondContact O-N 3.32Å; L41-F44 PolarHBondContact O-N 3.14Å; L41-S45 WeakPolarHBondContact O-CB 3.31Å; L41-S45 PolarHBondContact O-N 3.08Å
42	G	82.8	Confident	77.2	Confident	34 Å²	34	102.7 Å²	102.7	35%	0.351	54%	0.542	S	S	.	.	H	α-helix	trans	-63.5	-44.4	174.6	0	0	0	0	0	112.8	C38 L39 L40 S45 L46	C38-G42 PolarHBondContact O-N 2.82Å; L39-G42 PolarHBondContact O-N 3Å; L40-G42 VanDerWaalsContact C-N 3.34Å; L40-G42 PolarHBondContact O-N 3.35Å; G42-S45 PolarHBondContact O-N 2.92Å; G42-L46 WeakPolarHBondContact O-CG 3.24Å; G42-L46 PolarHBondContact O-N 3.5Å
43	C	79.8	Confident	76	Confident	73 Å²	73	101 Å²	101	49%	0.493	55%	0.545	S	S	.	.	H	α-helix	trans	-65.1	-41.2	176.5	-70.4	0	0	0	0	112.4	L39 L40 S45 L46 L47	L39-C43 PolarHBondContact O-N 3.09Å; L39-C43 PolarHBondContact O-SG 3.42Å; L39-C43 VanDerWaalsContact O-SG 3.34Å; L40-C43 PolarHBondContact O-N 3.26Å; C43-S45 VanDerWaalsContact C-N 3.35Å; C43-L46 PolarHBondContact O-N 3.16Å; C43-L47 WeakPolarHBondContact O-CB 3.36Å; C43-L47 PolarHBondContact O-N 3.07Å
44	F	79.6	Confident	75	Confident	151 Å²	151	100.4 Å²	100.4	66%	0.662	55%	0.554	S	S	*	*	H	α-helix	trans	-64.1	-38.7	175.2	-95.6	-77.3	0	0	0	112.2	L40 L41 L47 W48	L40-F44 WeakPolarHBondContact O-CB 3.3Å; L40-F44 WeakPolarHBondContact O-CD2 3.26Å; L40-F44 PolarHBondContact O-N 3.06Å; L41-F44 PolarHBondContact O-N 3.14Å; F44-L47 PolarHBondContact O-N 3.37Å; F44-W48 VanDerWaalsContact O-CB 3.31Å; F44-W48 WeakPolarHBondContact O-CB 3.42Å; F44-W48 PolarHBondContact O-N 3.44Å
45	S	77.1	Confident	73.9	Confident	74 Å²	74	98.2 Å²	98.2	52%	0.517	56%	0.557	S	S	.	*	H	α-helix	trans	-63.2	-44.5	175.2	-178.5	0	0	0	0	112.2	L41 G42 C43 W48 L49	L41-S45 WeakPolarHBondContact O-CB 3.31Å; L41-S45 PolarHBondContact O-N 3.08Å; G42-S45 PolarHBondContact O-N 2.92Å; C43-S45 VanDerWaalsContact C-N 3.35Å; S45-W48 PolarHBondContact O-N 2.94Å; S45-L49 PolarHBondContact O-N 3.38Å
46	L	77.3	Confident	72.4	Confident	118 Å²	118	99.3 Å²	99.3	62%	0.618	57%	0.569	S	S	*	*	H	α-helix	trans	-67.2	-38.3	177.3	-71.1	168.4	0	0	0	112.5	G42 C43 L49 Q50	G42-L46 WeakPolarHBondContact O-CG 3.24Å; G42-L46 PolarHBondContact O-N 3.5Å; C43-L46 PolarHBondContact O-N 3.16Å; L46-L49 PolarHBondContact O-N 3.11Å; L46-Q50 WeakPolarHBondContact O-CG 3.42Å; L46-Q50 PolarHBondContact O-N 3.33Å
47	L	75.2	Confident	70.6	Confident	103 Å²	103	104 Å²	104	54%	0.539	60%	0.597	S	S	.	*	H	α-helix	trans	-67.2	-39.6	175.5	-159.4	79.1	0	0	0	111.3	C43 F44 L49 Q50 L51	C43-L47 WeakPolarHBondContact O-CB 3.36Å; C43-L47 PolarHBondContact O-N 3.07Å; F44-L47 PolarHBondContact O-N 3.37Å; L47-L49 VanDerWaalsContact C-N 3.35Å; L47-Q50 PolarHBondContact O-N 3.4Å; L47-L51 HydrophobicContact CD2-CD1 4.37Å; L47-L51 HydrophobicContact CG-CD1 4.1Å; L47-L51 WeakPolarHBondContact O-CB 3.33Å; L47-L51 WeakPolarHBondContact O-CD1 3.49Å; L47-L51 WeakPolarHBondContact O-CG 3.47Å; L47-L51 PolarHBondContact O-N 2.96Å
48	W	71.3	Confident	68.7	Low	185 Å²	185	104.7 Å²	104.7	70%	0.701	61%	0.61	S	S	*	*	H	α-helix	trans	-62.6	-40.6	173.4	-173.2	-91.2	0	0	0	111.9	F44 S45 L51 S52	F44-W48 VanDerWaalsContact O-CB 3.31Å; F44-W48 WeakPolarHBondContact O-CB 3.42Å; F44-W48 PolarHBondContact O-N 3.44Å; S45-W48 PolarHBondContact O-N 2.94Å; W48-L51 PolarHBondContact O-N 3.15Å; W48-S52 PolarHBondContact NE1-OG 3.19Å; W48-S52 VanDerWaalsContact O-CB 3.26Å; W48-S52 WeakPolarHBondContact O-CB 3.45Å; W48-S52 PolarHBondContact O-N 3.04Å; W48-S52 PolarHBondContact O-OG 2.62Å
49	L	70.1	Confident	66.6	Low	106 Å²	106	113 Å²	113	56%	0.555	63%	0.63	S	S	*	*	H	α-helix	trans	-63.9	-43.4	175.9	-135.8	83.9	0	0	0	111.7	S45 L46 L47 S52 C53	S45-L49 PolarHBondContact O-N 3.38Å; L46-L49 PolarHBondContact O-N 3.11Å; L47-L49 VanDerWaalsContact C-N 3.35Å; L49-S52 PolarHBondContact O-N 3.15Å; L49-C53 WeakPolarHBondContact O-CB 3.48Å; L49-C53 PolarHBondContact O-N 3.46Å; L49-C53 PolarHBondContact O-SG 2.72Å; L49-C53 VanDerWaalsContact O-SG 3.36Å
50	Q	69.5	Low	64.4	Low	137 Å²	137	113.7 Å²	113.7	64%	0.64	65%	0.649	S	S	*	*	H	α-helix	trans	-65.7	-39.6	177.4	-75.2	-74.5	-51.5	0	0	112.7	L46 L47 C53 S54	L46-Q50 WeakPolarHBondContact O-CG 3.42Å; L46-Q50 PolarHBondContact O-N 3.33Å; L47-Q50 PolarHBondContact O-N 3.4Å; Q50-C53 PolarHBondContact O-N 3.47Å; Q50-S54 PolarHBondContact O-N 2.91Å; Q50-S54 PolarHBondContact O-OG 3.23Å
51	L	67.7	Low	62.4	Low	125 Å²	125	113.6 Å²	113.6	65%	0.654	66%	0.662	S	S	*	*	H	α-helix	trans	-72.6	-31	176.7	-73.7	162.3	0	0	0	112.3	L47 W48	L47-L51 HydrophobicContact CD2-CD1 4.37Å; L47-L51 HydrophobicContact CG-CD1 4.1Å; L47-L51 WeakPolarHBondContact O-CB 3.33Å; L47-L51 WeakPolarHBondContact O-CD1 3.49Å; L47-L51 WeakPolarHBondContact O-CG 3.47Å; L47-L51 PolarHBondContact O-N 2.96Å; W48-L51 PolarHBondContact O-N 3.15Å
52	S	68.1	Low	60.2	Low	73 Å²	73	120.1 Å²	120.1	51%	0.51	68%	0.678	S	S	.	*	H	α-helix	trans	-76.9	-23.4	175.5	-57.7	0	0	0	0	113	W48 L49	W48-S52 PolarHBondContact NE1-OG 3.19Å; W48-S52 VanDerWaalsContact O-CB 3.26Å; W48-S52 WeakPolarHBondContact O-CB 3.45Å; W48-S52 PolarHBondContact O-N 3.04Å; W48-S52 PolarHBondContact O-OG 2.62Å; L49-S52 PolarHBondContact O-N 3.15Å
53	C	51.7	Low	57.8	Low	96 Å²	96	122.2 Å²	122.2	65%	0.649	70%	0.7	S	S	*	*	H	α-helix	trans	-96	-4.1	179.7	-70.3	0	0	0	0	114.8	L49 Q50 G55	L49-C53 WeakPolarHBondContact O-CB 3.48Å; L49-C53 PolarHBondContact O-N 3.46Å; L49-C53 PolarHBondContact O-SG 2.72Å; L49-C53 VanDerWaalsContact O-SG 3.36Å; Q50-C53 PolarHBondContact O-N 3.47Å; C53-G55 VanDerWaalsContact C-N 3.32Å
54	S	52.4	Low	55.7	Low	99 Å²	99	128.2 Å²	128.2	69%	0.692	72%	0.721	S	S	*	*	S	Bend	trans	-89.5	10.3	177.6	-72.2	0	0	0	0	114.5	Q50	Q50-S54 PolarHBondContact O-N 2.91Å; Q50-S54 PolarHBondContact O-OG 3.23Å
55	G	50.9	Low	53.7	Low	63 Å²	63	124.7 Å²	124.7	65%	0.649	73%	0.727	S	S	*	*	S	Bend	trans	-110.6	41.7	-174.4	0	0	0	0	0	115.6	C53	C53-G55 VanDerWaalsContact C-N 3.32Å
56	D	48.2	Very low	51.5	Low	155 Å²	155	129.7 Å²	129.7	83%	0.829	74%	0.742	S	S	*	*			trans	-168.2	50.8	155.8	-122.7	-16.9	0	0	0	114.9
57	V	45.3	Very low	49.9	Very low	151 Å²	151	133.7 Å²	133.7	92%	0.915	76%	0.757	S	S	*	*			trans	-115.7	75	167.7	-174	0	0	0	0	108.4
58	G	42.6	Very low	47.9	Very low	64 Å²	64	134.4 Å²	134.4	66%	0.66	77%	0.766	S	S	*	*			trans	-166.4	32.9	-173.1	0	0	0	0	0	115.9
59	R	37	Very low	46.5	Very low	255 Å²	255	131.6 Å²	131.6	96%	0.962	78%	0.775	S	S	*	*	S	Bend	trans	-163.3	59.3	167.9	-116.2	168	-173.9	-177.6	1.7	114.1
60	A	38.5	Very low	45.1	Very low	104 Å²	104	129.4 Å²	129.4	86%	0.86	78%	0.778	S	S	*	*			trans	-147.1	63.7	165.7	0	0	0	0	0	111.1
61	A	42.5	Very low	44.1	Very low	96 Å²	96	128.6 Å²	128.6	79%	0.793	79%	0.785	S	S	*	*			trans	-158.8	78.1	168.5	0	0	0	0	0	111.4
62	R	37.7	Very low	43.1	Very low	260 Å²	260	128.6 Å²	128.6	98%	0.981	79%	0.792	S	S	*	*			trans	174.5	115	145.3	-108	175.4	168.6	179	-3.5	110.8
63	G	32.3	Very low	42	Very low	79 Å²	79	136.6 Å²	136.6	81%	0.814	81%	0.811	S	S	*	*			trans	169.8	101.1	167.5	0	0	0	0	0	110.9
64	Q	35	Very low	41.8	Very low	199 Å²	199	136.5 Å²	136.5	93%	0.93	82%	0.817	S	S	*	*			trans	-60.7	157	179.3	-74.7	165.7	-34.3	0	0	112.6
65	G	37.1	Very low	41.2	Very low	77 Å²	77	137.4 Å²	137.4	79%	0.794	82%	0.822	S	S	*	*			trans	-66.8	154.8	-173	0	0	0	0	0	116.3
66	Q	31.6	Very low	41.8	Very low	178 Å²	178	139.9 Å²	139.9	83%	0.832	83%	0.827	S	S	*	*			trans	-162.9	121.4	147.5	-148.5	155.1	-15.5	0	0	107.3	T68	Q66-T68 PolarHBondContact O-N 3.48Å
67	E	43.5	Very low	41.7	Very low	202 Å²	202	138.3 Å²	138.3	94%	0.944	83%	0.825	S	S	*	*			trans	-64.9	113.4	171.6	-78.2	179.3	147.9	0	0	109.2
68	T	32.3	Very low	41.9	Very low	119 Å²	119	139.9 Å²	139.9	73%	0.73	82%	0.823	S	S	*	*			trans	-121.9	123.4	164.6	54	0	0	0	0	108.4	Q66 G70	Q66-T68 PolarHBondContact O-N 3.48Å; T68-G70 PolarHBondContact O-N 2.97Å
69	S	42	Very low	42.5	Very low	126 Å²	126	140.9 Å²	140.9	88%	0.881	82%	0.817	S	S	*	*			trans	-51.8	107.5	171.8	51.1	0	0	0	0	110.6
70	G	42.1	Very low	43.2	Very low	60 Å²	60	133.9 Å²	133.9	62%	0.619	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-64.9	159	172.9	0	0	0	0	0	111.8	T68	T68-G70 PolarHBondContact O-N 2.97Å
71	P	47.1	Very low	43.9	Very low	120 Å²	120	134.5 Å²	134.5	78%	0.779	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-60.8	152.1	179.9	27.1	-32.9	0	0	0	110.5	R73	P71-R73 PolarHBondContact O-N 3.32Å
72	P	46.1	Very low	44.9	Very low	124 Å²	124	132.4 Å²	132.4	81%	0.805	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-55.6	133.3	-179.1	22.7	-31.1	0	0	0	109.4	A74	P72-A74 PolarHBondContact O-N 3.38Å; P72-A74 VanDerWaalsContact O-N 3.11Å
73	R	45.8	Very low	46.1	Very low	241 Å²	241	128.2 Å²	128.2	91%	0.909	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-50.2	121.3	173.3	-74.5	-179	174.1	177.9	-2.3	107.9	P71 C75	P71-R73 PolarHBondContact O-N 3.32Å; R73-C75 PolarHBondContact O-N 3.46Å
74	A	47.2	Very low	47.9	Very low	95 Å²	95	125.7 Å²	125.7	79%	0.785	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-52.8	134.8	174.7	0	0	0	0	0	109.1	P72	P72-A74 PolarHBondContact O-N 3.38Å; P72-A74 VanDerWaalsContact O-N 3.11Å
75	C	40.5	Very low	49.3	Very low	118 Å²	118	120 Å²	120	80%	0.797	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-51.4	139.9	172.9	-64.6	0	0	0	0	109.1	R73	R73-C75 PolarHBondContact O-N 3.46Å
76	P	62.4	Low	50.7	Low	114 Å²	114	122.1 Å²	122.1	74%	0.74	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-51.1	140.7	167.9	-20.4	30.4	0	0	0	109.1	E78	P76-E78 PolarHBondContact O-N 3.29Å
77	P	48.2	Very low	52.8	Low	123 Å²	123	117 Å²	117	80%	0.799	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-53.7	135.1	176.1	21.7	-31.1	0	0	0	109.4
78	E	47.5	Very low	54.6	Low	184 Å²	184	112.6 Å²	112.6	86%	0.86	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-53.3	136.3	174.3	-76.7	-176.1	157.4	0	0	109.1	P76	P76-E78 PolarHBondContact O-N 3.29Å
79	P	55.8	Low	57.3	Low	85 Å²	85	110.6 Å²	110.6	55%	0.552	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-56.7	145.5	178.1	23.1	-31.1	0	0	0	109.4
80	P	52.2	Low	59.8	Low	108 Å²	108	106.4 Å²	106.4	70%	0.701	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-51.5	141	170.9	-19.5	29.3	0	0	0	109	E82	P80-E82 PolarHBondContact O-N 3.29Å
81	P	54.2	Low	62.1	Low	117 Å²	117	105.5 Å²	105.5	76%	0.76	62%	0.616	S	S	*	*			trans	-55.4	115.6	177.5	19.8	-29.2	0	0	0	108.8	Q83	P81-Q83 PolarHBondContact O-N 2.88Å; P81-Q83 VanDerWaalsContact O-N 3.15Å
82	E	62.1	Low	64.4	Low	51 Å²	51	104.6 Å²	104.6	24%	0.238	61%	0.61	C	S	.	*			trans	-62.7	117.8	179	-75.3	-179.4	150.6	0	0	108.4	P80 W84 Y129 S153	P80-E82 PolarHBondContact O-N 3.29Å; E82-W84 PolarHBondContact O-N 3.39Å; E82-Y129 WeakPolarHBondContact OE1-CE1 3.45Å; E82-Y129 PolarHBondContact OE1-OH 3.23Å; E82-Y129 PolarHBondContact OE2-OH 3.37Å; E82-S153 VanDerWaalsContact OE2-CB 3.27Å; E82-S153 WeakPolarHBondContact OE2-CB 3.23Å
83	Q	63.4	Low	66.9	Low	172 Å²	172	102.2 Å²	102.2	80%	0.804	59%	0.589	S	S	*	*			trans	-79.8	100.7	-178.6	-69.3	-178.9	-11.1	0	0	108.5	P81	P81-Q83 PolarHBondContact O-N 2.88Å; P81-Q83 VanDerWaalsContact O-N 3.15Å
84	W	69.4	Low	69.3	Low	27 Å²	27	93.4 Å²	93.4	10%	0.102	56%	0.555	C	S	.	*			trans	-69.5	139.3	164.9	-60.1	96.5	0	0	0	109	E82 E86 R94 H127 S155 T156	E82-W84 PolarHBondContact O-N 3.39Å; W84-E86 HydrophobicContact CB-CG 3.72Å; W84-E86 PolarHBondContact O-N 2.93Å; W84-R94 HydrophobicContact CE3-CB 4.34Å; W84-R94 HydrophobicContact CE3-CG 4.41Å; W84-R94 HydrophobicContact CH2-CB 4.25Å; W84-R94 HydrophobicContact CZ3-CB 4.06Å; W84-H127 HydrophobicContact CE3-CB 4.05Å; W84-H127 HydrophobicContact CH2-CB 3.9Å; W84-H127 HydrophobicContact CZ3-CB 3.51Å; W84-S155 WeakPolarHBondContact CZ2-OG 3.5Å; W84-S155 PolarHBondContact NE1-OG 2.98Å; W84-T156 VanDerWaalsContact CH2-OG1 3.32Å; W84-T156 WeakPolarHBondContact CH2-OG1 3.42Å
85	E	64.2	Low	71.8	Confident	80 Å²	80	88.9 Å²	88.9	37%	0.374	52%	0.518	S	S	.	.			trans	-70	102.3	160.5	-73.5	-147.7	157.4	0	0	108.4	H116 S120	E85-H116 IonicContact OE1-CE1 3.67Å; E85-H116 PolarHBondContact OE1-CE1 3.47Å; E85-H116 VanDerWaalsContact OE1-CE1 3.29Å; E85-H116 IonicContact OE1-NE2 2.78Å; E85-H116 PolarHBondContact OE1-NE2 3.31Å; E85-H116 IonicContact OE2-CE1 3.42Å; E85-H116 PolarHBondContact OE2-CE1 2.86Å; E85-H116 IonicContact OE2-NE2 3.91Å; E85-S120 PolarHBondContact OE2-OG 2.97Å
86	E	66.7	Low	74.6	Confident	121 Å²	121	83.2 Å²	83.2	57%	0.565	48%	0.48	S	S	*	.			trans	-104.5	101.3	-180	-63	-172.9	176.7	0	0	109.5	W84 R94	W84-E86 HydrophobicContact CB-CG 3.72Å; W84-E86 PolarHBondContact O-N 2.93Å; E86-R94 IonicContact OE1-CZ 3.79Å; E86-R94 IonicContact OE1-NH1 3.49Å; E86-R94 PolarHBondContact OE1-NH1 3.41Å; E86-R94 IonicContact OE1-NH2 2.95Å; E86-R94 PolarHBondContact OE1-NH2 2.84Å
87	D	77.3	Confident	76.3	Confident	71 Å²	71	77.9 Å²	77.9	38%	0.38	45%	0.445	S	S	.	.			trans	-100.7	118.3	156.4	176.2	-20.4	0	0	0	106.8	S89 W90	D87-S89 PolarHBondContact O-N 3.43Å; D87-S89 VanDerWaalsContact OD1-CB 3.27Å; D87-S89 WeakPolarHBondContact OD1-CB 3.32Å; D87-S89 PolarHBondContact OD1-N 3.33Å; D87-S89 PolarHBondContact OD1-OG 3.01Å; D87-S89 PolarHBondContact OD2-OG 3.3Å; D87-W90 HydrophobicContact CB-CD2 4.04Å; D87-W90 HydrophobicContact CB-CG 3.97Å; D87-W90 HydrophobicContact CB-CZ2 4.29Å; D87-W90 VanDerWaalsContact CB-NE1 3.33Å; D87-W90 VanDerWaalsContact CG-CD1 3.49Å; D87-W90 VanDerWaalsContact CG-NE1 3.32Å; D87-W90 WeakPolarHBondContact O-CB 3.27Å; D87-W90 PolarHBondContact O-N 2.81Å; D87-W90 PolarHBondContact OD2-NE1 2.97Å
88	A	79.6	Confident	78.7	Confident	108 Å²	108	72 Å²	72	89%	0.893	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-12.6	-176.3	0	0	0	0	0	113.8	W90	A88-W90 VanDerWaalsContact C-N 3.35Å
89	S	89.8	Confident	81.2	Confident	77 Å²	77	63.2 Å²	63.2	54%	0.538	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-7.5	174	73	0	0	0	0	114.3	D87	D87-S89 PolarHBondContact O-N 3.43Å; D87-S89 VanDerWaalsContact OD1-CB 3.27Å; D87-S89 WeakPolarHBondContact OD1-CB 3.32Å; D87-S89 PolarHBondContact OD1-N 3.33Å; D87-S89 PolarHBondContact OD1-OG 3.01Å; D87-S89 PolarHBondContact OD2-OG 3.3Å
90	W	94.6	Very high	83.2	Confident	39 Å²	39	59.6 Å²	59.6	15%	0.148	34%	0.342	C	S	.	.	S	Bend	trans	-86.2	161.3	-178.6	-64.2	17.5	0	0	0	110.9	D87 A88 K123 I124 Q125	D87-W90 HydrophobicContact CB-CD2 4.04Å; D87-W90 HydrophobicContact CB-CG 3.97Å; D87-W90 HydrophobicContact CB-CZ2 4.29Å; D87-W90 VanDerWaalsContact CB-NE1 3.33Å; D87-W90 VanDerWaalsContact CG-CD1 3.49Å; D87-W90 VanDerWaalsContact CG-NE1 3.32Å; D87-W90 WeakPolarHBondContact O-CB 3.27Å; D87-W90 PolarHBondContact O-N 2.81Å; D87-W90 PolarHBondContact OD2-NE1 2.97Å; A88-W90 VanDerWaalsContact C-N 3.35Å; W90-K123 HydrophobicContact CB-CB 4.27Å; W90-K123 WeakPolarHBondContact CB-O 3.1Å; W90-K123 VanDerWaalsContact CD2-CA 3.43Å; W90-K123 HydrophobicContact CD2-CB 3.77Å; W90-K123 HydrophobicContact CD2-CG 4.4Å; W90-K123 HydrophobicContact CE3-CB 4.47Å; W90-K123 HydrophobicContact CG-CB 3.62Å; W90-K123 HydrophobicContact CG-CG 4.3Å; W90-I124 WeakPolarHBondContact CZ3-O 3.28Å; W90-Q125 HydrophobicContact CB-CG 4.28Å; W90-Q125 HydrophobicContact CE3-CG 4.09Å
91	G	91.1	Very high	85.5	Confident	40 Å²	40	55.2 Å²	55.2	41%	0.412	31%	0.312	S	S	.	.			trans	-60.2	159	177.7	0	0	0	0	0	112.4	H93	G91-H93 VanDerWaalsContact C-N 3.26Å; G91-H93 PolarHBondContact O-N 2.92Å
92	P	94.6	Very high	87.6	Confident	101 Å²	101	52 Å²	52	66%	0.656	29%	0.285	S	S	*	.	S	Bend	trans	-74.4	-16.3	-172.7	31.5	-36.8	0	0	0	113.6
93	H	97.6	Very high	89.3	Confident	75 Å²	75	56.8 Å²	56.8	35%	0.347	31%	0.307	S	S	.	.			trans	-83.1	132	-171.2	-62.5	-61.5	0	0	0	112.7	G91 D157 Y158 F177	G91-H93 VanDerWaalsContact C-N 3.26Å; G91-H93 PolarHBondContact O-N 2.92Å; H93-D157 VanDerWaalsContact CA-OD2 3.24Å; H93-D157 WeakPolarHBondContact CA-OD2 3.21Å; H93-D157 IonicContact ND1-OD2 3.97Å; H93-Y158 HydrophobicContact CB-CD1 4.29Å; H93-Y158 HydrophobicContact CB-CE1 3.97Å; H93-F177 HydrophobicContact CB-CB 3.87Å; H93-F177 HydrophobicContact CB-CD2 4.21Å; H93-F177 HydrophobicContact CB-CG 4.25Å; H93-F177 WeakPolarHBondContact CD2-CB 3.23Å; H93-F177 AromaticContact CD2-CG 3.67Å; H93-F177 AromaticContact CE1-CD1 3.79Å; H93-F177 AromaticContact CE1-CG 3.88Å; H93-F177 AromaticContact CG-CD2 3.88Å; H93-F177 AromaticContact CG-CG 3.66Å; H93-F177 AromaticContact ND1-CD2 3.8Å; H93-F177 AromaticContact ND1-CG 3.8Å; H93-F177 AromaticContact NE2-CD1 3.69Å; H93-F177 AromaticContact NE2-CG 3.82Å
94	R	97.9	Very high	90.9	Very high	55 Å²	55	51.4 Å²	51.4	21%	0.208	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	126	-179.4	-64.9	175.3	-175.4	-160.1	-0.9	111.9	W84 E86 Q125 S155 D157 Y158	W84-R94 HydrophobicContact CE3-CB 4.34Å; W84-R94 HydrophobicContact CE3-CG 4.41Å; W84-R94 HydrophobicContact CH2-CB 4.25Å; W84-R94 HydrophobicContact CZ3-CB 4.06Å; E86-R94 IonicContact OE1-CZ 3.79Å; E86-R94 IonicContact OE1-NH1 3.49Å; E86-R94 PolarHBondContact OE1-NH1 3.41Å; E86-R94 IonicContact OE1-NH2 2.95Å; E86-R94 PolarHBondContact OE1-NH2 2.84Å; R94-Q125 HydrophobicContact CG-CB 4.07Å; R94-Q125 VanDerWaalsContact CG-OE1 3.25Å; R94-S155 WeakPolarHBondContact CD-O 3.48Å; R94-D157 PolarHBondContact N-OD2 3.3Å; R94-D157 PolarHBondContact O-N 2.86Å; R94-Y158 VanDerWaalsContact O-CD1 3.26Å; R94-Y158 WeakPolarHBondContact O-CD1 3.32Å; R94-Y158 PolarHBondContact O-N 2.86Å
95	L	98.6	Very high	92.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123.7	-179.6	175.9	55	0	0	0	111.9	V97 L119 I124 Q125 H126 H127 Y158 A160	L95-V97 HydrophobicContact CD2-CG2 3.95Å; L95-V97 HydrophobicContact CG-CG2 3.96Å; L95-L119 HydrophobicContact CD2-CD1 4.15Å; L95-L119 HydrophobicContact CD2-CD2 4.15Å; L95-I124 HydrophobicContact CB-CG2 4Å; L95-I124 HydrophobicContact CD2-CG2 4.02Å; L95-Q125 WeakPolarHBondContact CB-O 3.44Å; L95-Q125 PolarHBondContact N-O 3.19Å; L95-H126 HydrophobicContact CB-CB 4.11Å; L95-H126 HydrophobicContact CG-CB 4.49Å; L95-H126 CarbonylContact O-C 3.6Å; L95-H126 WeakPolarHBondContact O-CA 3.33Å; L95-H127 PolarHBondContact O-N 2.88Å; L95-Y158 WeakPolarHBondContact CA-O 3.37Å; L95-Y158 HydrophobicContact CB-CD1 4.31Å; L95-Y158 HydrophobicContact CB-CE1 3.63Å; L95-Y158 HydrophobicContact CB-CE2 4.15Å; L95-Y158 HydrophobicContact CD1-CD2 3.75Å; L95-Y158 HydrophobicContact CD1-CE1 4.4Å; L95-Y158 HydrophobicContact CD1-CE2 3.59Å; L95-Y158 HydrophobicContact CD1-CG 4.27Å; L95-Y158 HydrophobicContact CD2-CE2 4.33Å; L95-Y158 HydrophobicContact CG-CE2 4.22Å; L95-A160 HydrophobicContact CD1-CB 3.74Å; L95-A160 HydrophobicContact CD2-CB 4.48Å
96	A	98.8	Very high	93.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	114.8	160.3	0	0	0	0	0	110.2	L98 Y129 T156 Y158 I159 A160	A96-L98 HydrophobicContact CB-CD2 4.01Å; A96-L98 PolarHBondContact O-N 3.45Å; A96-Y129 HydrophobicContact CB-CD2 3.93Å; A96-Y129 HydrophobicContact CB-CE2 3.69Å; A96-T156 HydrophobicContact CB-CG2 3.5Å; A96-Y158 PolarHBondContact N-O 3.2Å; A96-I159 HydrophobicContact CB-CG2 4.32Å; A96-I159 CarbonylContact O-C 3.59Å; A96-I159 WeakPolarHBondContact O-CA 3.26Å; A96-A160 PolarHBondContact O-N 2.87Å
97	V	98.9	Very high	95.4	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	106.7	172	-173.6	0	0	0	0	107.8	L95 V99 F111 L119 H127 I128 Y129 H162	L95-V97 HydrophobicContact CD2-CG2 3.95Å; L95-V97 HydrophobicContact CG-CG2 3.96Å; V97-V99 HydrophobicContact CG1-CG2 3.94Å; V97-F111 HydrophobicContact CG1-CE1 4.46Å; V97-F111 HydrophobicContact CG1-CZ 4.16Å; V97-L119 HydrophobicContact CG2-CD1 3.78Å; V97-H127 PolarHBondContact N-O 3.07Å; V97-I128 HydrophobicContact CB-CG1 4.14Å; V97-I128 HydrophobicContact CG2-CG1 4.36Å; V97-Y129 PolarHBondContact O-N 2.78Å; V97-H162 HydrophobicContact CG1-CB 3.89Å
98	L	98.9	Very high	96.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	106.5	-175.4	-61.4	-170	0	0	0	109.7	A96 P100 Y129 L131 I145 F149 I159 A160 H162	A96-L98 HydrophobicContact CB-CD2 4.01Å; A96-L98 PolarHBondContact O-N 3.45Å; L98-P100 WeakPolarHBondContact O-CD 3.49Å; L98-Y129 HydrophobicContact CD2-CD2 4.04Å; L98-Y129 HydrophobicContact CD2-CG 4.31Å; L98-L131 HydrophobicContact CB-CD1 3.96Å; L98-I145 HydrophobicContact CB-CD1 3.91Å; L98-I145 HydrophobicContact CD1-CG2 4.08Å; L98-F149 HydrophobicContact CD1-CB 4.36Å; L98-I159 HydrophobicContact CD1-CB 3.96Å; L98-I159 HydrophobicContact CD1-CD1 3.96Å; L98-I159 HydrophobicContact CD1-CG2 3.89Å; L98-I159 HydrophobicContact CG-CB 4.28Å; L98-I159 HydrophobicContact CG-CG2 4.36Å; L98-A160 PolarHBondContact N-O 2.83Å; L98-H162 PolarHBondContact O-N 3.36Å
99	V	98.9	Very high	97.3	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	100.8	-171.2	-172.3	0	0	0	0	110	V97 F101 F111 I128 Y129 L131 V164	V97-V99 HydrophobicContact CG1-CG2 3.94Å; V99-F101 PolarHBondContact O-N 3.02Å; V99-F111 HydrophobicContact CG1-CE1 4.38Å; V99-F111 HydrophobicContact CG2-CD1 4.45Å; V99-F111 HydrophobicContact CG2-CE1 3.48Å; V99-F111 VanDerWaalsContact CG2-CE1 3.48Å; V99-F111 HydrophobicContact CG2-CZ 3.7Å; V99-I128 HydrophobicContact CG2-CG2 3.98Å; V99-Y129 WeakPolarHBondContact CB-O 3.13Å; V99-Y129 PolarHBondContact N-O 2.95Å; V99-L131 WeakPolarHBondContact O-CB 3.36Å; V99-L131 PolarHBondContact O-N 3.3Å; V99-V164 HydrophobicContact CG1-CB 3.62Å; V99-V164 HydrophobicContact CG1-CG2 3.93Å
100	P	98.9	Very high	97.8	Very high	8 Å²	8	48 Å²	48	5%	0.052	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	124.9	176.8	31.2	-33.1	0	0	0	108.9	L98 F139 R141 L144 I145 H162	L98-P100 WeakPolarHBondContact O-CD 3.49Å; P100-F139 HydrophobicContact CB-CE1 4.46Å; P100-F139 HydrophobicContact CB-CZ 3.89Å; P100-R141 HydrophobicContact CB-CB 4.47Å; P100-R141 HydrophobicContact CB-CG 3.97Å; P100-R141 HydrophobicContact CG-CG 3.82Å; P100-L144 HydrophobicContact CB-CB 4.32Å; P100-L144 HydrophobicContact CB-CD1 4.11Å; P100-I145 HydrophobicContact CB-CD1 4.4Å; P100-I145 HydrophobicContact CG-CD1 4.23Å; P100-H162 WeakPolarHBondContact CD-O 3.36Å
101	F	98.9	Very high	98	Very high	17 Å²	17	46.1 Å²	46.1	8%	0.075	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	136.7	-164.9	-171.1	-92.8	0	0	0	113.5	V99 R104 L108 V130 L131 N132 Q133 V164	V99-F101 PolarHBondContact O-N 3.02Å; F101-R104 HydrophobicContact CD2-CB 4.08Å; F101-R104 HydrophobicContact CE2-CB 3.56Å; F101-R104 VanDerWaalsContact CE2-O 3.32Å; F101-R104 WeakPolarHBondContact CE2-O 3.22Å; F101-R104 HydrophobicContact CZ-CB 4.2Å; F101-L108 HydrophobicContact CD2-CD1 4.39Å; F101-L108 HydrophobicContact CE2-CB 3.82Å; F101-L108 HydrophobicContact CE2-CD1 4.22Å; F101-L108 HydrophobicContact CE2-CD2 4.03Å; F101-L108 HydrophobicContact CE2-CG 4.25Å; F101-L108 HydrophobicContact CZ-CB 4.3Å; F101-L108 HydrophobicContact CZ-CD2 4.03Å; F101-V130 HydrophobicContact CB-CG1 3.6Å; F101-V130 HydrophobicContact CD1-CG1 3.82Å; F101-V130 HydrophobicContact CD2-CG1 3.95Å; F101-V130 HydrophobicContact CE1-CG1 4.5Å; F101-V130 HydrophobicContact CG-CG1 3.51Å; F101-L131 PolarHBondContact N-O 3.48Å; F101-L131 VanDerWaalsContact O-O 3.14Å; F101-N132 HydrophobicContact CD1-CB 4.13Å; F101-N132 WeakPolarHBondContact CD1-OD1 3.48Å; F101-N132 WeakPolarHBondContact O-CA 3.45Å; F101-Q133 PolarHBondContact O-N 3.35Å; F101-V164 HydrophobicContact CD2-CG2 4.34Å; F101-V164 HydrophobicContact CE2-CG2 4.47Å
102	R	98.6	Very high	98.3	Very high	48 Å²	48	44.2 Å²	44.2	18%	0.181	21%	0.214	C	C	.	.	S	Bend	trans	-161.8	124.4	161.7	179	-179.9	-72.5	166.5	-9.3	108.5	R104 Q133 D135 F137 F139	R102-R104 VanDerWaalsContact C-N 3.34Å; R102-R104 PolarHBondContact O-N 3.03Å; R102-R104 PolarHBondContact O-NH1 2.67Å; R102-Q133 PolarHBondContact NE-O 2.82Å; R102-Q133 PolarHBondContact NH2-O 3.36Å; R102-D135 PolarHBondContact NH2-O 2.92Å; R102-D135 IonicContact NH2-OD1 2.82Å; R102-D135 PolarHBondContact NH2-OD1 3.38Å; R102-F137 PolarHBondContact NH1-O 3.07Å; R102-F137 PolarHBondContact NH2-O 3.07Å; R102-F139 HydrophobicContact CB-CD2 3.79Å; R102-F139 HydrophobicContact CB-CE2 3.85Å
103	E	97.9	Very high	98.5	Very high	153 Å²	153	41.5 Å²	41.5	72%	0.715	20%	0.196	S	C	*	.	S	Bend	trans	50.2	48.5	173.1	-60.8	-179.7	160.4	0	0	113.8	R264	E103-R264 PolarHBondContact O-NH1 3.4Å
104	R	98.1	Very high	98.6	Very high	59 Å²	59	40 Å²	40	22%	0.223	19%	0.189	C	C	.	.			trans	-126.6	40.3	174.8	-66.6	-66.3	-179	-78	-4.3	111.7	F101 R102 E106 E107 L108 V164	F101-R104 HydrophobicContact CD2-CB 4.08Å; F101-R104 HydrophobicContact CE2-CB 3.56Å; F101-R104 VanDerWaalsContact CE2-O 3.32Å; F101-R104 WeakPolarHBondContact CE2-O 3.22Å; F101-R104 HydrophobicContact CZ-CB 4.2Å; R102-R104 VanDerWaalsContact C-N 3.34Å; R102-R104 PolarHBondContact O-N 3.03Å; R102-R104 PolarHBondContact O-NH1 2.67Å; R104-E106 VanDerWaalsContact C-N 3.33Å; R104-E106 PolarHBondContact O-N 3.45Å; R104-E107 WeakPolarHBondContact CA-OE2 3.37Å; R104-E107 HydrophobicContact CB-CB 4.37Å; R104-E107 WeakPolarHBondContact CD-OE1 3.48Å; R104-E107 PolarHBondContact O-N 3.18Å; R104-L108 PolarHBondContact O-N 3.43Å; R104-V164 HydrophobicContact CB-CG1 3.73Å; R104-V164 HydrophobicContact CG-CG1 3.98Å
105	F	97.6	Very high	98.6	Very high	129 Å²	129	37.3 Å²	37.3	57%	0.566	18%	0.179	S	C	*	.	H	α-helix	trans	-61.3	-40.5	-170.4	-176.7	-106.3	0	0	0	112.4	E107 L108 L109	F105-E107 PolarHBondContact O-N 3.08Å; F105-L108 WeakPolarHBondContact O-CB 3.31Å; F105-L108 PolarHBondContact O-N 3.4Å; F105-L109 HydrophobicContact CD1-CD1 4.05Å; F105-L109 HydrophobicContact CD1-CG 4.28Å; F105-L109 HydrophobicContact CE1-CD1 3.61Å; F105-L109 HydrophobicContact CE1-CD2 4.17Å; F105-L109 HydrophobicContact CE1-CG 3.95Å; F105-L109 HydrophobicContact CE2-CD2 4.29Å; F105-L109 HydrophobicContact CZ-CD1 4.15Å; F105-L109 HydrophobicContact CZ-CD2 3.83Å; F105-L109 HydrophobicContact CZ-CG 4.09Å; F105-L109 WeakPolarHBondContact O-CG 3.44Å; F105-L109 PolarHBondContact O-N 3.35Å
106	E	98.3	Very high	98.6	Very high	113 Å²	113	38.9 Å²	38.9	53%	0.528	19%	0.186	S	C	.	.	H	α-helix	trans	-61.7	-44.3	177.9	-64.5	163.2	143.7	0	0	111.5	R104 L108 L109 R264	R104-E106 VanDerWaalsContact C-N 3.33Å; R104-E106 PolarHBondContact O-N 3.45Å; E106-L108 VanDerWaalsContact C-N 3.35Å; E106-L109 PolarHBondContact O-N 2.88Å; E106-R264 IonicContact OE2-CZ 3.63Å; E106-R264 IonicContact OE2-NH2 3.44Å; E106-R264 PolarHBondContact OE2-NH2 2.77Å
107	E	98.7	Very high	98.6	Very high	13 Å²	13	46.3 Å²	46.3	6%	0.061	22%	0.215	C	C	.	.	H	α-helix	trans	-65.4	-40.2	175.6	-60.7	87.4	162.1	0	0	110.9	R104 F105 L109 V110 F111 V164 D165 L258 R264	R104-E107 WeakPolarHBondContact CA-OE2 3.37Å; R104-E107 HydrophobicContact CB-CB 4.37Å; R104-E107 WeakPolarHBondContact CD-OE1 3.48Å; R104-E107 PolarHBondContact O-N 3.18Å; F105-E107 PolarHBondContact O-N 3.08Å; E107-L109 VanDerWaalsContact C-N 3.32Å; E107-L109 PolarHBondContact O-N 3.36Å; E107-V110 PolarHBondContact O-N 2.86Å; E107-V110 VanDerWaalsContact O-N 3.14Å; E107-F111 VanDerWaalsContact O-CB 3.22Å; E107-F111 WeakPolarHBondContact O-CB 3.24Å; E107-F111 PolarHBondContact O-N 2.87Å; E107-V164 HydrophobicContact CB-CG1 4.22Å; E107-V164 HydrophobicContact CB-CG2 4.33Å; E107-D165 HydrophobicContact CG-CB 4.13Å; E107-L258 HydrophobicContact CG-CB 4.3Å; E107-R264 IonicContact OE1-CZ 3.86Å; E107-R264 IonicContact OE1-NE 3.19Å; E107-R264 PolarHBondContact OE1-NE 2.79Å; E107-R264 IonicContact OE1-NH2 3.91Å; E107-R264 PolarHBondContact OE1-NH2 3.17Å; E107-R264 IonicContact OE2-CZ 3.64Å; E107-R264 IonicContact OE2-NE 3.89Å; E107-R264 IonicContact OE2-NH2 3.8Å; E107-R264 PolarHBondContact OE2-NH2 3.41Å
108	L	98.7	Very high	98.6	Very high	6 Å²	6	46.4 Å²	46.4	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-61.1	-40.2	177.8	-167.7	68.2	0	0	0	112.6	F101 R104 F105 E106 V110 F111 V112 V130 V164 L300	F101-L108 HydrophobicContact CD2-CD1 4.39Å; F101-L108 HydrophobicContact CE2-CB 3.82Å; F101-L108 HydrophobicContact CE2-CD1 4.22Å; F101-L108 HydrophobicContact CE2-CD2 4.03Å; F101-L108 HydrophobicContact CE2-CG 4.25Å; F101-L108 HydrophobicContact CZ-CB 4.3Å; F101-L108 HydrophobicContact CZ-CD2 4.03Å; R104-L108 PolarHBondContact O-N 3.43Å; F105-L108 WeakPolarHBondContact O-CB 3.31Å; F105-L108 PolarHBondContact O-N 3.4Å; E106-L108 VanDerWaalsContact C-N 3.35Å; L108-V110 PolarHBondContact O-N 3.14Å; L108-F111 PolarHBondContact O-N 2.81Å; L108-V112 HydrophobicContact CD1-CG2 3.7Å; L108-V112 HydrophobicContact CG-CG2 3.97Å; L108-V112 PolarHBondContact O-N 3.07Å; L108-V112 VanDerWaalsContact O-N 3.1Å; L108-V130 HydrophobicContact CD1-CG1 4.25Å; L108-V130 HydrophobicContact CD1-CG2 3.71Å; L108-V130 HydrophobicContact CD2-CG1 4.31Å; L108-V130 HydrophobicContact CD2-CG2 4.38Å; L108-V164 HydrophobicContact CB-CG2 4.32Å; L108-V164 HydrophobicContact CD1-CG2 3.97Å; L108-L300 HydrophobicContact CD2-CD2 4.35Å
109	L	98.6	Very high	98.5	Very high	80 Å²	80	46.4 Å²	46.4	42%	0.419	22%	0.215	S	C	.	.	H	α-helix	trans	-59.9	-30.5	177.9	-72.8	-178.9	0	0	0	112.5	F105 E106 E107 P113 V302	F105-L109 HydrophobicContact CD1-CD1 4.05Å; F105-L109 HydrophobicContact CD1-CG 4.28Å; F105-L109 HydrophobicContact CE1-CD1 3.61Å; F105-L109 HydrophobicContact CE1-CD2 4.17Å; F105-L109 HydrophobicContact CE1-CG 3.95Å; F105-L109 HydrophobicContact CE2-CD2 4.29Å; F105-L109 HydrophobicContact CZ-CD1 4.15Å; F105-L109 HydrophobicContact CZ-CD2 3.83Å; F105-L109 HydrophobicContact CZ-CG 4.09Å; F105-L109 WeakPolarHBondContact O-CG 3.44Å; F105-L109 PolarHBondContact O-N 3.35Å; E106-L109 PolarHBondContact O-N 2.88Å; E107-L109 VanDerWaalsContact C-N 3.32Å; E107-L109 PolarHBondContact O-N 3.36Å; L109-P113 WeakPolarHBondContact O-CD 3.36Å; L109-P113 VanDerWaalsContact O-CG 3.32Å; L109-P113 WeakPolarHBondContact O-CG 3.39Å; L109-V302 HydrophobicContact CD2-CG1 3.9Å; L109-V302 WeakPolarHBondContact O-CG1 3.08Å
110	V	98.8	Very high	98.4	Very high	70 Å²	70	47.6 Å²	47.6	42%	0.424	22%	0.223	S	C	.	.	H	α-helix	trans	-87.1	-42.9	174.8	-174.2	0	0	0	0	110.9	E107 L108 H114 L167 L258	E107-V110 PolarHBondContact O-N 2.86Å; E107-V110 VanDerWaalsContact O-N 3.14Å; L108-V110 PolarHBondContact O-N 3.14Å; V110-H114 WeakPolarHBondContact O-CB 3.36Å; V110-H114 PolarHBondContact O-N 3.26Å; V110-H114 VanDerWaalsContact O-N 3.14Å; V110-L167 HydrophobicContact CG1-CD1 3.7Å; V110-L258 HydrophobicContact CB-CD1 4.11Å; V110-L258 HydrophobicContact CG1-CD1 4.02Å; V110-L258 HydrophobicContact CG2-CD1 4.41Å
111	F	98.9	Very high	98.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.5	-52.5	-173.2	179.8	-91.1	0	0	0	113.3	V97 V99 E107 L108 H114 M115 I128 H162 V164 L167	V97-F111 HydrophobicContact CG1-CE1 4.46Å; V97-F111 HydrophobicContact CG1-CZ 4.16Å; V99-F111 HydrophobicContact CG1-CE1 4.38Å; V99-F111 HydrophobicContact CG2-CD1 4.45Å; V99-F111 HydrophobicContact CG2-CE1 3.48Å; V99-F111 VanDerWaalsContact CG2-CE1 3.48Å; V99-F111 HydrophobicContact CG2-CZ 3.7Å; E107-F111 VanDerWaalsContact O-CB 3.22Å; E107-F111 WeakPolarHBondContact O-CB 3.24Å; E107-F111 PolarHBondContact O-N 2.87Å; L108-F111 PolarHBondContact O-N 2.81Å; F111-H114 PolarHBondContact O-N 2.81Å; F111-M115 HydrophobicContact CD1-CG 4.15Å; F111-M115 HydrophobicContact CD2-CG 3.89Å; F111-M115 HydrophobicContact CE1-CB 4.31Å; F111-M115 HydrophobicContact CE1-CG 3.77Å; F111-M115 HydrophobicContact CE2-CG 3.52Å; F111-M115 HydrophobicContact CE2-SD 4.31Å; F111-M115 HydrophobicContact CG-CG 4.21Å; F111-M115 HydrophobicContact CZ-CB 4.41Å; F111-M115 HydrophobicContact CZ-CG 3.47Å; F111-M115 VanDerWaalsContact CZ-CG 3.47Å; F111-M115 WeakPolarHBondContact O-CB 3.45Å; F111-M115 WeakPolarHBondContact O-CG 3.48Å; F111-M115 PolarHBondContact O-N 3.39Å; F111-I128 HydrophobicContact CE1-CG2 4.16Å; F111-H162 AromaticContact CE2-CE1 3.49Å; F111-H162 VanDerWaalsContact CE2-CE1 3.49Å; F111-H162 WeakPolarHBondContact CE2-CE1 3.29Å; F111-H162 AromaticContact CE2-ND1 3.34Å; F111-H162 VanDerWaalsContact CE2-ND1 3.34Å; F111-H162 WeakPolarHBondContact CE2-ND1 3.29Å; F111-H162 HydrophobicContact CZ-CB 4.45Å; F111-H162 AromaticContact CZ-CG 3.99Å; F111-H162 AromaticContact CZ-ND1 3.66Å; F111-V164 HydrophobicContact CB-CG2 3.89Å; F111-V164 HydrophobicContact CD1-CG2 4.36Å; F111-V164 HydrophobicContact CD2-CG2 4.27Å; F111-V164 WeakPolarHBondContact CD2-O 3.42Å; F111-V164 HydrophobicContact CG-CG2 3.92Å; F111-L167 HydrophobicContact CB-CD2 4.3Å; F111-L167 HydrophobicContact CD2-CD2 3.7Å; F111-L167 HydrophobicContact CG-CD2 4.42Å
112	V	98.8	Very high	98.3	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.2	-56.1	-172.4	174.5	0	0	0	0	111.6	L108 H114 H116 I128 V302 A305 C307	L108-V112 HydrophobicContact CD1-CG2 3.7Å; L108-V112 HydrophobicContact CG-CG2 3.97Å; L108-V112 PolarHBondContact O-N 3.07Å; L108-V112 VanDerWaalsContact O-N 3.1Å; V112-H114 VanDerWaalsContact C-N 3.33Å; V112-H114 PolarHBondContact O-N 2.78Å; V112-H116 WeakPolarHBondContact O-CB 3.48Å; V112-H116 PolarHBondContact O-N 2.61Å; V112-I128 HydrophobicContact CG1-CD1 4.34Å; V112-V302 HydrophobicContact CB-CB 3.97Å; V112-V302 HydrophobicContact CB-CG1 4.45Å; V112-V302 HydrophobicContact CB-CG2 4.16Å; V112-V302 HydrophobicContact CG1-CB 3.95Å; V112-V302 HydrophobicContact CG1-CG2 4.23Å; V112-V302 HydrophobicContact CG2-CG2 4.3Å; V112-A305 HydrophobicContact CG1-CB 3.86Å; V112-C307 HydrophobicContact CG1-CB 4.22Å; V112-C307 HydrophobicContact CG2-CB 4.42Å
113	P	98.6	Very high	98.2	Very high	44 Å²	44	57.6 Å²	57.6	29%	0.286	26%	0.264	S	S	.	.	H	α-helix	trans	-66.4	-32.7	177.3	25.6	-34.4	0	0	0	113	L109 R117 V302 A305	L109-P113 WeakPolarHBondContact O-CD 3.36Å; L109-P113 VanDerWaalsContact O-CG 3.32Å; L109-P113 WeakPolarHBondContact O-CG 3.39Å; P113-R117 WeakPolarHBondContact O-CB 3.37Å; P113-R117 PolarHBondContact O-N 2.87Å; P113-V302 HydrophobicContact CG-CG1 4.27Å; P113-A305 HydrophobicContact CB-CB 4.29Å
114	H	98.9	Very high	98.2	Very high	43 Å²	43	51.1 Å²	51.1	20%	0.199	23%	0.234	C	C	.	.	H	α-helix	trans	-62.7	-53.2	176.6	179.1	89.1	0	0	0	111.7	V110 F111 V112 R117 F118 L167 P168	V110-H114 WeakPolarHBondContact O-CB 3.36Å; V110-H114 PolarHBondContact O-N 3.26Å; V110-H114 VanDerWaalsContact O-N 3.14Å; F111-H114 PolarHBondContact O-N 2.81Å; V112-H114 VanDerWaalsContact C-N 3.33Å; V112-H114 PolarHBondContact O-N 2.78Å; H114-R117 PolarHBondContact O-N 3.45Å; H114-F118 VanDerWaalsContact O-CB 3.28Å; H114-F118 WeakPolarHBondContact O-CB 3.32Å; H114-F118 PolarHBondContact O-N 3.36Å; H114-L167 HydrophobicContact CB-CD2 4.36Å; H114-P168 PolarHBondContact CE1-O 2.73Å; H114-P168 VanDerWaalsContact CE1-O 3.29Å; H114-P168 PolarHBondContact NE2-O 3.39Å
115	M	98.8	Very high	98.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.7	-40.8	-178.1	-73.1	-51.8	-61.4	0	0	111.8	F111 R117 F118 L119 I128 H162 P168 Y175	F111-M115 HydrophobicContact CD1-CG 4.15Å; F111-M115 HydrophobicContact CD2-CG 3.89Å; F111-M115 HydrophobicContact CE1-CB 4.31Å; F111-M115 HydrophobicContact CE1-CG 3.77Å; F111-M115 HydrophobicContact CE2-CG 3.52Å; F111-M115 HydrophobicContact CE2-SD 4.31Å; F111-M115 HydrophobicContact CG-CG 4.21Å; F111-M115 HydrophobicContact CZ-CB 4.41Å; F111-M115 HydrophobicContact CZ-CG 3.47Å; F111-M115 VanDerWaalsContact CZ-CG 3.47Å; F111-M115 WeakPolarHBondContact O-CB 3.45Å; F111-M115 WeakPolarHBondContact O-CG 3.48Å; F111-M115 PolarHBondContact O-N 3.39Å; M115-R117 PolarHBondContact O-N 3.38Å; M115-F118 HydrophobicContact CE-CD1 4.48Å; M115-F118 PolarHBondContact O-N 3.04Å; M115-L119 HydrophobicContact CE-CD1 4.13Å; M115-L119 HydrophobicContact CE-CG 4.2Å; M115-L119 WeakPolarHBondContact O-CB 3.45Å; M115-L119 WeakPolarHBondContact O-CG 3.31Å; M115-L119 PolarHBondContact O-N 3.3Å; M115-I128 HydrophobicContact CB-CD1 4.13Å; M115-H162 VanDerWaalsContact CE-NE2 3.33Å; M115-H162 WeakPolarHBondContact CE-NE2 3.39Å; M115-P168 HydrophobicContact CE-CG 4.18Å; M115-P168 WeakPolarHBondContact SD-CD 3.4Å; M115-P168 HydrophobicContact SD-CG 3.67Å; M115-Y175 HydrophobicContact CE-CE1 3.98Å
116	H	98.1	Very high	98.1	Very high	32 Å²	32	43.4 Å²	43.4	15%	0.148	20%	0.202	C	C	.	.	H	α-helix	trans	-57	-52.5	175.4	-176.9	61.6	0	0	0	111.3	E85 V112 F118 L119 S120 H126 A305	E85-H116 IonicContact OE1-CE1 3.67Å; E85-H116 PolarHBondContact OE1-CE1 3.47Å; E85-H116 VanDerWaalsContact OE1-CE1 3.29Å; E85-H116 IonicContact OE1-NE2 2.78Å; E85-H116 PolarHBondContact OE1-NE2 3.31Å; E85-H116 IonicContact OE2-CE1 3.42Å; E85-H116 PolarHBondContact OE2-CE1 2.86Å; E85-H116 IonicContact OE2-NE2 3.91Å; V112-H116 WeakPolarHBondContact O-CB 3.48Å; V112-H116 PolarHBondContact O-N 2.61Å; H116-F118 VanDerWaalsContact C-N 3.35Å; H116-F118 PolarHBondContact O-N 3.04Å; H116-L119 PolarHBondContact O-N 2.58Å; H116-S120 WeakPolarHBondContact O-CB 3.4Å; H116-S120 PolarHBondContact O-N 2.9Å; H116-S120 PolarHBondContact O-OG 3.12Å; H116-H126 AromaticContact CG-NE2 3.91Å; H116-H126 AromaticContact ND1-CE1 3.64Å; H116-H126 AromaticContact ND1-NE2 3.07Å; H116-H126 PolarHBondContact ND1-NE2 2.93Å; H116-A305 HydrophobicContact CB-CB 3.69Å
117	R	98.3	Very high	98.1	Very high	157 Å²	157	38.6 Å²	38.6	59%	0.592	18%	0.18	S	C	*	.	H	α-helix	trans	-60.6	-41.1	174.9	179.3	-177.1	170.3	-145.9	-2.6	112.9	P113 H114 M115 R121	P113-R117 WeakPolarHBondContact O-CB 3.37Å; P113-R117 PolarHBondContact O-N 2.87Å; H114-R117 PolarHBondContact O-N 3.45Å; M115-R117 PolarHBondContact O-N 3.38Å; R117-R121 WeakPolarHBondContact O-CB 3.35Å; R117-R121 VanDerWaalsContact O-CG 3.31Å; R117-R121 WeakPolarHBondContact O-CG 3.15Å; R117-R121 PolarHBondContact O-N 3.31Å; R117-R121 PolarHBondContact O-NE 2.82Å
118	F	98.8	Very high	98.1	Very high	2 Å²	2	38 Å²	38	1%	0.009	18%	0.177	C	C	.	.	H	α-helix	trans	-64.1	-47	-178.4	-177.9	-92.5	0	0	0	111.4	H114 M115 H116 K122 P168 N170 E171 Y175	H114-F118 VanDerWaalsContact O-CB 3.28Å; H114-F118 WeakPolarHBondContact O-CB 3.32Å; H114-F118 PolarHBondContact O-N 3.36Å; M115-F118 HydrophobicContact CE-CD1 4.48Å; M115-F118 PolarHBondContact O-N 3.04Å; H116-F118 VanDerWaalsContact C-N 3.35Å; H116-F118 PolarHBondContact O-N 3.04Å; F118-K122 HydrophobicContact CD1-CD 3.89Å; F118-K122 HydrophobicContact CE1-CD 3.4Å; F118-K122 VanDerWaalsContact CE1-CD 3.4Å; F118-K122 HydrophobicContact CE2-CD 4.41Å; F118-K122 HydrophobicContact CZ-CD 3.69Å; F118-K122 WeakPolarHBondContact O-CG 3.28Å; F118-K122 PolarHBondContact O-N 3.11Å; F118-P168 HydrophobicContact CD1-CB 4.5Å; F118-P168 HydrophobicContact CD1-CG 3.79Å; F118-P168 HydrophobicContact CD2-CB 4.35Å; F118-P168 HydrophobicContact CD2-CG 4.03Å; F118-P168 HydrophobicContact CE1-CB 4.04Å; F118-P168 HydrophobicContact CE1-CG 3.79Å; F118-P168 HydrophobicContact CE2-CB 3.88Å; F118-P168 HydrophobicContact CE2-CG 4.03Å; F118-P168 HydrophobicContact CG-CG 3.92Å; F118-P168 HydrophobicContact CZ-CB 3.71Å; F118-P168 HydrophobicContact CZ-CG 3.92Å; F118-N170 WeakPolarHBondContact CZ-O 3.47Å; F118-E171 HydrophobicContact CE2-CG 4.18Å; F118-Y175 AromaticContact CE1-CD2 3.68Å; F118-Y175 HydrophobicContact CE1-CD2 3.68Å; F118-Y175 AromaticContact CE1-CE2 3.58Å; F118-Y175 HydrophobicContact CE1-CE2 3.58Å; F118-Y175 HydrophobicContact CE1-CG 4.37Å; F118-Y175 HydrophobicContact CZ-CD2 4.39Å; F118-Y175 HydrophobicContact CZ-CE2 4.15Å
119	L	98.4	Very high	98.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-74.2	-39.3	-178.8	-65.5	172	0	0	0	112.3	L95 V97 M115 H116 R121 K122 K123 I124 H126 Y175	L95-L119 HydrophobicContact CD2-CD1 4.15Å; L95-L119 HydrophobicContact CD2-CD2 4.15Å; V97-L119 HydrophobicContact CG2-CD1 3.78Å; M115-L119 HydrophobicContact CE-CD1 4.13Å; M115-L119 HydrophobicContact CE-CG 4.2Å; M115-L119 WeakPolarHBondContact O-CB 3.45Å; M115-L119 WeakPolarHBondContact O-CG 3.31Å; M115-L119 PolarHBondContact O-N 3.3Å; H116-L119 PolarHBondContact O-N 2.58Å; L119-R121 PolarHBondContact O-N 3.11Å; L119-K122 CarbonylContact O-C 3.55Å; L119-K122 WeakPolarHBondContact O-CA 3.42Å; L119-K122 PolarHBondContact O-N 3.15Å; L119-K122 VanDerWaalsContact O-N 3.07Å; L119-K123 PolarHBondContact O-N 3.08Å; L119-K123 VanDerWaalsContact O-N 3.07Å; L119-I124 HydrophobicContact CB-CB 4.4Å; L119-I124 HydrophobicContact CD2-CB 4.39Å; L119-I124 HydrophobicContact CD2-CD1 3.97Å; L119-I124 HydrophobicContact CD2-CG2 4.38Å; L119-I124 PolarHBondContact O-N 3.25Å; L119-I124 VanDerWaalsContact O-N 3.09Å; L119-H126 WeakPolarHBondContact CB-ND1 3.23Å; L119-H126 HydrophobicContact CD1-CB 3.87Å; L119-Y175 HydrophobicContact CD2-CD1 3.83Å; L119-Y175 HydrophobicContact CD2-CG 4Å
120	S	96.9	Very high	98.2	Very high	25 Å²	25	34 Å²	34	18%	0.175	16%	0.156	C	C	.	.	H	α-helix	trans	-63.5	-39.5	176.7	-60.4	0	0	0	0	112.2	E85 H116 K122 K123 H126	E85-S120 PolarHBondContact OE2-OG 2.97Å; H116-S120 WeakPolarHBondContact O-CB 3.4Å; H116-S120 PolarHBondContact O-N 2.9Å; H116-S120 PolarHBondContact O-OG 3.12Å; S120-K122 PolarHBondContact O-N 3.11Å; S120-K123 PolarHBondContact O-N 3.34Å; S120-H126 PolarHBondContact OG-CE1 2.86Å
121	R	97.1	Very high	98.2	Very high	113 Å²	113	30.7 Å²	30.7	43%	0.426	14%	0.136	S	C	.	.	H	α-helix	trans	-63.3	-30	173.8	-74.5	-173.4	-62	157.3	12.5	112.9	R117 L119 K123 E171	R117-R121 WeakPolarHBondContact O-CB 3.35Å; R117-R121 VanDerWaalsContact O-CG 3.31Å; R117-R121 WeakPolarHBondContact O-CG 3.15Å; R117-R121 PolarHBondContact O-N 3.31Å; R117-R121 PolarHBondContact O-NE 2.82Å; L119-R121 PolarHBondContact O-N 3.11Å; R121-K123 VanDerWaalsContact C-N 3.27Å; R121-E171 IonicContact CZ-OE1 3.26Å; R121-E171 IonicContact NE-OE1 3.77Å; R121-E171 IonicContact NH1-OE1 3.04Å; R121-E171 PolarHBondContact NH1-OE1 3.12Å; R121-E171 IonicContact NH2-OE1 2.61Å; R121-E171 PolarHBondContact NH2-OE1 2.8Å
122	K	97.1	Very high	98.2	Very high	54 Å²	54	32.2 Å²	32.2	24%	0.235	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	1.3	174.9	-66	173.9	66.7	65.6	0	113	F118 L119 S120 I124 E171 L173	F118-K122 HydrophobicContact CD1-CD 3.89Å; F118-K122 HydrophobicContact CE1-CD 3.4Å; F118-K122 VanDerWaalsContact CE1-CD 3.4Å; F118-K122 HydrophobicContact CE2-CD 4.41Å; F118-K122 HydrophobicContact CZ-CD 3.69Å; F118-K122 WeakPolarHBondContact O-CG 3.28Å; F118-K122 PolarHBondContact O-N 3.11Å; L119-K122 CarbonylContact O-C 3.55Å; L119-K122 WeakPolarHBondContact O-CA 3.42Å; L119-K122 PolarHBondContact O-N 3.15Å; L119-K122 VanDerWaalsContact O-N 3.07Å; S120-K122 PolarHBondContact O-N 3.11Å; K122-I124 VanDerWaalsContact C-N 3.3Å; K122-I124 HydrophobicContact CB-CD1 3.88Å; K122-I124 HydrophobicContact CB-CG1 4.15Å; K122-I124 PolarHBondContact O-N 2.83Å; K122-E171 PolarHBondContact NZ-O 3.38Å; K122-L173 WeakPolarHBondContact CE-O 3.22Å; K122-L173 PolarHBondContact NZ-O 3.39Å
123	K	97.1	Very high	98.2	Very high	117 Å²	117	32.3 Å²	32.3	51%	0.509	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	41.7	-179.7	-56.1	-174	178.3	-169.8	0	113.1	W90 L119 S120 R121	W90-K123 HydrophobicContact CB-CB 4.27Å; W90-K123 WeakPolarHBondContact CB-O 3.1Å; W90-K123 VanDerWaalsContact CD2-CA 3.43Å; W90-K123 HydrophobicContact CD2-CB 3.77Å; W90-K123 HydrophobicContact CD2-CG 4.4Å; W90-K123 HydrophobicContact CE3-CB 4.47Å; W90-K123 HydrophobicContact CG-CB 3.62Å; W90-K123 HydrophobicContact CG-CG 4.3Å; L119-K123 PolarHBondContact O-N 3.08Å; L119-K123 VanDerWaalsContact O-N 3.07Å; S120-K123 PolarHBondContact O-N 3.34Å; R121-K123 VanDerWaalsContact C-N 3.27Å
124	I	97.3	Very high	98.2	Very high	17 Å²	17	32.3 Å²	32.3	9%	0.087	14%	0.144	C	C	.	.			trans	-102.4	118.6	177.9	-65.9	168.5	0	0	0	108.3	W90 L95 L119 K122 H126 Y158 Y175	W90-I124 WeakPolarHBondContact CZ3-O 3.28Å; L95-I124 HydrophobicContact CB-CG2 4Å; L95-I124 HydrophobicContact CD2-CG2 4.02Å; L119-I124 HydrophobicContact CB-CB 4.4Å; L119-I124 HydrophobicContact CD2-CB 4.39Å; L119-I124 HydrophobicContact CD2-CD1 3.97Å; L119-I124 HydrophobicContact CD2-CG2 4.38Å; L119-I124 PolarHBondContact O-N 3.25Å; L119-I124 VanDerWaalsContact O-N 3.09Å; K122-I124 VanDerWaalsContact C-N 3.3Å; K122-I124 HydrophobicContact CB-CD1 3.88Å; K122-I124 HydrophobicContact CB-CG1 4.15Å; K122-I124 PolarHBondContact O-N 2.83Å; I124-H126 PolarHBondContact O-N 3.21Å; I124-H126 PolarHBondContact O-ND1 3.38Å; I124-Y158 VanDerWaalsContact CG2-OH 3.31Å; I124-Y158 WeakPolarHBondContact CG2-OH 3.22Å; I124-Y175 VanDerWaalsContact CD1-CB 3.45Å
125	Q	97.2	Very high	98.2	Very high	16 Å²	16	30.6 Å²	30.6	8%	0.075	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	123	172.3	-63.2	-175.4	-15.9	0	0	108.4	W90 R94 L95	W90-Q125 HydrophobicContact CB-CG 4.28Å; W90-Q125 HydrophobicContact CE3-CG 4.09Å; R94-Q125 HydrophobicContact CG-CB 4.07Å; R94-Q125 VanDerWaalsContact CG-OE1 3.25Å; L95-Q125 WeakPolarHBondContact CB-O 3.44Å; L95-Q125 PolarHBondContact N-O 3.19Å
126	H	97.8	Very high	98.1	Very high	9 Å²	9	39.5 Å²	39.5	4%	0.042	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	155.2	-172.3	65.2	-80.3	0	0	0	113.2	L95 H116 L119 S120 I124	L95-H126 HydrophobicContact CB-CB 4.11Å; L95-H126 HydrophobicContact CG-CB 4.49Å; L95-H126 CarbonylContact O-C 3.6Å; L95-H126 WeakPolarHBondContact O-CA 3.33Å; H116-H126 AromaticContact CG-NE2 3.91Å; H116-H126 AromaticContact ND1-CE1 3.64Å; H116-H126 AromaticContact ND1-NE2 3.07Å; H116-H126 PolarHBondContact ND1-NE2 2.93Å; L119-H126 WeakPolarHBondContact CB-ND1 3.23Å; L119-H126 HydrophobicContact CD1-CB 3.87Å; S120-H126 PolarHBondContact OG-CE1 2.86Å; I124-H126 PolarHBondContact O-N 3.21Å; I124-H126 PolarHBondContact O-ND1 3.38Å
127	H	98.4	Very high	98.2	Very high	13 Å²	13	39.9 Å²	39.9	6%	0.06	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	140.6	166	-167.3	74.6	0	0	0	109.8	W84 L95 V97 Y129 T308	W84-H127 HydrophobicContact CE3-CB 4.05Å; W84-H127 HydrophobicContact CH2-CB 3.9Å; W84-H127 HydrophobicContact CZ3-CB 3.51Å; L95-H127 PolarHBondContact O-N 2.88Å; V97-H127 PolarHBondContact N-O 3.07Å; H127-Y129 HydrophobicContact CB-CE2 4.05Å; H127-Y129 AromaticContact CD2-CD2 3.88Å; H127-Y129 AromaticContact CD2-CE1 3.79Å; H127-Y129 AromaticContact CD2-CE2 3.52Å; H127-Y129 AromaticContact CD2-CZ 3.46Å; H127-Y129 VanDerWaalsContact CD2-CZ 3.46Å; H127-T308 PolarHBondContact NE2-OG1 3.38Å
128	I	98.8	Very high	98.2	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	120.5	-178.4	-59.1	172	0	0	0	109.4	V97 V99 F111 V112 M115 V130 C307 T308	V97-I128 HydrophobicContact CB-CG1 4.14Å; V97-I128 HydrophobicContact CG2-CG1 4.36Å; V99-I128 HydrophobicContact CG2-CG2 3.98Å; F111-I128 HydrophobicContact CE1-CG2 4.16Å; V112-I128 HydrophobicContact CG1-CD1 4.34Å; M115-I128 HydrophobicContact CB-CD1 4.13Å; I128-V130 HydrophobicContact CG2-CG2 4.49Å; I128-C307 HydrophobicContact CB-CB 3.79Å; I128-C307 HydrophobicContact CG2-CB 3.95Å; I128-C307 CarbonylContact O-C 3.48Å; I128-C307 WeakPolarHBondContact O-CA 3.34Å; I128-C307 WeakPolarHBondContact O-CB 3.32Å; I128-T308 PolarHBondContact O-N 3.45Å
129	Y	98.8	Very high	98.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	114.6	173.9	-62.5	-93.4	0	0	0	109.8	E82 A96 V97 L98 V99 H127 S153 T308 L310	E82-Y129 WeakPolarHBondContact OE1-CE1 3.45Å; E82-Y129 PolarHBondContact OE1-OH 3.23Å; E82-Y129 PolarHBondContact OE2-OH 3.37Å; A96-Y129 HydrophobicContact CB-CD2 3.93Å; A96-Y129 HydrophobicContact CB-CE2 3.69Å; V97-Y129 PolarHBondContact O-N 2.78Å; L98-Y129 HydrophobicContact CD2-CD2 4.04Å; L98-Y129 HydrophobicContact CD2-CG 4.31Å; V99-Y129 WeakPolarHBondContact CB-O 3.13Å; V99-Y129 PolarHBondContact N-O 2.95Å; H127-Y129 HydrophobicContact CB-CE2 4.05Å; H127-Y129 AromaticContact CD2-CD2 3.88Å; H127-Y129 AromaticContact CD2-CE1 3.79Å; H127-Y129 AromaticContact CD2-CE2 3.52Å; H127-Y129 AromaticContact CD2-CZ 3.46Å; H127-Y129 VanDerWaalsContact CD2-CZ 3.46Å; Y129-S153 PolarHBondContact OH-N 3.12Å; Y129-T308 CarbonylContact C-O 3.4Å; Y129-T308 WeakPolarHBondContact CA-O 3.49Å; Y129-T308 HydrophobicContact CD1-CG2 4.5Å; Y129-L310 HydrophobicContact CD1-CD1 4.26Å
130	V	98.9	Very high	98.2	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	108.9	173	-175.4	0	0	0	0	108.2	F101 L108 I128 N132 C307 T308 V309 L310	F101-V130 HydrophobicContact CB-CG1 3.6Å; F101-V130 HydrophobicContact CD1-CG1 3.82Å; F101-V130 HydrophobicContact CD2-CG1 3.95Å; F101-V130 HydrophobicContact CE1-CG1 4.5Å; F101-V130 HydrophobicContact CG-CG1 3.51Å; L108-V130 HydrophobicContact CD1-CG1 4.25Å; L108-V130 HydrophobicContact CD1-CG2 3.71Å; L108-V130 HydrophobicContact CD2-CG1 4.31Å; L108-V130 HydrophobicContact CD2-CG2 4.38Å; I128-V130 HydrophobicContact CG2-CG2 4.49Å; V130-N132 PolarHBondContact O-N 2.81Å; V130-C307 HydrophobicContact CG2-CB 4.44Å; V130-T308 PolarHBondContact N-O 2.93Å; V130-V309 HydrophobicContact CB-CB 4.45Å; V130-V309 HydrophobicContact CB-CG1 4.43Å; V130-V309 HydrophobicContact CB-CG2 4.11Å; V130-V309 HydrophobicContact CG1-CG1 4.47Å; V130-V309 HydrophobicContact CG2-CG2 4.41Å; V130-L310 PolarHBondContact O-N 3.35Å
131	L	98.9	Very high	98.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	79.1	-173.5	-49.7	173.9	0	0	0	108.5	L98 V99 F101 Q133 L144 I145 G148 L310 I312	L98-L131 HydrophobicContact CB-CD1 3.96Å; V99-L131 WeakPolarHBondContact O-CB 3.36Å; V99-L131 PolarHBondContact O-N 3.3Å; F101-L131 PolarHBondContact N-O 3.48Å; F101-L131 VanDerWaalsContact O-O 3.14Å; L131-Q133 PolarHBondContact O-N 2.81Å; L131-L144 HydrophobicContact CB-CB 4.17Å; L131-L144 HydrophobicContact CB-CD2 4.39Å; L131-L144 HydrophobicContact CD1-CB 4.49Å; L131-L144 WeakPolarHBondContact CD1-O 3.48Å; L131-I145 HydrophobicContact CD1-CD1 4.17Å; L131-G148 VanDerWaalsContact CD2-CA 3.42Å; L131-L310 HydrophobicContact CD2-CD1 3.95Å; L131-I312 HydrophobicContact CB-CD1 3.75Å; L131-I312 HydrophobicContact CD2-CD1 4.07Å
132	N	98.9	Very high	98.4	Very high	32 Å²	32	29.9 Å²	29.9	17%	0.171	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	107.6	-171.3	-176.1	33.4	0	0	0	111.1	F101 V130 V134 V309 L310 N311 I312	F101-N132 HydrophobicContact CD1-CB 4.13Å; F101-N132 WeakPolarHBondContact CD1-OD1 3.48Å; F101-N132 WeakPolarHBondContact O-CA 3.45Å; V130-N132 PolarHBondContact O-N 2.81Å; N132-V134 WeakPolarHBondContact ND2-CG1 3.37Å; N132-V134 PolarHBondContact O-N 3.01Å; N132-V309 HydrophobicContact CB-CG1 3.98Å; N132-L310 WeakPolarHBondContact CA-O 3.41Å; N132-L310 WeakPolarHBondContact CB-O 3.29Å; N132-L310 PolarHBondContact N-O 3Å; N132-N311 PolarHBondContact ND2-OD1 3.33Å; N132-I312 PolarHBondContact O-N 3.48Å
133	Q	98.9	Very high	98.5	Very high	3 Å²	3	27.4 Å²	27.4	1%	0.014	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	105.3	178.3	-160.6	-173.6	-28.7	0	0	110.9	F101 R102 L131 D135 R138 F139 L144 I312 L314	F101-Q133 PolarHBondContact O-N 3.35Å; R102-Q133 PolarHBondContact NE-O 2.82Å; R102-Q133 PolarHBondContact NH2-O 3.36Å; L131-Q133 PolarHBondContact O-N 2.81Å; Q133-D135 WeakPolarHBondContact CG-OD2 3.25Å; Q133-D135 PolarHBondContact NE2-OD1 2.87Å; Q133-D135 PolarHBondContact NE2-OD2 3.5Å; Q133-R138 PolarHBondContact NE2-O 3.42Å; Q133-F139 HydrophobicContact CB-CD2 4.43Å; Q133-F139 HydrophobicContact CB-CE2 4.49Å; Q133-L144 HydrophobicContact CB-CD1 3.88Å; Q133-L144 HydrophobicContact CB-CD2 3.8Å; Q133-L144 HydrophobicContact CB-CG 4.31Å; Q133-L144 HydrophobicContact CG-CD1 4.48Å; Q133-L144 HydrophobicContact CG-CD2 4.08Å; Q133-I312 WeakPolarHBondContact CA-O 3.26Å; Q133-L314 HydrophobicContact CG-CD1 4.08Å; Q133-L314 HydrophobicContact CG-CG 4.35Å
134	V	98.8	Very high	98.5	Very high	44 Å²	44	21.9 Å²	21.9	27%	0.267	10%	0.104	S	C	.	.			trans	-99.4	-8.7	-174.9	-66.7	0	0	0	0	114.1	N132 N311 I312 M313	N132-V134 WeakPolarHBondContact ND2-CG1 3.37Å; N132-V134 PolarHBondContact O-N 3.01Å; V134-N311 HydrophobicContact CG1-CB 3.89Å; V134-N311 HydrophobicContact CG2-CB 4.05Å; V134-I312 WeakPolarHBondContact CG2-O 3.18Å; V134-I312 PolarHBondContact N-O 2.89Å; V134-M313 HydrophobicContact CB-SD 4.45Å; V134-M313 HydrophobicContact CG2-CG 3.7Å; V134-M313 HydrophobicContact CG2-SD 3.72Å
135	D	98.6	Very high	98.6	Very high	7 Å²	7	21 Å²	21	4%	0.037	10%	0.1	C	C	.	.	S	Bend	trans	-66.3	169.3	169.1	62.2	74.1	0	0	0	112.2	R102 Q133 F137 M313 L314	R102-D135 PolarHBondContact NH2-O 2.92Å; R102-D135 IonicContact NH2-OD1 2.82Å; R102-D135 PolarHBondContact NH2-OD1 3.38Å; Q133-D135 WeakPolarHBondContact CG-OD2 3.25Å; Q133-D135 PolarHBondContact NE2-OD1 2.87Å; Q133-D135 PolarHBondContact NE2-OD2 3.5Å; D135-F137 HydrophobicContact CB-CD2 4.1Å; D135-F137 WeakPolarHBondContact OD1-CB 3.35Å; D135-F137 PolarHBondContact OD1-N 3.22Å; D135-M313 VanDerWaalsContact CA-SD 3.52Å; D135-M313 HydrophobicContact CB-CE 4.23Å; D135-M313 HydrophobicContact CB-SD 3.79Å; D135-M313 PolarHBondContact N-SD 3.26Å; D135-M313 VanDerWaalsContact N-SD 3.4Å; D135-L314 WeakPolarHBondContact OD2-CB 3.31Å; D135-L314 PolarHBondContact OD2-N 2.95Å
136	H	98	Very high	98.7	Very high	187 Å²	187	20.3 Å²	20.3	87%	0.866	10%	0.097	S	C	*	.	S	Bend	trans	-97.9	11.1	-179	-61.1	-43.1	0	0	0	113.9
137	F	98.6	Very high	98.8	Very high	39 Å²	39	19.9 Å²	19.9	17%	0.171	10%	0.095	C	C	.	.	S	Bend	trans	-74.9	168.3	173	-58.7	-57	0	0	0	110.5	R102 D135 W222 L314 C316 C324 T325	R102-F137 PolarHBondContact NH1-O 3.07Å; R102-F137 PolarHBondContact NH2-O 3.07Å; D135-F137 HydrophobicContact CB-CD2 4.1Å; D135-F137 WeakPolarHBondContact OD1-CB 3.35Å; D135-F137 PolarHBondContact OD1-N 3.22Å; F137-W222 HydrophobicContact CB-CE3 3.84Å; F137-W222 HydrophobicContact CB-CH2 4.22Å; F137-W222 HydrophobicContact CB-CZ3 3.48Å; F137-W222 VanDerWaalsContact CB-CZ3 3.48Å; F137-W222 HydrophobicContact CD2-CH2 4.16Å; F137-W222 HydrophobicContact CD2-CZ3 4.23Å; F137-W222 HydrophobicContact CG-CH2 4.4Å; F137-W222 HydrophobicContact CG-CZ3 4.14Å; F137-L314 WeakPolarHBondContact CD2-O 3.22Å; F137-L314 VanDerWaalsContact CE2-O 3.3Å; F137-L314 WeakPolarHBondContact CE2-O 3.33Å; F137-C316 HydrophobicContact CD1-CB 4.1Å; F137-C316 HydrophobicContact CD2-CB 4.01Å; F137-C316 HydrophobicContact CE1-CB 3.85Å; F137-C316 HydrophobicContact CE2-CB 3.73Å; F137-C316 HydrophobicContact CG-CB 4.19Å; F137-C316 HydrophobicContact CZ-CB 3.65Å; F137-C324 WeakPolarHBondContact CA-O 3.48Å; F137-C324 WeakPolarHBondContact CB-O 3.33Å; F137-C324 HydrophobicContact CD1-CB 4.32Å; F137-T325 HydrophobicContact CD1-CG2 3.61Å; F137-T325 HydrophobicContact CE1-CG2 3.78Å
138	R	98.6	Very high	98.8	Very high	4 Å²	4	19.2 Å²	19.2	2%	0.015	9%	0.092	C	C	.	.	P	Polyproline II helix	trans	-57.8	155.9	170.8	-61.8	173.1	76	-178	0.3	109.8	Q133 N140 W222 D267 K269 W323 C324 F326	Q133-R138 PolarHBondContact NE2-O 3.42Å; R138-N140 PolarHBondContact O-N 3.44Å; R138-W222 HydrophobicContact CB-CB 4.16Å; R138-W222 VanDerWaalsContact O-CE3 3.24Å; R138-D267 IonicContact CZ-OD1 3.23Å; R138-D267 IonicContact CZ-OD2 2.73Å; R138-D267 VanDerWaalsContact CZ-OD2 3.3Å; R138-D267 IonicContact NE-OD1 2.78Å; R138-D267 IonicContact NE-OD2 3.38Å; R138-D267 PolarHBondContact NE-OD2 2.83Å; R138-D267 PolarHBondContact NH2-O 3.11Å; R138-D267 IonicContact NH2-OD1 2.7Å; R138-D267 PolarHBondContact NH2-OD1 3.48Å; R138-D267 IonicContact NH2-OD2 3.66Å; R138-D267 PolarHBondContact NH2-OD2 2.79Å; R138-D267 VanDerWaalsContact NH2-OD2 3.09Å; R138-K269 PolarHBondContact NH1-O 3.38Å; R138-K269 PolarHBondContact NH2-O 2.82Å; R138-W323 WeakPolarHBondContact CD-O 3.34Å; R138-W323 PolarHBondContact NH1-O 3.32Å; R138-C324 WeakPolarHBondContact CG-O 3.32Å; R138-C324 PolarHBondContact N-O 2.77Å; R138-F326 HydrophobicContact CG-CD1 4.4Å; R138-F326 HydrophobicContact CG-CD2 4.39Å; R138-F326 HydrophobicContact CG-CE1 4Å; R138-F326 HydrophobicContact CG-CE2 3.99Å; R138-F326 HydrophobicContact CG-CZ 3.78Å
139	F	98.7	Very high	98.8	Very high	61 Å²	61	19.8 Å²	19.8	27%	0.268	9%	0.094	S	C	.	.	P	Polyproline II helix	trans	-64.2	131.6	-178.6	-173.7	-110.7	0	0	0	110.8	P100 R102 Q133 R141 L144 G223	P100-F139 HydrophobicContact CB-CE1 4.46Å; P100-F139 HydrophobicContact CB-CZ 3.89Å; R102-F139 HydrophobicContact CB-CD2 3.79Å; R102-F139 HydrophobicContact CB-CE2 3.85Å; Q133-F139 HydrophobicContact CB-CD2 4.43Å; Q133-F139 HydrophobicContact CB-CE2 4.49Å; F139-R141 HydrophobicContact CD1-CB 4.47Å; F139-R141 HydrophobicContact CE1-CB 3.97Å; F139-L144 HydrophobicContact CD2-CD1 4.16Å; F139-L144 HydrophobicContact CE2-CD1 3.42Å; F139-L144 VanDerWaalsContact CE2-CD1 3.42Å; F139-L144 HydrophobicContact CZ-CD1 3.75Å; F139-G223 PolarHBondContact O-N 3.45Å
140	N	98.8	Very high	98.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.113	C	C	.	.			trans	-125.4	85.7	-177.9	-169.3	-25.9	0	0	0	110.3	R138 A142 A143 L144 N219 F221 W222 L314	R138-N140 PolarHBondContact O-N 3.44Å; N140-A142 VanDerWaalsContact C-N 3.35Å; N140-A142 PolarHBondContact O-N 2.86Å; N140-A143 HydrophobicContact CB-CB 4.18Å; N140-A143 VanDerWaalsContact OD1-CB 3.29Å; N140-A143 WeakPolarHBondContact OD1-CB 3.26Å; N140-A143 PolarHBondContact OD1-N 2.86Å; N140-L144 VanDerWaalsContact O-CG 3.27Å; N140-L144 WeakPolarHBondContact O-CG 3.31Å; N140-L144 PolarHBondContact O-N 3.36Å; N140-L144 VanDerWaalsContact O-N 3.11Å; N140-N219 PolarHBondContact ND2-O 2.99Å; N140-F221 VanDerWaalsContact CG-O 3.3Å; N140-F221 PolarHBondContact OD1-O 3.02Å; N140-W222 HydrophobicContact CB-CD2 4.14Å; N140-W222 HydrophobicContact CB-CE3 3.57Å; N140-W222 HydrophobicContact CB-CH2 4.39Å; N140-W222 HydrophobicContact CB-CZ3 3.7Å; N140-L314 HydrophobicContact CB-CD1 3.85Å
141	R	98.9	Very high	98.8	Very high	22 Å²	22	25.2 Å²	25.2	8%	0.083	12%	0.121	C	C	.	.	H	α-helix	trans	-54.3	-49.1	-178.9	176.8	167.2	176.8	-73.3	-6.9	112.1	P100 F139 L144 I145 D163 E227	P100-R141 HydrophobicContact CB-CB 4.47Å; P100-R141 HydrophobicContact CB-CG 3.97Å; P100-R141 HydrophobicContact CG-CG 3.82Å; F139-R141 HydrophobicContact CD1-CB 4.47Å; F139-R141 HydrophobicContact CE1-CB 3.97Å; R141-L144 PolarHBondContact O-N 2.95Å; R141-I145 WeakPolarHBondContact O-CG1 3.33Å; R141-I145 PolarHBondContact O-N 2.92Å; R141-I145 VanDerWaalsContact O-N 3.09Å; R141-D163 IonicContact CZ-OD1 2.93Å; R141-D163 IonicContact NE-OD1 2.95Å; R141-D163 PolarHBondContact NE-OD1 3.36Å; R141-D163 IonicContact NH2-OD1 3.02Å; R141-D163 PolarHBondContact NH2-OD1 3.49Å; R141-E227 WeakPolarHBondContact CD-OE1 3.44Å; R141-E227 IonicContact CZ-OE1 3.3Å; R141-E227 IonicContact NE-OE1 2.77Å; R141-E227 IonicContact NH1-OE1 3.53Å; R141-E227 PolarHBondContact NH1-OE1 2.8Å
142	A	98.8	Very high	98.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-65.1	-46.3	-175.6	0	0	0	0	0	113.3	N140 L144 I145 N146 M217 S218 E227	N140-A142 VanDerWaalsContact C-N 3.35Å; N140-A142 PolarHBondContact O-N 2.86Å; A142-L144 VanDerWaalsContact C-N 3.31Å; A142-L144 PolarHBondContact O-N 2.62Å; A142-I145 PolarHBondContact O-N 3.02Å; A142-N146 PolarHBondContact O-N 3.46Å; A142-N146 VanDerWaalsContact O-N 3.07Å; A142-M217 HydrophobicContact CB-CB 3.61Å; A142-M217 HydrophobicContact CB-CE 4.03Å; A142-M217 HydrophobicContact CB-CG 4.42Å; A142-M217 HydrophobicContact CB-SD 4Å; A142-S218 WeakPolarHBondContact CB-O 3.49Å; A142-E227 HydrophobicContact CB-CB 3.85Å; A142-E227 HydrophobicContact CB-CG 3.82Å
143	A	98.9	Very high	98.4	Very high	3 Å²	3	25.1 Å²	25.1	3%	0.025	12%	0.124	C	C	.	.	H	α-helix	trans	-63.5	-38.6	177.2	0	0	0	0	0	111.5	N140 I145 N146 V147 N219 V290 L314	N140-A143 HydrophobicContact CB-CB 4.18Å; N140-A143 VanDerWaalsContact OD1-CB 3.29Å; N140-A143 WeakPolarHBondContact OD1-CB 3.26Å; N140-A143 PolarHBondContact OD1-N 2.86Å; A143-I145 PolarHBondContact O-N 2.9Å; A143-N146 WeakPolarHBondContact O-CB 3.28Å; A143-N146 PolarHBondContact O-N 2.86Å; A143-V147 WeakPolarHBondContact O-CG2 3.4Å; A143-V147 PolarHBondContact O-N 3.33Å; A143-N219 HydrophobicContact CB-CB 4.44Å; A143-V290 HydrophobicContact CB-CG2 4.3Å; A143-L314 HydrophobicContact CB-CD1 3.82Å; A143-L314 HydrophobicContact CB-CD2 4.16Å
144	L	98.9	Very high	98.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.4	-46.1	173.9	-70.2	167.4	0	0	0	111.5	P100 L131 Q133 F139 N140 R141 A142 N146 V147 G148 I312 L314	P100-L144 HydrophobicContact CB-CB 4.32Å; P100-L144 HydrophobicContact CB-CD1 4.11Å; L131-L144 HydrophobicContact CB-CB 4.17Å; L131-L144 HydrophobicContact CB-CD2 4.39Å; L131-L144 HydrophobicContact CD1-CB 4.49Å; L131-L144 WeakPolarHBondContact CD1-O 3.48Å; Q133-L144 HydrophobicContact CB-CD1 3.88Å; Q133-L144 HydrophobicContact CB-CD2 3.8Å; Q133-L144 HydrophobicContact CB-CG 4.31Å; Q133-L144 HydrophobicContact CG-CD1 4.48Å; Q133-L144 HydrophobicContact CG-CD2 4.08Å; F139-L144 HydrophobicContact CD2-CD1 4.16Å; F139-L144 HydrophobicContact CE2-CD1 3.42Å; F139-L144 VanDerWaalsContact CE2-CD1 3.42Å; F139-L144 HydrophobicContact CZ-CD1 3.75Å; N140-L144 VanDerWaalsContact O-CG 3.27Å; N140-L144 WeakPolarHBondContact O-CG 3.31Å; N140-L144 PolarHBondContact O-N 3.36Å; N140-L144 VanDerWaalsContact O-N 3.11Å; R141-L144 PolarHBondContact O-N 2.95Å; A142-L144 VanDerWaalsContact C-N 3.31Å; A142-L144 PolarHBondContact O-N 2.62Å; L144-N146 VanDerWaalsContact C-N 3.31Å; L144-N146 PolarHBondContact O-N 3.38Å; L144-V147 CarbonylContact O-C 3.55Å; L144-V147 WeakPolarHBondContact O-CB 3.47Å; L144-V147 PolarHBondContact O-N 3.03Å; L144-V147 VanDerWaalsContact O-N 3.1Å; L144-G148 PolarHBondContact O-N 3.3Å; L144-I312 HydrophobicContact CD2-CB 4.07Å; L144-I312 HydrophobicContact CD2-CD1 3.82Å; L144-I312 HydrophobicContact CD2-CG2 4.05Å; L144-L314 HydrophobicContact CD2-CD1 4.31Å; L144-L314 HydrophobicContact CG-CD1 4.32Å
145	I	98.9	Very high	98	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58.4	-43.5	175.8	-61.9	-56	0	0	0	111.3	L98 P100 L131 R141 A142 A143 V147 G148 F149 I159 M161 Y211 M217	L98-I145 HydrophobicContact CB-CD1 3.91Å; L98-I145 HydrophobicContact CD1-CG2 4.08Å; P100-I145 HydrophobicContact CB-CD1 4.4Å; P100-I145 HydrophobicContact CG-CD1 4.23Å; L131-I145 HydrophobicContact CD1-CD1 4.17Å; R141-I145 WeakPolarHBondContact O-CG1 3.33Å; R141-I145 PolarHBondContact O-N 2.92Å; R141-I145 VanDerWaalsContact O-N 3.09Å; A142-I145 PolarHBondContact O-N 3.02Å; A143-I145 PolarHBondContact O-N 2.9Å; I145-V147 VanDerWaalsContact C-N 3.28Å; I145-V147 PolarHBondContact O-N 3.07Å; I145-G148 PolarHBondContact O-N 3.09Å; I145-F149 WeakPolarHBondContact O-CB 3.47Å; I145-F149 PolarHBondContact O-N 3.21Å; I145-I159 HydrophobicContact CG2-CD1 4.45Å; I145-M161 HydrophobicContact CB-CG 4.48Å; I145-M161 HydrophobicContact CB-SD 4.48Å; I145-M161 HydrophobicContact CD1-CB 4.02Å; I145-M161 HydrophobicContact CD1-CG 4.12Å; I145-M161 HydrophobicContact CG1-CB 4.32Å; I145-M161 HydrophobicContact CG1-CG 4.13Å; I145-M161 HydrophobicContact CG1-SD 4.36Å; I145-M161 HydrophobicContact CG2-CG 3.52Å; I145-M161 HydrophobicContact CG2-SD 3.62Å; I145-Y211 HydrophobicContact CG2-CE2 4.15Å; I145-Y211 VanDerWaalsContact CG2-OH 3.25Å; I145-Y211 WeakPolarHBondContact CG2-OH 3.39Å; I145-M217 HydrophobicContact CB-SD 4.16Å; I145-M217 HydrophobicContact CG1-SD 4.25Å; I145-M217 HydrophobicContact CG2-SD 4.36Å
146	N	98.9	Very high	97.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57	-44.4	175.4	-74.6	-30.9	0	0	0	111.2	A142 A143 L144 F149 L150 Y211 M217 N219 L287 V290	A142-N146 PolarHBondContact O-N 3.46Å; A142-N146 VanDerWaalsContact O-N 3.07Å; A143-N146 WeakPolarHBondContact O-CB 3.28Å; A143-N146 PolarHBondContact O-N 2.86Å; L144-N146 VanDerWaalsContact C-N 3.31Å; L144-N146 PolarHBondContact O-N 3.38Å; N146-F149 WeakPolarHBondContact O-CB 3.43Å; N146-F149 PolarHBondContact O-N 2.99Å; N146-L150 WeakPolarHBondContact O-CG 3.5Å; N146-L150 PolarHBondContact O-N 3.46Å; N146-L150 VanDerWaalsContact O-N 3.15Å; N146-Y211 PolarHBondContact OD1-OH 2.81Å; N146-M217 PolarHBondContact ND2-O 2.92Å; N146-M217 PolarHBondContact OD1-N 3.22Å; N146-N219 PolarHBondContact ND2-OD1 3.42Å; N146-L287 HydrophobicContact CB-CD1 4.01Å; N146-V290 HydrophobicContact CB-CB 4.23Å; N146-V290 HydrophobicContact CB-CG1 4.15Å; N146-V290 HydrophobicContact CB-CG2 4.34Å
147	V	98.9	Very high	97.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.1	-49.3	175.3	175.5	0	0	0	0	110.9	A143 L144 I145 F149 L150 E151 V290 Y292 I312 L314	A143-V147 WeakPolarHBondContact O-CG2 3.4Å; A143-V147 PolarHBondContact O-N 3.33Å; L144-V147 CarbonylContact O-C 3.55Å; L144-V147 WeakPolarHBondContact O-CB 3.47Å; L144-V147 PolarHBondContact O-N 3.03Å; L144-V147 VanDerWaalsContact O-N 3.1Å; I145-V147 VanDerWaalsContact C-N 3.28Å; I145-V147 PolarHBondContact O-N 3.07Å; V147-F149 PolarHBondContact O-N 3.35Å; V147-L150 PolarHBondContact O-N 3.33Å; V147-L150 VanDerWaalsContact O-N 3.08Å; V147-E151 HydrophobicContact CG1-CG 3.83Å; V147-E151 WeakPolarHBondContact O-CB 3.47Å; V147-E151 VanDerWaalsContact O-CG 3.23Å; V147-E151 WeakPolarHBondContact O-CG 3.4Å; V147-E151 PolarHBondContact O-N 3.36Å; V147-V290 HydrophobicContact CG2-CG2 4Å; V147-Y292 HydrophobicContact CB-CD2 4.28Å; V147-Y292 HydrophobicContact CB-CE2 4.33Å; V147-Y292 HydrophobicContact CB-CG 4.45Å; V147-Y292 HydrophobicContact CG1-CD2 3.55Å; V147-Y292 HydrophobicContact CG1-CE2 3.46Å; V147-Y292 VanDerWaalsContact CG1-CE2 3.46Å; V147-Y292 HydrophobicContact CG1-CG 4.2Å; V147-Y292 HydrophobicContact CG2-CD1 3.62Å; V147-Y292 HydrophobicContact CG2-CD2 3.72Å; V147-Y292 HydrophobicContact CG2-CE1 4.03Å; V147-Y292 HydrophobicContact CG2-CE2 4.13Å; V147-Y292 HydrophobicContact CG2-CG 3.44Å; V147-Y292 VanDerWaalsContact CG2-CG 3.44Å; V147-I312 HydrophobicContact CB-CD1 4.12Å; V147-I312 HydrophobicContact CB-CG2 4.34Å; V147-I312 HydrophobicContact CG1-CD1 3.57Å; V147-I312 HydrophobicContact CG1-CG1 3.8Å; V147-I312 HydrophobicContact CG1-CG2 3.96Å; V147-I312 HydrophobicContact CG2-CG2 4.09Å; V147-L314 HydrophobicContact CG2-CD2 3.87Å
148	G	98.9	Very high	97.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-58.5	-35.7	178.1	0	0	0	0	0	113.2	L131 L144 I145 S152	L131-G148 VanDerWaalsContact CD2-CA 3.42Å; L144-G148 PolarHBondContact O-N 3.3Å; I145-G148 PolarHBondContact O-N 3.09Å; G148-S152 VanDerWaalsContact O-CB 3.23Å; G148-S152 WeakPolarHBondContact O-CB 3.29Å; G148-S152 PolarHBondContact O-N 2.87Å; G148-S152 PolarHBondContact O-OG 2.91Å
149	F	98.9	Very high	97.9	Very high	12 Å²	12	24.6 Å²	24.6	5%	0.053	13%	0.131	C	C	.	.	H	α-helix	trans	-61.5	-51	173	178.9	-82.5	0	0	0	111.5	L98 I145 N146 V147 E151 S152 I159 K208 Y211 Q212 L287	L98-F149 HydrophobicContact CD1-CB 4.36Å; I145-F149 WeakPolarHBondContact O-CB 3.47Å; I145-F149 PolarHBondContact O-N 3.21Å; N146-F149 WeakPolarHBondContact O-CB 3.43Å; N146-F149 PolarHBondContact O-N 2.99Å; V147-F149 PolarHBondContact O-N 3.35Å; F149-E151 VanDerWaalsContact C-N 3.29Å; F149-E151 PolarHBondContact O-N 3.05Å; F149-S152 PolarHBondContact O-OG 2.83Å; F149-I159 HydrophobicContact CD2-CD1 4.17Å; F149-I159 HydrophobicContact CD2-CG2 4.03Å; F149-K208 HydrophobicContact CE2-CB 3.91Å; F149-K208 HydrophobicContact CE2-CD 4.17Å; F149-K208 HydrophobicContact CE2-CG 3.65Å; F149-K208 HydrophobicContact CZ-CB 3.97Å; F149-K208 HydrophobicContact CZ-CD 4.07Å; F149-K208 HydrophobicContact CZ-CG 3.95Å; F149-Y211 HydrophobicContact CB-CD1 4.24Å; F149-Y211 HydrophobicContact CB-CE1 3.9Å; F149-Y211 HydrophobicContact CD1-CD1 4.28Å; F149-Y211 AromaticContact CD2-CD1 3.27Å; F149-Y211 HydrophobicContact CD2-CD1 3.27Å; F149-Y211 AromaticContact CD2-CE1 3.82Å; F149-Y211 HydrophobicContact CD2-CE1 3.82Å; F149-Y211 AromaticContact CD2-CG 3.88Å; F149-Y211 HydrophobicContact CD2-CG 3.88Å; F149-Y211 AromaticContact CE2-CD1 3.57Å; F149-Y211 HydrophobicContact CE2-CD1 3.57Å; F149-Y211 HydrophobicContact CE2-CG 4Å; F149-Y211 AromaticContact CG-CD1 3.67Å; F149-Y211 HydrophobicContact CG-CD1 3.67Å; F149-Y211 AromaticContact CG-CE1 3.82Å; F149-Y211 HydrophobicContact CG-CE1 3.82Å; F149-Y211 HydrophobicContact CZ-CD1 4.23Å; F149-Q212 HydrophobicContact CE1-CG 4.02Å; F149-Q212 HydrophobicContact CZ-CG 3.63Å; F149-L287 HydrophobicContact CB-CD1 4.3Å; F149-L287 HydrophobicContact CD1-CD1 3.76Å; F149-L287 HydrophobicContact CD1-CD2 3.74Å; F149-L287 HydrophobicContact CD1-CG 4.36Å; F149-L287 HydrophobicContact CE1-CD2 3.69Å; F149-L287 HydrophobicContact CG-CD1 4.27Å; F149-L287 HydrophobicContact CZ-CD2 4.4Å
150	L	98.8	Very high	98	Very high	75 Å²	75	21.7 Å²	21.7	39%	0.393	12%	0.118	S	C	.	.	H	α-helix	trans	-65.7	-33.4	-178.6	-66.8	171.1	0	0	0	112.4	N146 V147 L287 V290 Y292	N146-L150 WeakPolarHBondContact O-CG 3.5Å; N146-L150 PolarHBondContact O-N 3.46Å; N146-L150 VanDerWaalsContact O-N 3.15Å; V147-L150 PolarHBondContact O-N 3.33Å; V147-L150 VanDerWaalsContact O-N 3.08Å; L150-L287 HydrophobicContact CD1-CD1 4.06Å; L150-L287 HydrophobicContact CD2-CD1 3.8Å; L150-L287 HydrophobicContact CD2-CG 4.23Å; L150-L287 HydrophobicContact CG-CD1 3.65Å; L150-V290 HydrophobicContact CD1-CG1 3.69Å; L150-Y292 HydrophobicContact CD1-CE1 3.79Å
151	E	98.6	Very high	98	Very high	40 Å²	40	21.8 Å²	21.8	19%	0.187	12%	0.119	C	C	.	.	H	α-helix	trans	-94.2	-11.7	-174.2	-63.5	-57.8	160.7	0	0	114.2	V147 F149 Y292 V294 R297 L310	V147-E151 HydrophobicContact CG1-CG 3.83Å; V147-E151 WeakPolarHBondContact O-CB 3.47Å; V147-E151 VanDerWaalsContact O-CG 3.23Å; V147-E151 WeakPolarHBondContact O-CG 3.4Å; V147-E151 PolarHBondContact O-N 3.36Å; F149-E151 VanDerWaalsContact C-N 3.29Å; F149-E151 PolarHBondContact O-N 3.05Å; E151-Y292 HydrophobicContact CG-CE2 4.05Å; E151-Y292 VanDerWaalsContact OE1-CE2 3.22Å; E151-Y292 WeakPolarHBondContact OE1-CE2 3.48Å; E151-Y292 VanDerWaalsContact OE1-CZ 3.31Å; E151-Y292 PolarHBondContact OE1-OH 2.87Å; E151-V294 HydrophobicContact CG-CG2 3.99Å; E151-R297 IonicContact OE2-CZ 3.35Å; E151-R297 VanDerWaalsContact OE2-CZ 3.26Å; E151-R297 IonicContact OE2-NH1 2.75Å; E151-R297 PolarHBondContact OE2-NH1 3.31Å; E151-R297 IonicContact OE2-NH2 2.69Å; E151-R297 PolarHBondContact OE2-NH2 3.36Å; E151-L310 HydrophobicContact CB-CD1 3.63Å; E151-L310 HydrophobicContact CG-CD1 4.35Å
152	S	96.9	Very high	98	Very high	5 Å²	5	20.8 Å²	20.8	4%	0.035	12%	0.115	C	C	.	.	S	Bend	trans	-69.1	153.1	172.4	69	0	0	0	0	111.3	G148 F149	G148-S152 VanDerWaalsContact O-CB 3.23Å; G148-S152 WeakPolarHBondContact O-CB 3.29Å; G148-S152 PolarHBondContact O-N 2.87Å; G148-S152 PolarHBondContact O-OG 2.91Å; F149-S152 PolarHBondContact O-OG 2.83Å
153	S	93.8	Very high	98	Very high	26 Å²	26	22.5 Å²	22.5	18%	0.182	12%	0.124	C	C	.	.			trans	-47.4	143.1	179.1	-178	0	0	0	0	113.1	E82 Y129 S155 T156 K208	E82-S153 VanDerWaalsContact OE2-CB 3.27Å; E82-S153 WeakPolarHBondContact OE2-CB 3.23Å; Y129-S153 PolarHBondContact OH-N 3.12Å; S153-S155 PolarHBondContact O-N 3.38Å; S153-S155 PolarHBondContact OG-N 3.2Å; S153-S155 PolarHBondContact OG-OG 2.97Å; S153-T156 VanDerWaalsContact O-CB 3.28Å; S153-T156 WeakPolarHBondContact O-CB 3.24Å; S153-T156 PolarHBondContact O-N 2.91Å; S153-T156 VanDerWaalsContact O-N 3.08Å; S153-T156 PolarHBondContact O-OG1 3.49Å; S153-K208 PolarHBondContact O-NZ 3.24Å
154	N	93.3	Very high	98	Very high	161 Å²	161	22.7 Å²	22.7	86%	0.861	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-25.6	169.9	-69.7	-27.5	0	0	0	112.8	T156	N154-T156 VanDerWaalsContact C-N 3.27Å; N154-T156 PolarHBondContact O-N 2.94Å
155	S	94.8	Very high	98	Very high	43 Å²	43	23.3 Å²	23.3	30%	0.301	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-6	177.1	69.3	0	0	0	0	114.3	W84 R94 S153	W84-S155 WeakPolarHBondContact CZ2-OG 3.5Å; W84-S155 PolarHBondContact NE1-OG 2.98Å; R94-S155 WeakPolarHBondContact CD-O 3.48Å; S153-S155 PolarHBondContact O-N 3.38Å; S153-S155 PolarHBondContact OG-N 3.2Å; S153-S155 PolarHBondContact OG-OG 2.97Å
156	T	96.9	Very high	97.9	Very high	4 Å²	4	23.4 Å²	23.4	3%	0.025	13%	0.129	C	C	.	.			trans	-72.3	131.1	176.2	-61.7	0	0	0	0	110	W84 A96 S153 N154 Y158 K208	W84-T156 VanDerWaalsContact CH2-OG1 3.32Å; W84-T156 WeakPolarHBondContact CH2-OG1 3.42Å; A96-T156 HydrophobicContact CB-CG2 3.5Å; S153-T156 VanDerWaalsContact O-CB 3.28Å; S153-T156 WeakPolarHBondContact O-CB 3.24Å; S153-T156 PolarHBondContact O-N 2.91Å; S153-T156 VanDerWaalsContact O-N 3.08Å; S153-T156 PolarHBondContact O-OG1 3.49Å; N154-T156 VanDerWaalsContact C-N 3.27Å; N154-T156 PolarHBondContact O-N 2.94Å; T156-Y158 WeakPolarHBondContact CG2-O 3.46Å; T156-K208 WeakPolarHBondContact O-CD 3.38Å; T156-K208 WeakPolarHBondContact O-CE 3.46Å; T156-K208 PolarHBondContact O-NZ 2.82Å; T156-K208 VanDerWaalsContact O-NZ 3.16Å
157	D	98.3	Very high	97.9	Very high	61 Å²	61	23.6 Å²	23.6	33%	0.326	13%	0.13	S	C	.	.			trans	-93.3	-31.2	179.6	-56	-66.8	0	0	0	112.8	H93 R94 F177 K208	H93-D157 VanDerWaalsContact CA-OD2 3.24Å; H93-D157 WeakPolarHBondContact CA-OD2 3.21Å; H93-D157 IonicContact ND1-OD2 3.97Å; R94-D157 PolarHBondContact N-OD2 3.3Å; R94-D157 PolarHBondContact O-N 2.86Å; D157-F177 HydrophobicContact CB-CD2 4.31Å; D157-F177 HydrophobicContact CB-CE2 4.06Å; D157-K208 PolarHBondContact O-N 3.06Å
158	Y	98.9	Very high	97.9	Very high	4 Å²	4	23.6 Å²	23.6	2%	0.016	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	160.9	-176.2	75.3	-65.9	0	0	0	112.3	H93 R94 L95 A96 I124 T156 Y175 G176 F177 P178 L205 L206	H93-Y158 HydrophobicContact CB-CD1 4.29Å; H93-Y158 HydrophobicContact CB-CE1 3.97Å; R94-Y158 VanDerWaalsContact O-CD1 3.26Å; R94-Y158 WeakPolarHBondContact O-CD1 3.32Å; R94-Y158 PolarHBondContact O-N 2.86Å; L95-Y158 WeakPolarHBondContact CA-O 3.37Å; L95-Y158 HydrophobicContact CB-CD1 4.31Å; L95-Y158 HydrophobicContact CB-CE1 3.63Å; L95-Y158 HydrophobicContact CB-CE2 4.15Å; L95-Y158 HydrophobicContact CD1-CD2 3.75Å; L95-Y158 HydrophobicContact CD1-CE1 4.4Å; L95-Y158 HydrophobicContact CD1-CE2 3.59Å; L95-Y158 HydrophobicContact CD1-CG 4.27Å; L95-Y158 HydrophobicContact CD2-CE2 4.33Å; L95-Y158 HydrophobicContact CG-CE2 4.22Å; A96-Y158 PolarHBondContact N-O 3.2Å; I124-Y158 VanDerWaalsContact CG2-OH 3.31Å; I124-Y158 WeakPolarHBondContact CG2-OH 3.22Å; T156-Y158 WeakPolarHBondContact CG2-O 3.46Å; Y158-Y175 VanDerWaalsContact CE2-O 3.29Å; Y158-Y175 WeakPolarHBondContact CE2-O 3.4Å; Y158-Y175 PolarHBondContact OH-O 3.1Å; Y158-G176 VanDerWaalsContact CE2-O 3.29Å; Y158-G176 WeakPolarHBondContact CE2-O 3.34Å; Y158-F177 AromaticContact CD1-CD2 3.78Å; Y158-F177 HydrophobicContact CD1-CD2 3.78Å; Y158-F177 HydrophobicContact CE1-CD2 4.49Å; Y158-F177 AromaticContact CG-CD2 3.83Å; Y158-F177 HydrophobicContact CG-CD2 3.83Å; Y158-P178 HydrophobicContact CD2-CG 4.23Å; Y158-L205 HydrophobicContact CD2-CD2 4.47Å; Y158-L205 HydrophobicContact CE2-CD2 4.01Å; Y158-L206 WeakPolarHBondContact CA-O 3.41Å; Y158-L206 VanDerWaalsContact CB-O 3.31Å; Y158-L206 WeakPolarHBondContact CB-O 3.37Å
159	I	98.9	Very high	97.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	151.4	-176.7	62.6	157.8	0	0	0	110.7	A96 L98 I145 F149 M161 L205 L206 Y211	A96-I159 HydrophobicContact CB-CG2 4.32Å; A96-I159 CarbonylContact O-C 3.59Å; A96-I159 WeakPolarHBondContact O-CA 3.26Å; L98-I159 HydrophobicContact CD1-CB 3.96Å; L98-I159 HydrophobicContact CD1-CD1 3.96Å; L98-I159 HydrophobicContact CD1-CG2 3.89Å; L98-I159 HydrophobicContact CG-CB 4.28Å; L98-I159 HydrophobicContact CG-CG2 4.36Å; I145-I159 HydrophobicContact CG2-CD1 4.45Å; F149-I159 HydrophobicContact CD2-CD1 4.17Å; F149-I159 HydrophobicContact CD2-CG2 4.03Å; I159-M161 HydrophobicContact CD1-CG 4.09Å; I159-L205 VanDerWaalsContact O-CA 3.24Å; I159-L205 WeakPolarHBondContact O-CA 3.35Å; I159-L206 HydrophobicContact CG1-CB 4.38Å; I159-L206 PolarHBondContact N-O 2.79Å; I159-L206 PolarHBondContact O-N 3.44Å; I159-Y211 HydrophobicContact CD1-CD1 4.43Å; I159-Y211 HydrophobicContact CD1-CD2 3.58Å; I159-Y211 HydrophobicContact CD1-CE2 3.83Å; I159-Y211 HydrophobicContact CD1-CG 3.9Å
160	A	98.9	Very high	97.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	114.7	161.8	0	0	0	0	0	108.2	L95 A96 L98 H162 L205	L95-A160 HydrophobicContact CD1-CB 3.74Å; L95-A160 HydrophobicContact CD2-CB 4.48Å; A96-A160 PolarHBondContact O-N 2.87Å; L98-A160 PolarHBondContact N-O 2.83Å; A160-H162 PolarHBondContact O-N 2.92Å; A160-L205 HydrophobicContact CB-CD1 3.65Å; A160-L205 HydrophobicContact CB-CG 3.86Å
161	M	98.9	Very high	97.9	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	113.3	167.3	-55.7	178.8	-67.6	0	0	106.8	I145 I159 I203 L204 L206 Y211 M217 F231	I145-M161 HydrophobicContact CB-CG 4.48Å; I145-M161 HydrophobicContact CB-SD 4.48Å; I145-M161 HydrophobicContact CD1-CB 4.02Å; I145-M161 HydrophobicContact CD1-CG 4.12Å; I145-M161 HydrophobicContact CG1-CB 4.32Å; I145-M161 HydrophobicContact CG1-CG 4.13Å; I145-M161 HydrophobicContact CG1-SD 4.36Å; I145-M161 HydrophobicContact CG2-CG 3.52Å; I145-M161 HydrophobicContact CG2-SD 3.62Å; I159-M161 HydrophobicContact CD1-CG 4.09Å; M161-I203 VanDerWaalsContact O-CA 3.3Å; M161-I203 WeakPolarHBondContact O-CA 3.48Å; M161-L204 HydrophobicContact CE-CB 3.58Å; M161-L204 HydrophobicContact CE-CD2 3.28Å; M161-L204 HydrophobicContact CE-CG 3.41Å; M161-L204 VanDerWaalsContact CE-CG 3.41Å; M161-L204 PolarHBondContact N-O 2.75Å; M161-L204 PolarHBondContact O-N 3.5Å; M161-L204 VanDerWaalsContact O-N 3.11Å; M161-L206 HydrophobicContact CE-CD1 3.5Å; M161-Y211 HydrophobicContact SD-CE2 3.95Å; M161-M217 HydrophobicContact SD-CG 4.39Å; M161-M217 HydrophobicContact SD-SD 3.62Å; M161-M217 VanDerWaalsContact SD-SD 3.62Å; M161-F231 HydrophobicContact CE-CD1 4.12Å; M161-F231 HydrophobicContact CE-CE1 3.73Å; M161-F231 HydrophobicContact SD-CE1 4.4Å
162	H	98.9	Very high	97.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	115.2	-163.4	-157.7	-53	0	0	0	112.1	V97 L98 P100 F111 M115 A160 L166 Y175	V97-H162 HydrophobicContact CG1-CB 3.89Å; L98-H162 PolarHBondContact O-N 3.36Å; P100-H162 WeakPolarHBondContact CD-O 3.36Å; F111-H162 AromaticContact CE2-CE1 3.49Å; F111-H162 VanDerWaalsContact CE2-CE1 3.49Å; F111-H162 WeakPolarHBondContact CE2-CE1 3.29Å; F111-H162 AromaticContact CE2-ND1 3.34Å; F111-H162 VanDerWaalsContact CE2-ND1 3.34Å; F111-H162 WeakPolarHBondContact CE2-ND1 3.29Å; F111-H162 HydrophobicContact CZ-CB 4.45Å; F111-H162 AromaticContact CZ-CG 3.99Å; F111-H162 AromaticContact CZ-ND1 3.66Å; M115-H162 VanDerWaalsContact CE-NE2 3.33Å; M115-H162 WeakPolarHBondContact CE-NE2 3.39Å; A160-H162 PolarHBondContact O-N 2.92Å; H162-L166 PolarHBondContact CE1-O 2.99Å; H162-Y175 AromaticContact NE2-CE1 3.99Å; H162-Y175 PolarHBondContact NE2-OH 3.25Å
163	D	98.9	Very high	98	Very high	36 Å²	36	33.5 Å²	33.5	19%	0.193	18%	0.177	C	C	.	.			trans	-65.6	136	174.6	-66.2	-7.1	0	0	0	110.2	R141 D165 L166 G202	R141-D163 IonicContact CZ-OD1 2.93Å; R141-D163 IonicContact NE-OD1 2.95Å; R141-D163 PolarHBondContact NE-OD1 3.36Å; R141-D163 IonicContact NH2-OD1 3.02Å; R141-D163 PolarHBondContact NH2-OD1 3.49Å; D163-D165 PolarHBondContact O-N 3.46Å; D163-L166 HydrophobicContact CB-CB 4.36Å; D163-L166 PolarHBondContact O-N 2.82Å; D163-G202 PolarHBondContact N-O 2.95Å; D163-G202 VanDerWaalsContact OD2-CA 3.3Å; D163-G202 WeakPolarHBondContact OD2-CA 3.46Å; D163-G202 PolarHBondContact OD2-N 2.83Å
164	V	98.9	Very high	98.2	Very high	7 Å²	7	36 Å²	36	4%	0.042	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-20.8	-173.9	70.5	0	0	0	0	113.3	V99 F101 R104 E107 L108 F111	V99-V164 HydrophobicContact CG1-CB 3.62Å; V99-V164 HydrophobicContact CG1-CG2 3.93Å; F101-V164 HydrophobicContact CD2-CG2 4.34Å; F101-V164 HydrophobicContact CE2-CG2 4.47Å; R104-V164 HydrophobicContact CB-CG1 3.73Å; R104-V164 HydrophobicContact CG-CG1 3.98Å; E107-V164 HydrophobicContact CB-CG1 4.22Å; E107-V164 HydrophobicContact CB-CG2 4.33Å; L108-V164 HydrophobicContact CB-CG2 4.32Å; L108-V164 HydrophobicContact CD1-CG2 3.97Å; F111-V164 HydrophobicContact CB-CG2 3.89Å; F111-V164 HydrophobicContact CD1-CG2 4.36Å; F111-V164 HydrophobicContact CD2-CG2 4.27Å; F111-V164 WeakPolarHBondContact CD2-O 3.42Å; F111-V164 HydrophobicContact CG-CG2 3.92Å
165	D	98.6	Very high	98.5	Very high	14 Å²	14	28.4 Å²	28.4	8%	0.075	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	2.9	-175.5	59.2	3.2	0	0	0	113.4	E107 D163 H257 L258 H259	E107-D165 HydrophobicContact CG-CB 4.13Å; D163-D165 PolarHBondContact O-N 3.46Å; D165-H257 CarbonylContact O-C 3.59Å; D165-H257 VanDerWaalsContact O-CA 3.3Å; D165-H257 WeakPolarHBondContact O-CA 3.45Å; D165-H257 IonicContact OD1-CD2 3.62Å; D165-H257 IonicContact OD1-NE2 3.53Å; D165-H257 IonicContact OD2-NE2 2.68Å; D165-L258 HydrophobicContact CB-CB 4.27Å; D165-L258 WeakPolarHBondContact CB-O 3.42Å; D165-L258 PolarHBondContact O-N 3.28Å; D165-H259 IonicContact OD2-CE1 3.09Å; D165-H259 IonicContact OD2-CG 3.3Å; D165-H259 IonicContact OD2-ND1 2.62Å; D165-H259 PolarHBondContact OD2-ND1 3.26Å
166	L	98.9	Very high	98.7	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	92.3	-176	-166.2	66.9	0	0	0	111.7	H162 D163 A186 I203 F255 H257	H162-L166 PolarHBondContact CE1-O 2.99Å; D163-L166 HydrophobicContact CB-CB 4.36Å; D163-L166 PolarHBondContact O-N 2.82Å; L166-A186 HydrophobicContact CD2-CB 3.87Å; L166-I203 HydrophobicContact CB-CD1 4.45Å; L166-I203 HydrophobicContact CD2-CD1 3.92Å; L166-I203 HydrophobicContact CD2-CG1 4.09Å; L166-I203 HydrophobicContact CG-CD1 4.12Å; L166-F255 HydrophobicContact CD1-CB 3.65Å; L166-F255 HydrophobicContact CD1-CG 4.13Å; L166-F255 HydrophobicContact CG-CB 4.12Å; L166-F255 HydrophobicContact CG-CD1 4.16Å; L166-F255 HydrophobicContact CG-CG 4.18Å; L166-H257 HydrophobicContact CD1-CB 3.84Å
167	L	98.9	Very high	98.8	Very high	5 Å²	5	30.1 Å²	30.1	3%	0.026	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	126.8	-173.1	-54.7	-179.8	0	0	0	112.1	V110 F111 H114 F255 H256 L258	V110-L167 HydrophobicContact CG1-CD1 3.7Å; F111-L167 HydrophobicContact CB-CD2 4.3Å; F111-L167 HydrophobicContact CD2-CD2 3.7Å; F111-L167 HydrophobicContact CG-CD2 4.42Å; H114-L167 HydrophobicContact CB-CD2 4.36Å; L167-F255 CarbonylContact O-C 3.52Å; L167-F255 WeakPolarHBondContact O-CA 3.08Å; L167-H256 HydrophobicContact CB-CB 4.26Å; L167-H256 PolarHBondContact N-O 3.1Å; L167-H256 PolarHBondContact O-N 3.4Å; L167-L258 HydrophobicContact CD1-CD1 3.67Å; L167-L258 HydrophobicContact CD1-CG 4.41Å; L167-L258 HydrophobicContact CG-CD1 4.3Å
168	P	98.9	Very high	98.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	131.1	173.7	29.8	-35	0	0	0	111	H114 M115 F118 L173 Y175 F255	H114-P168 PolarHBondContact CE1-O 2.73Å; H114-P168 VanDerWaalsContact CE1-O 3.29Å; H114-P168 PolarHBondContact NE2-O 3.39Å; M115-P168 HydrophobicContact CE-CG 4.18Å; M115-P168 WeakPolarHBondContact SD-CD 3.4Å; M115-P168 HydrophobicContact SD-CG 3.67Å; F118-P168 HydrophobicContact CD1-CB 4.5Å; F118-P168 HydrophobicContact CD1-CG 3.79Å; F118-P168 HydrophobicContact CD2-CB 4.35Å; F118-P168 HydrophobicContact CD2-CG 4.03Å; F118-P168 HydrophobicContact CE1-CB 4.04Å; F118-P168 HydrophobicContact CE1-CG 3.79Å; F118-P168 HydrophobicContact CE2-CB 3.88Å; F118-P168 HydrophobicContact CE2-CG 4.03Å; F118-P168 HydrophobicContact CG-CG 3.92Å; F118-P168 HydrophobicContact CZ-CB 3.71Å; F118-P168 HydrophobicContact CZ-CG 3.92Å; P168-L173 HydrophobicContact CB-CD1 3.71Å; P168-Y175 HydrophobicContact CB-CE2 4.28Å; P168-Y175 HydrophobicContact CG-CE2 4.42Å; P168-F255 HydrophobicContact CB-CD1 4.34Å; P168-F255 HydrophobicContact CB-CE1 4.22Å
169	L	98.8	Very high	98.7	Very high	98 Å²	98	34.9 Å²	34.9	51%	0.513	18%	0.177	S	C	.	.			trans	-107.7	-21.3	177.2	-59.5	-177.3	0	0	0	113.2	T254 H256	L169-T254 WeakPolarHBondContact CB-O 3.37Å; L169-T254 PolarHBondContact N-O 3.11Å; L169-H256 HydrophobicContact CD1-CB 4.07Å; L169-H256 HydrophobicContact CD2-CB 4.17Å; L169-H256 HydrophobicContact CG-CB 4.26Å
170	N	98.6	Very high	98.7	Very high	19 Å²	19	38.5 Å²	38.5	10%	0.102	21%	0.207	C	C	.	.			trans	-100.5	121.9	-179.6	-170.6	-20.8	0	0	0	110.8	F118 E172 L173 T250 T254	F118-N170 WeakPolarHBondContact CZ-O 3.47Å; N170-E172 PolarHBondContact O-N 3.45Å; N170-E172 VanDerWaalsContact OD1-CB 3.28Å; N170-E172 WeakPolarHBondContact OD1-CB 3.21Å; N170-E172 WeakPolarHBondContact OD1-CG 3.49Å; N170-E172 PolarHBondContact OD1-N 2.8Å; N170-L173 HydrophobicContact CB-CG 4.45Å; N170-L173 WeakPolarHBondContact O-CB 3.44Å; N170-L173 WeakPolarHBondContact O-CG 3.38Å; N170-L173 PolarHBondContact O-N 3.37Å; N170-T250 HydrophobicContact CB-CG2 4.32Å; N170-T250 WeakPolarHBondContact ND2-CG2 3.37Å; N170-T250 PolarHBondContact ND2-OG1 3.2Å; N170-T250 VanDerWaalsContact ND2-OG1 3.12Å; N170-T254 HydrophobicContact CB-CG2 4.27Å
171	E	98.4	Very high	98.7	Very high	95 Å²	95	38.6 Å²	38.6	44%	0.444	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-14.4	-179.3	-68.1	179	-159.2	0	0	113.6	F118 R121 K122 L173	F118-E171 HydrophobicContact CE2-CG 4.18Å; R121-E171 IonicContact CZ-OE1 3.26Å; R121-E171 IonicContact NE-OE1 3.77Å; R121-E171 IonicContact NH1-OE1 3.04Å; R121-E171 PolarHBondContact NH1-OE1 3.12Å; R121-E171 IonicContact NH2-OE1 2.61Å; R121-E171 PolarHBondContact NH2-OE1 2.8Å; K122-E171 PolarHBondContact NZ-O 3.38Å; E171-L173 PolarHBondContact O-N 3.47Å
172	E	98.5	Very high	98.7	Very high	127 Å²	127	38.5 Å²	38.5	59%	0.593	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-12.9	173.9	-63.5	175.6	175.5	0	0	113.1	N170 D174 I248	N170-E172 PolarHBondContact O-N 3.45Å; N170-E172 VanDerWaalsContact OD1-CB 3.28Å; N170-E172 WeakPolarHBondContact OD1-CB 3.21Å; N170-E172 WeakPolarHBondContact OD1-CG 3.49Å; N170-E172 PolarHBondContact OD1-N 2.8Å; E172-D174 PolarHBondContact O-N 2.83Å; E172-I248 HydrophobicContact CB-CD1 3.58Å
173	L	98.8	Very high	98.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	-62.6	124.4	173.9	-67.8	172.2	0	0	0	110.1	K122 P168 N170 E171 Y175 V185 L190 P245 I248 T254 F255	K122-L173 WeakPolarHBondContact CE-O 3.22Å; K122-L173 PolarHBondContact NZ-O 3.39Å; P168-L173 HydrophobicContact CB-CD1 3.71Å; N170-L173 HydrophobicContact CB-CG 4.45Å; N170-L173 WeakPolarHBondContact O-CB 3.44Å; N170-L173 WeakPolarHBondContact O-CG 3.38Å; N170-L173 PolarHBondContact O-N 3.37Å; E171-L173 PolarHBondContact O-N 3.47Å; L173-Y175 HydrophobicContact CB-CD2 4.23Å; L173-Y175 HydrophobicContact CB-CE2 3.99Å; L173-Y175 PolarHBondContact O-N 2.91Å; L173-V185 HydrophobicContact CB-CG1 4.27Å; L173-V185 HydrophobicContact CD1-CG1 4.09Å; L173-V185 HydrophobicContact CD2-CG1 4.18Å; L173-V185 HydrophobicContact CG-CG1 4.43Å; L173-L190 HydrophobicContact CD2-CD1 4.17Å; L173-P245 HydrophobicContact CD2-CB 4.21Å; L173-P245 HydrophobicContact CD2-CG 3.8Å; L173-I248 HydrophobicContact CD2-CD1 4.42Å; L173-I248 HydrophobicContact CD2-CG1 4.38Å; L173-T254 HydrophobicContact CD1-CG2 3.85Å; L173-T254 HydrophobicContact CD2-CG2 3.94Å; L173-T254 HydrophobicContact CG-CG2 4.18Å; L173-F255 HydrophobicContact CD1-CD1 4.47Å; L173-F255 HydrophobicContact CD1-CE1 3.58Å; L173-F255 HydrophobicContact CD1-CZ 3.73Å; L173-F255 HydrophobicContact CD2-CZ 4.25Å
174	D	98.6	Very high	98.7	Very high	80 Å²	80	38 Å²	38	43%	0.428	20%	0.204	S	C	.	.			trans	-77.6	119.1	179.4	-169.2	8.6	0	0	0	111	E172 G176 F183 V185	E172-D174 PolarHBondContact O-N 2.83Å; D174-G176 WeakPolarHBondContact OD1-CA 3.49Å; D174-G176 PolarHBondContact OD1-N 2.86Å; D174-F183 HydrophobicContact CB-CE1 3.88Å; D174-F183 HydrophobicContact CB-CE2 4.42Å; D174-F183 HydrophobicContact CB-CZ 3.77Å; D174-F183 WeakPolarHBondContact O-CE1 3.42Å; D174-V185 WeakPolarHBondContact O-CG2 3.34Å
175	Y	98.8	Very high	98.7	Very high	1 Å²	1	37.7 Å²	37.7	0%	0.004	20%	0.202	C	C	.	.			trans	-116.3	7.7	172.8	-83.8	-105.3	0	0	0	111.5	M115 F118 L119 I124 Y158 H162 P168 L173 V185 I203 L205	M115-Y175 HydrophobicContact CE-CE1 3.98Å; F118-Y175 AromaticContact CE1-CD2 3.68Å; F118-Y175 HydrophobicContact CE1-CD2 3.68Å; F118-Y175 AromaticContact CE1-CE2 3.58Å; F118-Y175 HydrophobicContact CE1-CE2 3.58Å; F118-Y175 HydrophobicContact CE1-CG 4.37Å; F118-Y175 HydrophobicContact CZ-CD2 4.39Å; F118-Y175 HydrophobicContact CZ-CE2 4.15Å; L119-Y175 HydrophobicContact CD2-CD1 3.83Å; L119-Y175 HydrophobicContact CD2-CG 4Å; I124-Y175 VanDerWaalsContact CD1-CB 3.45Å; Y158-Y175 VanDerWaalsContact CE2-O 3.29Å; Y158-Y175 WeakPolarHBondContact CE2-O 3.4Å; Y158-Y175 PolarHBondContact OH-O 3.1Å; H162-Y175 AromaticContact NE2-CE1 3.99Å; H162-Y175 PolarHBondContact NE2-OH 3.25Å; P168-Y175 HydrophobicContact CB-CE2 4.28Å; P168-Y175 HydrophobicContact CG-CE2 4.42Å; L173-Y175 HydrophobicContact CB-CD2 4.23Å; L173-Y175 HydrophobicContact CB-CE2 3.99Å; L173-Y175 PolarHBondContact O-N 2.91Å; Y175-V185 HydrophobicContact CD2-CG1 4.5Å; Y175-V185 HydrophobicContact CD2-CG2 4.45Å; Y175-V185 HydrophobicContact CE2-CG1 3.66Å; Y175-V185 HydrophobicContact CE2-CG2 4.26Å; Y175-I203 HydrophobicContact CE1-CG2 4.09Å; Y175-L205 HydrophobicContact CD1-CD1 4.38Å; Y175-L205 HydrophobicContact CD1-CD2 4.3Å; Y175-L205 HydrophobicContact CG-CD2 4.46Å
176	G	98.6	Very high	98.7	Very high	23 Å²	23	37 Å²	37	24%	0.237	20%	0.198	C	C	.	.	S	Bend	trans	-66.4	178.6	177.4	0	0	0	0	0	112.4	Y158 D174 P178	Y158-G176 VanDerWaalsContact CE2-O 3.29Å; Y158-G176 WeakPolarHBondContact CE2-O 3.34Å; D174-G176 WeakPolarHBondContact OD1-CA 3.49Å; D174-G176 PolarHBondContact OD1-N 2.86Å; G176-P178 WeakPolarHBondContact O-CD 3.46Å
177	F	98.8	Very high	98.7	Very high	60 Å²	60	37 Å²	37	26%	0.263	20%	0.199	S	C	.	.			trans	-64.8	119.9	-178.8	-179.3	-106.8	0	0	0	111	H93 D157 Y158 E179	H93-F177 HydrophobicContact CB-CB 3.87Å; H93-F177 HydrophobicContact CB-CD2 4.21Å; H93-F177 HydrophobicContact CB-CG 4.25Å; H93-F177 WeakPolarHBondContact CD2-CB 3.23Å; H93-F177 AromaticContact CD2-CG 3.67Å; H93-F177 AromaticContact CE1-CD1 3.79Å; H93-F177 AromaticContact CE1-CG 3.88Å; H93-F177 AromaticContact CG-CD2 3.88Å; H93-F177 AromaticContact CG-CG 3.66Å; H93-F177 AromaticContact ND1-CD2 3.8Å; H93-F177 AromaticContact ND1-CG 3.8Å; H93-F177 AromaticContact NE2-CD1 3.69Å; H93-F177 AromaticContact NE2-CG 3.82Å; D157-F177 HydrophobicContact CB-CD2 4.31Å; D157-F177 HydrophobicContact CB-CE2 4.06Å; Y158-F177 AromaticContact CD1-CD2 3.78Å; Y158-F177 HydrophobicContact CD1-CD2 3.78Å; Y158-F177 HydrophobicContact CE1-CD2 4.49Å; Y158-F177 AromaticContact CG-CD2 3.83Å; Y158-F177 HydrophobicContact CG-CD2 3.83Å; F177-E179 VanDerWaalsContact C-N 3.28Å; F177-E179 HydrophobicContact CD1-CB 3.85Å; F177-E179 HydrophobicContact CE1-CB 3.85Å; F177-E179 HydrophobicContact CE1-CG 4.19Å; F177-E179 PolarHBondContact O-N 2.63Å
178	P	98.6	Very high	98.6	Very high	10 Å²	10	37.2 Å²	37.2	7%	0.065	20%	0.2	C	C	.	.			trans	-84.9	67.8	-173.5	36.3	-38.6	0	0	0	111.3	Y158 G176 A180 G181 F183 L205	Y158-P178 HydrophobicContact CD2-CG 4.23Å; G176-P178 WeakPolarHBondContact O-CD 3.46Å; P178-A180 PolarHBondContact O-N 3.07Å; P178-G181 WeakPolarHBondContact CB-O 3.42Å; P178-G181 PolarHBondContact O-N 2.98Å; P178-F183 HydrophobicContact CB-CB 3.94Å; P178-L205 HydrophobicContact CG-CB 4.18Å
179	E	98.3	Very high	98.6	Very high	155 Å²	155	44.1 Å²	44.1	72%	0.724	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-43.9	-174.3	-173	177.6	-167.6	0	0	112.8	F177 G181 H210	F177-E179 VanDerWaalsContact C-N 3.28Å; F177-E179 HydrophobicContact CD1-CB 3.85Å; F177-E179 HydrophobicContact CE1-CB 3.85Å; F177-E179 HydrophobicContact CE1-CG 4.19Å; F177-E179 PolarHBondContact O-N 2.63Å; E179-G181 VanDerWaalsContact C-N 3.3Å; E179-G181 PolarHBondContact O-N 3.46Å; E179-H210 PolarHBondContact O-CE1 2.77Å
180	A	98.4	Very high	98.6	Very high	76 Å²	76	39.8 Å²	39.8	63%	0.628	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-20.7	-174.9	0	0	0	0	0	114	P178 F243	P178-A180 PolarHBondContact O-N 3.07Å; A180-F243 HydrophobicContact CB-CD2 4.43Å; A180-F243 HydrophobicContact CB-CE1 4.5Å; A180-F243 HydrophobicContact CB-CE2 3.72Å; A180-F243 HydrophobicContact CB-CZ 3.75Å; A180-F243 WeakPolarHBondContact O-CE2 3.27Å
181	G	98.6	Very high	98.6	Very high	2 Å²	2	39.1 Å²	39.1	2%	0.021	21%	0.206	C	C	.	.	S	Bend	trans	153.6	171.9	-175	0	0	0	0	0	112.4	P178 E179 F183	P178-G181 WeakPolarHBondContact CB-O 3.42Å; P178-G181 PolarHBondContact O-N 2.98Å; E179-G181 VanDerWaalsContact C-N 3.3Å; E179-G181 PolarHBondContact O-N 3.46Å; G181-F183 PolarHBondContact O-N 3.23Å
182	P	98.9	Very high	98.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.197	C	C	.	.			trans	-51.2	131.9	179.4	-30.1	38.2	0	0	0	113	L204 L205 L206 I235 L240 Q241 L242 F243	P182-L204 HydrophobicContact CB-CD1 4.11Å; P182-L205 CarbonylContact C-O 3.49Å; P182-L205 VanDerWaalsContact CA-O 3.32Å; P182-L205 WeakPolarHBondContact CA-O 3.38Å; P182-L206 HydrophobicContact CB-CD2 4.03Å; P182-L206 HydrophobicContact CB-CG 3.86Å; P182-L206 HydrophobicContact CG-CD2 3.63Å; P182-L206 HydrophobicContact CG-CG 3.94Å; P182-I235 HydrophobicContact CB-CD1 4.11Å; P182-I235 HydrophobicContact CG-CD1 4.24Å; P182-I235 HydrophobicContact CG-CG1 4.24Å; P182-I235 HydrophobicContact CG-CG2 4.07Å; P182-L240 HydrophobicContact CG-CB 4.41Å; P182-L240 HydrophobicContact CG-CD1 4.08Å; P182-Q241 WeakPolarHBondContact CD-O 3.42Å; P182-L242 HydrophobicContact CB-CD1 4.06Å; P182-F243 PolarHBondContact O-N 3.09Å
183	F	98.9	Very high	98.5	Very high	26 Å²	26	34.4 Å²	34.4	11%	0.114	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	109.9	-176.7	-168.8	-88.2	0	0	0	111	D174 P178 G181 V185 L204 L205 F243 P245	D174-F183 HydrophobicContact CB-CE1 3.88Å; D174-F183 HydrophobicContact CB-CE2 4.42Å; D174-F183 HydrophobicContact CB-CZ 3.77Å; D174-F183 WeakPolarHBondContact O-CE1 3.42Å; P178-F183 HydrophobicContact CB-CB 3.94Å; G181-F183 PolarHBondContact O-N 3.23Å; F183-V185 HydrophobicContact CD1-CG2 3.73Å; F183-V185 HydrophobicContact CE1-CG2 3.9Å; F183-V185 PolarHBondContact O-N 2.83Å; F183-L204 WeakPolarHBondContact O-CD1 3.3Å; F183-L205 HydrophobicContact CB-CB 4.35Å; F183-L205 PolarHBondContact N-O 3.16Å; F183-L205 PolarHBondContact O-N 2.79Å; F183-F243 HydrophobicContact CD2-CB 3.6Å; F183-F243 HydrophobicContact CE2-CB 4.15Å; F183-P245 HydrophobicContact CE1-CG 3.92Å; F183-P245 HydrophobicContact CZ-CB 4.44Å; F183-P245 HydrophobicContact CZ-CG 3.89Å
184	H	98.9	Very high	98.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	94.2	-177.7	-178.9	-127.1	0	0	0	111	A186 Y199 V200 G201 I203 L204 L242 F243 R244 P245	H184-A186 PolarHBondContact CE1-O 3.42Å; H184-A186 PolarHBondContact NE2-O 3.14Å; H184-Y199 AromaticContact CE1-CD1 3.65Å; H184-Y199 AromaticContact CE1-CE1 3.85Å; H184-Y199 PolarHBondContact CE1-O 3.32Å; H184-Y199 PolarHBondContact ND1-O 2.76Å; H184-Y199 AromaticContact NE2-CE1 3.91Å; H184-V200 WeakPolarHBondContact NE2-CA 3.33Å; H184-G201 PolarHBondContact NE2-O 3.36Å; H184-I203 PolarHBondContact CD2-O 2.98Å; H184-I203 VanDerWaalsContact CD2-O 3.3Å; H184-L204 HydrophobicContact CB-CD1 3.93Å; H184-L242 HydrophobicContact CB-CD1 4.05Å; H184-L242 HydrophobicContact CB-CG 4.45Å; H184-F243 PolarHBondContact N-O 2.99Å; H184-R244 HydrophobicContact CB-CG 3.96Å; H184-R244 PolarHBondContact ND1-NE 3.01Å; H184-P245 VanDerWaalsContact O-CD 3.23Å; H184-P245 WeakPolarHBondContact O-CD 3.3Å
185	V	98.9	Very high	98.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.199	C	C	.	.	S	Bend	trans	-63.3	-45.3	-179.1	174.4	0	0	0	0	111.1	L173 D174 Y175 F183 S187 I203 L205 F255	L173-V185 HydrophobicContact CB-CG1 4.27Å; L173-V185 HydrophobicContact CD1-CG1 4.09Å; L173-V185 HydrophobicContact CD2-CG1 4.18Å; L173-V185 HydrophobicContact CG-CG1 4.43Å; D174-V185 WeakPolarHBondContact O-CG2 3.34Å; Y175-V185 HydrophobicContact CD2-CG1 4.5Å; Y175-V185 HydrophobicContact CD2-CG2 4.45Å; Y175-V185 HydrophobicContact CE2-CG1 3.66Å; Y175-V185 HydrophobicContact CE2-CG2 4.26Å; F183-V185 HydrophobicContact CD1-CG2 3.73Å; F183-V185 HydrophobicContact CE1-CG2 3.9Å; F183-V185 PolarHBondContact O-N 2.83Å; V185-S187 PolarHBondContact O-N 3.25Å; V185-I203 HydrophobicContact CB-CB 3.98Å; V185-I203 HydrophobicContact CB-CG2 3.73Å; V185-I203 HydrophobicContact CG1-CB 4.35Å; V185-I203 HydrophobicContact CG1-CD1 4.49Å; V185-I203 HydrophobicContact CG1-CG2 4.14Å; V185-I203 HydrophobicContact CG2-CG2 4.1Å; V185-I203 PolarHBondContact N-O 2.92Å; V185-L205 HydrophobicContact CG2-CD1 3.64Å; V185-F255 HydrophobicContact CG1-CE1 4.05Å; V185-F255 HydrophobicContact CG1-CZ 3.93Å; V185-F255 WeakPolarHBondContact O-CZ 3.43Å
186	A	98.7	Very high	98.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	S	Bend	trans	-79.7	48.1	-178.2	0	0	0	0	0	112.8	L166 H184 Y199 I203 F255	L166-A186 HydrophobicContact CD2-CB 3.87Å; H184-A186 PolarHBondContact CE1-O 3.42Å; H184-A186 PolarHBondContact NE2-O 3.14Å; A186-Y199 VanDerWaalsContact O-CE1 3.32Å; A186-Y199 WeakPolarHBondContact O-CE1 3.37Å; A186-I203 HydrophobicContact CB-CB 4.01Å; A186-I203 HydrophobicContact CB-CD1 4.49Å; A186-I203 HydrophobicContact CB-CG1 4.32Å; A186-I203 PolarHBondContact N-O 3.41Å; A186-F255 HydrophobicContact CB-CZ 4.41Å
187	S	98.2	Very high	98.3	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.007	24%	0.24	C	C	.	.			trans	-44.6	144.8	-177.3	177.3	0	0	0	0	113.2	V185 E189 L190 H191	V185-S187 PolarHBondContact O-N 3.25Å; S187-E189 PolarHBondContact O-N 3.37Å; S187-E189 PolarHBondContact OG-N 3.44Å; S187-L190 CarbonylContact O-C 3.57Å; S187-L190 PolarHBondContact O-N 2.75Å; S187-H191 PolarHBondContact O-N 2.95Å
188	P	98.3	Very high	98.2	Very high	8 Å²	8	48.5 Å²	48.5	5%	0.052	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-25.2	176.9	-14.8	23.9	0	0	0	114	L190 Y194 H195 Y196 Y199 R244	P188-L190 VanDerWaalsContact C-N 3.29Å; P188-Y194 VanDerWaalsContact CA-O 3.27Å; P188-Y194 WeakPolarHBondContact CA-O 3.5Å; P188-H195 PolarHBondContact O-ND1 3.28Å; P188-Y196 VanDerWaalsContact CG-O 3.3Å; P188-Y196 WeakPolarHBondContact CG-O 3.38Å; P188-Y199 HydrophobicContact CG-CD1 4.22Å; P188-R244 VanDerWaalsContact CD-CZ 3.45Å
189	E	98.1	Very high	98.2	Very high	146 Å²	146	48.2 Å²	48.2	68%	0.682	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-18.7	176.4	-64.8	174.4	-168.1	0	0	113	S187	S187-E189 PolarHBondContact O-N 3.37Å; S187-E189 PolarHBondContact OG-N 3.44Å
190	L	98.6	Very high	98.2	Very high	7 Å²	7	41 Å²	41	4%	0.037	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.8	-26	-173.5	-55.3	177.3	0	0	0	112.3	L173 S187 P188 P245 I248 T254 F255	L173-L190 HydrophobicContact CD2-CD1 4.17Å; S187-L190 CarbonylContact O-C 3.57Å; S187-L190 PolarHBondContact O-N 2.75Å; P188-L190 VanDerWaalsContact C-N 3.29Å; L190-P245 HydrophobicContact CD1-CB 4.03Å; L190-P245 HydrophobicContact CD1-CG 4.11Å; L190-I248 HydrophobicContact CD1-CB 4.09Å; L190-I248 HydrophobicContact CD1-CG1 4.12Å; L190-I248 HydrophobicContact CD1-CG2 4.04Å; L190-I248 HydrophobicContact CD2-CB 3.95Å; L190-I248 HydrophobicContact CD2-CG2 3.65Å; L190-T254 HydrophobicContact CB-CG2 4.29Å; L190-T254 HydrophobicContact CD1-CG2 4.24Å; L190-F255 HydrophobicContact CB-CD2 4.42Å; L190-F255 HydrophobicContact CB-CE2 3.81Å
191	H	98.6	Very high	98.2	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.019	18%	0.179	C	C	.	.	S	Bend	trans	-67.6	135.2	-178.7	-166.4	-65.4	0	0	0	110.7	S187 L193 Y194 H195 Y199	S187-H191 PolarHBondContact O-N 2.95Å; H191-L193 PolarHBondContact ND1-N 3.07Å; H191-L193 VanDerWaalsContact ND1-N 3.11Å; H191-L193 PolarHBondContact O-N 3Å; H191-Y194 AromaticContact CE1-CD2 3.41Å; H191-Y194 VanDerWaalsContact CE1-CD2 3.41Å; H191-Y194 WeakPolarHBondContact CE1-CD2 3.05Å; H191-Y194 AromaticContact CE1-CE2 3.86Å; H191-Y194 AromaticContact ND1-CD2 3.77Å; H191-Y194 PolarHBondContact ND1-N 3.11Å; H191-Y194 AromaticContact NE2-CD2 3.76Å; H191-H195 PolarHBondContact O-CE1 3.19Å; H191-Y199 HydrophobicContact CB-CE1 4.12Å; H191-Y199 AromaticContact CD2-CE1 3.59Å; H191-Y199 AromaticContact CD2-CZ 3.66Å; H191-Y199 PolarHBondContact CD2-OH 3.37Å; H191-Y199 AromaticContact CG-CE1 3.93Å; H191-Y199 PolarHBondContact NE2-OH 3.03Å; H191-Y199 VanDerWaalsContact NE2-OH 3.1Å
192	P	97.5	Very high	98.2	Very high	39 Å²	39	37.5 Å²	37.5	25%	0.253	18%	0.178	S	C	.	.	S	Bend	trans	-70.6	1	-176.5	26.3	-36.1	0	0	0	116.2	H257	P192-H257 HydrophobicContact CG-CB 3.72Å
193	L	97.5	Very high	98.2	Very high	85 Å²	85	37.5 Å²	37.5	45%	0.445	18%	0.178	S	C	.	.	S	Bend	trans	-145.3	-41.4	-169	-66.4	179.1	0	0	0	113.8	H191 H257	H191-L193 PolarHBondContact ND1-N 3.07Å; H191-L193 VanDerWaalsContact ND1-N 3.11Å; H191-L193 PolarHBondContact O-N 3Å; L193-H257 WeakPolarHBondContact CD1-CE1 3.33Å
194	Y	97.3	Very high	98.2	Very high	51 Å²	51	36.2 Å²	36.2	20%	0.2	17%	0.173	C	C	.	.			trans	-108.9	115.6	-171.7	-56.9	-64.3	0	0	0	110.5	P188 H191 Y199 W224 R266	P188-Y194 VanDerWaalsContact CA-O 3.27Å; P188-Y194 WeakPolarHBondContact CA-O 3.5Å; H191-Y194 AromaticContact CE1-CD2 3.41Å; H191-Y194 VanDerWaalsContact CE1-CD2 3.41Å; H191-Y194 WeakPolarHBondContact CE1-CD2 3.05Å; H191-Y194 AromaticContact CE1-CE2 3.86Å; H191-Y194 AromaticContact ND1-CD2 3.77Å; H191-Y194 PolarHBondContact ND1-N 3.11Å; H191-Y194 AromaticContact NE2-CD2 3.76Å; Y194-Y199 AromaticContact CD2-CE2 3.8Å; Y194-Y199 HydrophobicContact CD2-CE2 3.8Å; Y194-Y199 AromaticContact CD2-CZ 3.77Å; Y194-Y199 HydrophobicContact CG-CD2 4.33Å; Y194-Y199 AromaticContact CG-CE2 3.98Å; Y194-Y199 HydrophobicContact CG-CE2 3.98Å; Y194-W224 HydrophobicContact CE1-CH2 4.26Å; Y194-W224 HydrophobicContact CE1-CZ2 4.01Å; Y194-W224 AromaticContact CZ-CZ2 3.74Å; Y194-W224 WeakPolarHBondContact OH-CZ2 3.29Å; Y194-R266 PolarHBondContact OH-NE 3.18Å
195	H	98.1	Very high	98.2	Very high	91 Å²	91	36.2 Å²	36.2	42%	0.421	17%	0.173	S	C	.	.			trans	-120.8	6.4	-170.1	-52.7	-59.8	0	0	0	114.4	P188 H191 Y252	P188-H195 PolarHBondContact O-ND1 3.28Å; H191-H195 PolarHBondContact O-CE1 3.19Å; H195-Y252 AromaticContact CE1-CD1 3.97Å; H195-Y252 AromaticContact CE1-CE1 3.35Å; H195-Y252 WeakPolarHBondContact CE1-CE1 3.33Å; H195-Y252 AromaticContact CE1-CZ 3.54Å; H195-Y252 AromaticContact ND1-CE1 3.75Å
196	Y	97.6	Very high	98.2	Very high	84 Å²	84	36.2 Å²	36.2	33%	0.329	17%	0.173	S	C	.	.			trans	-81.4	145.9	-177.9	66.6	-86.7	0	0	0	111.5	P188 T198 Y199 D229	P188-Y196 VanDerWaalsContact CG-O 3.3Å; P188-Y196 WeakPolarHBondContact CG-O 3.38Å; Y196-T198 VanDerWaalsContact C-N 3.28Å; Y196-T198 WeakPolarHBondContact CD2-OG1 3.32Å; Y196-T198 WeakPolarHBondContact CE2-OG1 3.47Å; Y196-T198 PolarHBondContact O-N 2.84Å; Y196-T198 VanDerWaalsContact O-N 3.14Å; Y196-Y199 AromaticContact CE1-CD2 3.95Å; Y196-Y199 HydrophobicContact CE1-CD2 3.95Å; Y196-Y199 HydrophobicContact CE1-CG 4.13Å; Y196-Y199 VanDerWaalsContact CE2-CA 3.43Å; Y196-Y199 VanDerWaalsContact CZ-CB 3.48Å; Y196-Y199 AromaticContact CZ-CD2 3.82Å; Y196-Y199 VanDerWaalsContact O-CB 3.27Å; Y196-Y199 WeakPolarHBondContact O-CB 3.42Å; Y196-Y199 PolarHBondContact O-N 3.35Å; Y196-Y199 VanDerWaalsContact O-N 3.08Å; Y196-Y199 WeakPolarHBondContact OH-CD2 3.26Å; Y196-D229 VanDerWaalsContact CE2-OD1 3.31Å; Y196-D229 WeakPolarHBondContact CE2-OD1 3.16Å; Y196-D229 PolarHBondContact OH-OD1 2.95Å; Y196-D229 VanDerWaalsContact OH-OD1 3.12Å
197	K	97.1	Very high	98.2	Very high	181 Å²	181	36.4 Å²	36.4	79%	0.787	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-33.5	-166.7	-67.4	-175.8	177.8	-177.2	0	114.7	R244	K197-R244 PolarHBondContact O-NH1 3.32Å; K197-R244 PolarHBondContact O-NH2 2.83Å
198	T	97.8	Very high	98.3	Very high	52 Å²	52	37.9 Å²	37.9	32%	0.319	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	1.7	-176.4	57.7	0	0	0	0	113.7	Y196 V200 Y232	Y196-T198 VanDerWaalsContact C-N 3.28Å; Y196-T198 WeakPolarHBondContact CD2-OG1 3.32Å; Y196-T198 WeakPolarHBondContact CE2-OG1 3.47Å; Y196-T198 PolarHBondContact O-N 2.84Å; Y196-T198 VanDerWaalsContact O-N 3.14Å; T198-V200 PolarHBondContact O-N 3.29Å; T198-Y232 HydrophobicContact CG2-CD1 4.14Å; T198-Y232 HydrophobicContact CG2-CE1 3.62Å
199	Y	98.5	Very high	98.3	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.016	21%	0.21	C	C	.	.			trans	-62.2	130.2	178.3	172	-114.4	0	0	0	111.3	H184 A186 P188 H191 Y194 Y196 G201 G202 R244	H184-Y199 AromaticContact CE1-CD1 3.65Å; H184-Y199 AromaticContact CE1-CE1 3.85Å; H184-Y199 PolarHBondContact CE1-O 3.32Å; H184-Y199 PolarHBondContact ND1-O 2.76Å; H184-Y199 AromaticContact NE2-CE1 3.91Å; A186-Y199 VanDerWaalsContact O-CE1 3.32Å; A186-Y199 WeakPolarHBondContact O-CE1 3.37Å; P188-Y199 HydrophobicContact CG-CD1 4.22Å; H191-Y199 HydrophobicContact CB-CE1 4.12Å; H191-Y199 AromaticContact CD2-CE1 3.59Å; H191-Y199 AromaticContact CD2-CZ 3.66Å; H191-Y199 PolarHBondContact CD2-OH 3.37Å; H191-Y199 AromaticContact CG-CE1 3.93Å; H191-Y199 PolarHBondContact NE2-OH 3.03Å; H191-Y199 VanDerWaalsContact NE2-OH 3.1Å; Y194-Y199 AromaticContact CD2-CE2 3.8Å; Y194-Y199 HydrophobicContact CD2-CE2 3.8Å; Y194-Y199 AromaticContact CD2-CZ 3.77Å; Y194-Y199 HydrophobicContact CG-CD2 4.33Å; Y194-Y199 AromaticContact CG-CE2 3.98Å; Y194-Y199 HydrophobicContact CG-CE2 3.98Å; Y196-Y199 AromaticContact CE1-CD2 3.95Å; Y196-Y199 HydrophobicContact CE1-CD2 3.95Å; Y196-Y199 HydrophobicContact CE1-CG 4.13Å; Y196-Y199 VanDerWaalsContact CE2-CA 3.43Å; Y196-Y199 VanDerWaalsContact CZ-CB 3.48Å; Y196-Y199 AromaticContact CZ-CD2 3.82Å; Y196-Y199 VanDerWaalsContact O-CB 3.27Å; Y196-Y199 WeakPolarHBondContact O-CB 3.42Å; Y196-Y199 PolarHBondContact O-N 3.35Å; Y196-Y199 VanDerWaalsContact O-N 3.08Å; Y196-Y199 WeakPolarHBondContact OH-CD2 3.26Å; Y199-G201 VanDerWaalsContact CE2-CA 3.44Å; Y199-G201 VanDerWaalsContact CE2-N 3.29Å; Y199-G201 PolarHBondContact OH-O 2.86Å; Y199-G202 PolarHBondContact OH-N 3.17Å; Y199-R244 PolarHBondContact O-NH2 3.38Å
200	V	98.6	Very high	98.3	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.024	18%	0.183	C	C	.	.			trans	-138	19.2	179	-64.4	0	0	0	0	113.2	H184 T198 L204 D228 Y232 L242	H184-V200 WeakPolarHBondContact NE2-CA 3.33Å; T198-V200 PolarHBondContact O-N 3.29Å; V200-L204 HydrophobicContact CB-CD2 4.12Å; V200-D228 HydrophobicContact CG2-CB 4.08Å; V200-D228 WeakPolarHBondContact CG2-O 3.32Å; V200-Y232 HydrophobicContact CG1-CD2 3.73Å; V200-Y232 HydrophobicContact CG1-CG 4.44Å; V200-L242 HydrophobicContact CG1-CD1 4.2Å; V200-L242 HydrophobicContact CG1-CD2 3.62Å
201	G	98.3	Very high	98.3	Very high	3 Å²	3	38.1 Å²	38.1	3%	0.031	18%	0.181	C	C	.	.			trans	-81.5	-169.9	176.7	0	0	0	0	0	112.9	H184 Y199 I203	H184-G201 PolarHBondContact NE2-O 3.36Å; Y199-G201 VanDerWaalsContact CE2-CA 3.44Å; Y199-G201 VanDerWaalsContact CE2-N 3.29Å; Y199-G201 PolarHBondContact OH-O 2.86Å; G201-I203 PolarHBondContact O-N 3.31Å
202	G	98.6	Very high	98.3	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.01	21%	0.206	C	C	.	.	S	Bend	trans	74	-92.9	179.9	0	0	0	0	0	111.7	D163 Y199	D163-G202 PolarHBondContact N-O 2.95Å; D163-G202 VanDerWaalsContact OD2-CA 3.3Å; D163-G202 WeakPolarHBondContact OD2-CA 3.46Å; D163-G202 PolarHBondContact OD2-N 2.83Å; Y199-G202 PolarHBondContact OH-N 3.17Å
203	I	98.9	Very high	98.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	114.6	-174.2	-52.1	158.4	0	0	0	110.2	M161 L166 Y175 H184 V185 A186 G201 L205 F255	M161-I203 VanDerWaalsContact O-CA 3.3Å; M161-I203 WeakPolarHBondContact O-CA 3.48Å; L166-I203 HydrophobicContact CB-CD1 4.45Å; L166-I203 HydrophobicContact CD2-CD1 3.92Å; L166-I203 HydrophobicContact CD2-CG1 4.09Å; L166-I203 HydrophobicContact CG-CD1 4.12Å; Y175-I203 HydrophobicContact CE1-CG2 4.09Å; H184-I203 PolarHBondContact CD2-O 2.98Å; H184-I203 VanDerWaalsContact CD2-O 3.3Å; V185-I203 HydrophobicContact CB-CB 3.98Å; V185-I203 HydrophobicContact CB-CG2 3.73Å; V185-I203 HydrophobicContact CG1-CB 4.35Å; V185-I203 HydrophobicContact CG1-CD1 4.49Å; V185-I203 HydrophobicContact CG1-CG2 4.14Å; V185-I203 HydrophobicContact CG2-CG2 4.1Å; V185-I203 PolarHBondContact N-O 2.92Å; A186-I203 HydrophobicContact CB-CB 4.01Å; A186-I203 HydrophobicContact CB-CD1 4.49Å; A186-I203 HydrophobicContact CB-CG1 4.32Å; A186-I203 PolarHBondContact N-O 3.41Å; G201-I203 PolarHBondContact O-N 3.31Å; I203-L205 HydrophobicContact CG2-CD1 3.93Å; I203-F255 HydrophobicContact CD1-CD1 4.07Å; I203-F255 HydrophobicContact CD1-CE1 3.7Å
204	L	98.9	Very high	98.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	127.5	-178.9	171.8	61.9	0	0	0	110.7	M161 P182 F183 H184 V200 L206 F231 I235 L242	M161-L204 HydrophobicContact CE-CB 3.58Å; M161-L204 HydrophobicContact CE-CD2 3.28Å; M161-L204 HydrophobicContact CE-CG 3.41Å; M161-L204 VanDerWaalsContact CE-CG 3.41Å; M161-L204 PolarHBondContact N-O 2.75Å; M161-L204 PolarHBondContact O-N 3.5Å; M161-L204 VanDerWaalsContact O-N 3.11Å; P182-L204 HydrophobicContact CB-CD1 4.11Å; F183-L204 WeakPolarHBondContact O-CD1 3.3Å; H184-L204 HydrophobicContact CB-CD1 3.93Å; V200-L204 HydrophobicContact CB-CD2 4.12Å; L204-L206 HydrophobicContact CD1-CD1 4.36Å; L204-L206 HydrophobicContact CD2-CD1 4.09Å; L204-L206 HydrophobicContact CG-CD1 3.73Å; L204-F231 HydrophobicContact CD2-CD1 3.91Å; L204-F231 HydrophobicContact CD2-CE1 3.88Å; L204-I235 HydrophobicContact CD2-CD1 4.1Å; L204-L242 HydrophobicContact CD1-CD1 4.09Å
205	L	98.9	Very high	98.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	140.5	-177.9	-80.1	62	0	0	0	111.3	Y158 I159 A160 Y175 P178 P182 F183 V185 I203	Y158-L205 HydrophobicContact CD2-CD2 4.47Å; Y158-L205 HydrophobicContact CE2-CD2 4.01Å; I159-L205 VanDerWaalsContact O-CA 3.24Å; I159-L205 WeakPolarHBondContact O-CA 3.35Å; A160-L205 HydrophobicContact CB-CD1 3.65Å; A160-L205 HydrophobicContact CB-CG 3.86Å; Y175-L205 HydrophobicContact CD1-CD1 4.38Å; Y175-L205 HydrophobicContact CD1-CD2 4.3Å; Y175-L205 HydrophobicContact CG-CD2 4.46Å; P178-L205 HydrophobicContact CG-CB 4.18Å; P182-L205 CarbonylContact C-O 3.49Å; P182-L205 VanDerWaalsContact CA-O 3.32Å; P182-L205 WeakPolarHBondContact CA-O 3.38Å; F183-L205 HydrophobicContact CB-CB 4.35Å; F183-L205 PolarHBondContact N-O 3.16Å; F183-L205 PolarHBondContact O-N 2.79Å; V185-L205 HydrophobicContact CG2-CD1 3.64Å; I203-L205 HydrophobicContact CG2-CD1 3.93Å
206	L	98.9	Very high	98.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	142.9	174.2	-64.7	93.4	0	0	0	110.4	Y158 I159 M161 P182 L204 H210 Y211 F231	Y158-L206 WeakPolarHBondContact CA-O 3.41Å; Y158-L206 VanDerWaalsContact CB-O 3.31Å; Y158-L206 WeakPolarHBondContact CB-O 3.37Å; I159-L206 HydrophobicContact CG1-CB 4.38Å; I159-L206 PolarHBondContact N-O 2.79Å; I159-L206 PolarHBondContact O-N 3.44Å; M161-L206 HydrophobicContact CE-CD1 3.5Å; P182-L206 HydrophobicContact CB-CD2 4.03Å; P182-L206 HydrophobicContact CB-CG 3.86Å; P182-L206 HydrophobicContact CG-CD2 3.63Å; P182-L206 HydrophobicContact CG-CG 3.94Å; L204-L206 HydrophobicContact CD1-CD1 4.36Å; L204-L206 HydrophobicContact CD2-CD1 4.09Å; L204-L206 HydrophobicContact CG-CD1 3.73Å; L206-H210 HydrophobicContact CB-CB 4.43Å; L206-H210 HydrophobicContact CD2-CB 4.34Å; L206-Y211 HydrophobicContact CD1-CD2 4.37Å; L206-Y211 HydrophobicContact CD2-CD2 4.22Å; L206-F231 HydrophobicContact CD1-CE1 3.99Å; L206-F231 HydrophobicContact CD1-CZ 4.38Å; L206-F231 HydrophobicContact CD2-CE1 3.97Å; L206-F231 HydrophobicContact CD2-CZ 3.78Å
207	S	98.9	Very high	98.6	Very high	4 Å²	4	34.2 Å²	34.2	3%	0.028	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	153.3	162.3	71.2	0	0	0	0	109.9	Q209 H210 Y211	S207-Q209 PolarHBondContact O-N 2.94Å; S207-H210 PolarHBondContact O-N 3.14Å; S207-H210 VanDerWaalsContact O-N 3.14Å; S207-H210 WeakPolarHBondContact OG-CB 3.04Å; S207-H210 PolarHBondContact OG-N 3.44Å; S207-H210 VanDerWaalsContact OG-N 3.08Å; S207-H210 PolarHBondContact OG-ND1 3.08Å; S207-H210 VanDerWaalsContact OG-ND1 3.16Å; S207-Y211 PolarHBondContact O-N 3.14Å
208	K	98.8	Very high	98.7	Very high	31 Å²	31	25.7 Å²	25.7	14%	0.135	13%	0.13	C	C	.	.	H	α-helix	trans	-57.5	-38.6	176.4	-78.8	-159.9	175.4	169.3	0	112.1	F149 S153 T156 D157 Y211 Q212	F149-K208 HydrophobicContact CE2-CB 3.91Å; F149-K208 HydrophobicContact CE2-CD 4.17Å; F149-K208 HydrophobicContact CE2-CG 3.65Å; F149-K208 HydrophobicContact CZ-CB 3.97Å; F149-K208 HydrophobicContact CZ-CD 4.07Å; F149-K208 HydrophobicContact CZ-CG 3.95Å; S153-K208 PolarHBondContact O-NZ 3.24Å; T156-K208 WeakPolarHBondContact O-CD 3.38Å; T156-K208 WeakPolarHBondContact O-CE 3.46Å; T156-K208 PolarHBondContact O-NZ 2.82Å; T156-K208 VanDerWaalsContact O-NZ 3.16Å; D157-K208 PolarHBondContact O-N 3.06Å; K208-Y211 PolarHBondContact O-N 2.82Å; K208-Q212 WeakPolarHBondContact O-CB 3.47Å; K208-Q212 VanDerWaalsContact O-CG 3.3Å; K208-Q212 WeakPolarHBondContact O-CG 3.47Å; K208-Q212 PolarHBondContact O-N 2.86Å
209	Q	98.8	Very high	98.7	Very high	143 Å²	143	24.3 Å²	24.3	67%	0.668	12%	0.121	S	C	*	.	H	α-helix	trans	-59.1	-48.1	175.5	-176.1	-178.3	1	0	0	112.3	S207 Y211 Q212 L213	S207-Q209 PolarHBondContact O-N 2.94Å; Q209-Y211 PolarHBondContact O-N 2.6Å; Q209-Q212 PolarHBondContact O-N 2.78Å; Q209-L213 WeakPolarHBondContact O-CB 3.38Å; Q209-L213 PolarHBondContact O-N 2.68Å
210	H	98.9	Very high	98.7	Very high	24 Å²	24	27.7 Å²	27.7	11%	0.111	13%	0.133	C	C	.	.	H	α-helix	trans	-65.8	-38.8	178.8	-69.3	156.2	0	0	0	112.2	E179 L206 S207 L213 C214 L240	E179-H210 PolarHBondContact O-CE1 2.77Å; L206-H210 HydrophobicContact CB-CB 4.43Å; L206-H210 HydrophobicContact CD2-CB 4.34Å; S207-H210 PolarHBondContact O-N 3.14Å; S207-H210 VanDerWaalsContact O-N 3.14Å; S207-H210 WeakPolarHBondContact OG-CB 3.04Å; S207-H210 PolarHBondContact OG-N 3.44Å; S207-H210 VanDerWaalsContact OG-N 3.08Å; S207-H210 PolarHBondContact OG-ND1 3.08Å; S207-H210 VanDerWaalsContact OG-ND1 3.16Å; H210-L213 PolarHBondContact O-N 2.87Å; H210-C214 PolarHBondContact O-N 2.9Å; H210-C214 PolarHBondContact O-SG 2.79Å; H210-L240 HydrophobicContact CB-CD1 3.92Å
211	Y	98.9	Very high	98.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65	-41.9	177	-165.3	-98.6	0	0	0	112.1	I145 N146 F149 I159 M161 L206 S207 K208 Q209 C214 N215 G216 M217 F231 L287	I145-Y211 HydrophobicContact CG2-CE2 4.15Å; I145-Y211 VanDerWaalsContact CG2-OH 3.25Å; I145-Y211 WeakPolarHBondContact CG2-OH 3.39Å; N146-Y211 PolarHBondContact OD1-OH 2.81Å; F149-Y211 HydrophobicContact CB-CD1 4.24Å; F149-Y211 HydrophobicContact CB-CE1 3.9Å; F149-Y211 HydrophobicContact CD1-CD1 4.28Å; F149-Y211 AromaticContact CD2-CD1 3.27Å; F149-Y211 HydrophobicContact CD2-CD1 3.27Å; F149-Y211 AromaticContact CD2-CE1 3.82Å; F149-Y211 HydrophobicContact CD2-CE1 3.82Å; F149-Y211 AromaticContact CD2-CG 3.88Å; F149-Y211 HydrophobicContact CD2-CG 3.88Å; F149-Y211 AromaticContact CE2-CD1 3.57Å; F149-Y211 HydrophobicContact CE2-CD1 3.57Å; F149-Y211 HydrophobicContact CE2-CG 4Å; F149-Y211 AromaticContact CG-CD1 3.67Å; F149-Y211 HydrophobicContact CG-CD1 3.67Å; F149-Y211 AromaticContact CG-CE1 3.82Å; F149-Y211 HydrophobicContact CG-CE1 3.82Å; F149-Y211 HydrophobicContact CZ-CD1 4.23Å; I159-Y211 HydrophobicContact CD1-CD1 4.43Å; I159-Y211 HydrophobicContact CD1-CD2 3.58Å; I159-Y211 HydrophobicContact CD1-CE2 3.83Å; I159-Y211 HydrophobicContact CD1-CG 3.9Å; M161-Y211 HydrophobicContact SD-CE2 3.95Å; L206-Y211 HydrophobicContact CD1-CD2 4.37Å; L206-Y211 HydrophobicContact CD2-CD2 4.22Å; S207-Y211 PolarHBondContact O-N 3.14Å; K208-Y211 PolarHBondContact O-N 2.82Å; Q209-Y211 PolarHBondContact O-N 2.6Å; Y211-C214 PolarHBondContact O-N 3.27Å; Y211-N215 PolarHBondContact O-N 3.09Å; Y211-G216 VanDerWaalsContact CZ-CA 3.47Å; Y211-G216 PolarHBondContact O-N 2.94Å; Y211-M217 HydrophobicContact CE2-CG 4.2Å; Y211-M217 PolarHBondContact OH-N 2.85Å; Y211-F231 HydrophobicContact CD2-CE2 4.46Å; Y211-F231 AromaticContact CD2-CZ 3.82Å; Y211-F231 HydrophobicContact CD2-CZ 3.82Å; Y211-F231 HydrophobicContact CE2-CE2 4.22Å; Y211-F231 AromaticContact CE2-CZ 3.81Å; Y211-F231 HydrophobicContact CE2-CZ 3.81Å; Y211-L287 HydrophobicContact CD1-CD2 4.16Å; Y211-L287 HydrophobicContact CE1-CD1 4.19Å; Y211-L287 HydrophobicContact CE1-CD2 4.31Å
212	Q	98.6	Very high	98.7	Very high	116 Å²	116	28.6 Å²	28.6	54%	0.542	14%	0.136	S	C	.	.	H	α-helix	trans	-64	-40.5	174	-74.1	170.9	-34	0	0	112.4	F149 K208 Q209 C214 N215 L287	F149-Q212 HydrophobicContact CE1-CG 4.02Å; F149-Q212 HydrophobicContact CZ-CG 3.63Å; K208-Q212 WeakPolarHBondContact O-CB 3.47Å; K208-Q212 VanDerWaalsContact O-CG 3.3Å; K208-Q212 WeakPolarHBondContact O-CG 3.47Å; K208-Q212 PolarHBondContact O-N 2.86Å; Q209-Q212 PolarHBondContact O-N 2.78Å; Q212-C214 PolarHBondContact O-N 2.86Å; Q212-N215 WeakPolarHBondContact O-CA 3.49Å; Q212-N215 PolarHBondContact O-N 2.92Å; Q212-L287 HydrophobicContact CG-CD2 4.22Å
213	L	98.6	Very high	98.7	Very high	107 Å²	107	29 Å²	29	56%	0.56	14%	0.14	S	C	*	.	H	α-helix	trans	-60.2	-33.6	177.2	-174	64.6	0	0	0	112.1	Q209 H210 N215 A238 L240	Q209-L213 WeakPolarHBondContact O-CB 3.38Å; Q209-L213 PolarHBondContact O-N 2.68Å; H210-L213 PolarHBondContact O-N 2.87Å; L213-N215 PolarHBondContact O-N 3.35Å; L213-A238 HydrophobicContact CD2-CB 4.21Å; L213-A238 HydrophobicContact CG-CB 4.08Å; L213-L240 HydrophobicContact CD2-CD1 4.34Å; L213-L240 HydrophobicContact CD2-CD2 4.08Å; L213-L240 HydrophobicContact CD2-CG 4.23Å
214	C	98.6	Very high	98.6	Very high	9 Å²	9	33.5 Å²	33.5	6%	0.061	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-3.1	173.6	-68.1	0	0	0	0	114.1	H210 Y211 Q212 G216 F231 R234	H210-C214 PolarHBondContact O-N 2.9Å; H210-C214 PolarHBondContact O-SG 2.79Å; Y211-C214 PolarHBondContact O-N 3.27Å; Q212-C214 PolarHBondContact O-N 2.86Å; C214-G216 PolarHBondContact O-N 3.36Å; C214-F231 HydrophobicContact CB-CE2 3.81Å; C214-F231 HydrophobicContact CB-CZ 4.29Å; C214-R234 HydrophobicContact CB-CB 4.3Å; C214-R234 PolarHBondContact O-NH1 3.11Å
215	N	98.7	Very high	98.5	Very high	38 Å²	38	34 Å²	34	20%	0.203	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	41.6	-163.5	-171.6	27.7	0	0	0	111.9	Y211 Q212 L213 R234 G286 L287 N288	Y211-N215 PolarHBondContact O-N 3.09Å; Q212-N215 WeakPolarHBondContact O-CA 3.49Å; Q212-N215 PolarHBondContact O-N 2.92Å; L213-N215 PolarHBondContact O-N 3.35Å; N215-R234 PolarHBondContact O-NH1 2.92Å; N215-G286 CarbonylContact O-C 3.57Å; N215-G286 WeakPolarHBondContact O-CA 3.25Å; N215-L287 PolarHBondContact O-N 3.27Å; N215-L287 PolarHBondContact OD1-N 3.14Å; N215-N288 PolarHBondContact ND2-ND2 2.79Å; N215-N288 PolarHBondContact ND2-OD1 3.23Å; N215-N288 PolarHBondContact OD1-N 3.21Å; N215-N288 VanDerWaalsContact OD1-N 3.11Å; N215-N288 PolarHBondContact OD1-ND2 3.23Å; N215-N288 PolarHBondContact OD1-OD1 3.37Å; N215-N288 VanDerWaalsContact OD1-OD1 3.11Å
216	G	98.7	Very high	98.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.178	C	C	.	.	S	Bend	trans	52.3	-154.5	-174.9	0	0	0	0	0	114.5	Y211 C214 F231 R234	Y211-G216 VanDerWaalsContact CZ-CA 3.47Å; Y211-G216 PolarHBondContact O-N 2.94Å; C214-G216 PolarHBondContact O-N 3.36Å; G216-F231 VanDerWaalsContact O-CE2 3.31Å; G216-F231 WeakPolarHBondContact O-CE2 3.43Å; G216-R234 VanDerWaalsContact O-CD 3.26Å; G216-R234 WeakPolarHBondContact O-CD 3.3Å; G216-R234 PolarHBondContact O-NH1 3.02Å
217	M	98.8	Very high	98.4	Very high	2 Å²	2	39 Å²	39	1%	0.01	18%	0.182	C	C	.	.	S	Bend	trans	-91.9	157.9	-179.3	-57.9	-175.7	81.8	0	0	111.6	A142 I145 N146 M161 Y211 E227 F231 G286	A142-M217 HydrophobicContact CB-CB 3.61Å; A142-M217 HydrophobicContact CB-CE 4.03Å; A142-M217 HydrophobicContact CB-CG 4.42Å; A142-M217 HydrophobicContact CB-SD 4Å; I145-M217 HydrophobicContact CB-SD 4.16Å; I145-M217 HydrophobicContact CG1-SD 4.25Å; I145-M217 HydrophobicContact CG2-SD 4.36Å; N146-M217 PolarHBondContact ND2-O 2.92Å; N146-M217 PolarHBondContact OD1-N 3.22Å; M161-M217 HydrophobicContact SD-CG 4.39Å; M161-M217 HydrophobicContact SD-SD 3.62Å; M161-M217 VanDerWaalsContact SD-SD 3.62Å; Y211-M217 HydrophobicContact CE2-CG 4.2Å; Y211-M217 PolarHBondContact OH-N 2.85Å; M217-E227 HydrophobicContact CE-CG 3.92Å; M217-F231 HydrophobicContact CB-CD2 4.22Å; M217-F231 HydrophobicContact CE-CB 3.8Å; M217-F231 HydrophobicContact CE-CD1 4.4Å; M217-F231 HydrophobicContact CE-CG 4.08Å; M217-F231 HydrophobicContact CG-CB 4.31Å; M217-F231 HydrophobicContact CG-CD1 4.32Å; M217-F231 HydrophobicContact CG-CD2 3.59Å; M217-F231 HydrophobicContact CG-CE2 3.9Å; M217-F231 HydrophobicContact CG-CG 3.82Å; M217-F231 HydrophobicContact CG-CZ 4.39Å; M217-G286 WeakPolarHBondContact O-CA 3.08Å
218	S	98.6	Very high	98.3	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.007	19%	0.185	C	C	.	.			trans	-66.4	139	172.8	175.6	0	0	0	0	112.2	A142 R220 D282	A142-S218 WeakPolarHBondContact CB-O 3.49Å; S218-R220 VanDerWaalsContact C-N 3.28Å; S218-R220 PolarHBondContact O-N 3.33Å; S218-R220 PolarHBondContact OG-N 3.4Å; S218-D282 WeakPolarHBondContact CB-OD2 3.49Å; S218-D282 WeakPolarHBondContact OG-CB 3.33Å; S218-D282 PolarHBondContact OG-OD2 3.04Å
219	N	98.6	Very high	98.3	Very high	24 Å²	24	39.1 Å²	39.1	13%	0.128	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-4.2	176.3	-58	-48.6	0	0	0	113.4	N140 A143 N146 F221 G286 T289 V290	N140-N219 PolarHBondContact ND2-O 2.99Å; A143-N219 HydrophobicContact CB-CB 4.44Å; N146-N219 PolarHBondContact ND2-OD1 3.42Å; N219-F221 VanDerWaalsContact C-N 3.35Å; N219-F221 PolarHBondContact O-N 3.1Å; N219-G286 PolarHBondContact ND2-O 3.17Å; N219-T289 PolarHBondContact ND2-OG1 2.81Å; N219-V290 WeakPolarHBondContact ND2-CA 3.25Å; N219-V290 PolarHBondContact ND2-N 3.03Å; N219-V290 WeakPolarHBondContact OD1-CB 3.34Å; N219-V290 WeakPolarHBondContact OD1-CG2 3.37Å
220	R	98.3	Very high	98.3	Very high	74 Å²	74	32.3 Å²	32.3	28%	0.279	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-3.9	-166.5	-57.9	176.3	68.3	78.7	4.3	114	S218 W222 D282 A320 T321 W323	S218-R220 VanDerWaalsContact C-N 3.28Å; S218-R220 PolarHBondContact O-N 3.33Å; S218-R220 PolarHBondContact OG-N 3.4Å; R220-W222 PolarHBondContact O-N 3.26Å; R220-D282 WeakPolarHBondContact CD-OD2 3.42Å; R220-D282 WeakPolarHBondContact CG-OD2 3.1Å; R220-A320 PolarHBondContact NH2-O 3.25Å; R220-T321 HydrophobicContact CB-CG2 3.95Å; R220-T321 HydrophobicContact CG-CG2 4Å; R220-W323 PolarHBondContact O-NE1 3.49Å
221	F	98.3	Very high	98.3	Very high	18 Å²	18	31.2 Å²	31.2	8%	0.079	15%	0.147	C	C	.	.			trans	-95.9	89.4	-173.4	-67.7	-89.9	0	0	0	111.9	N140 N219 R226 E227 E230 Q278	N140-F221 VanDerWaalsContact CG-O 3.3Å; N140-F221 PolarHBondContact OD1-O 3.02Å; N219-F221 VanDerWaalsContact C-N 3.35Å; N219-F221 PolarHBondContact O-N 3.1Å; F221-R226 HydrophobicContact CD1-CB 3.89Å; F221-R226 HydrophobicContact CE1-CB 3.56Å; F221-R226 WeakPolarHBondContact CE1-O 3.48Å; F221-E227 HydrophobicContact CB-CB 3.54Å; F221-E227 HydrophobicContact CD1-CB 4.19Å; F221-E227 HydrophobicContact CD2-CB 3.98Å; F221-E227 HydrophobicContact CG-CB 3.64Å; F221-E230 HydrophobicContact CE2-CB 3.7Å; F221-E230 HydrophobicContact CE2-CG 3.78Å; F221-E230 HydrophobicContact CZ-CB 3.58Å; F221-E230 HydrophobicContact CZ-CG 3.81Å; F221-Q278 HydrophobicContact CE1-CB 4.26Å
222	W	98.4	Very high	98.3	Very high	8 Å²	8	33.8 Å²	33.8	3%	0.03	16%	0.157	C	C	.	.			trans	-97.9	124.1	176.1	-56.5	95.3	0	0	0	111.5	F137 R138 N140 R220 Q274 L314 C316 T321 W323 C324	F137-W222 HydrophobicContact CB-CE3 3.84Å; F137-W222 HydrophobicContact CB-CH2 4.22Å; F137-W222 HydrophobicContact CB-CZ3 3.48Å; F137-W222 VanDerWaalsContact CB-CZ3 3.48Å; F137-W222 HydrophobicContact CD2-CH2 4.16Å; F137-W222 HydrophobicContact CD2-CZ3 4.23Å; F137-W222 HydrophobicContact CG-CH2 4.4Å; F137-W222 HydrophobicContact CG-CZ3 4.14Å; R138-W222 HydrophobicContact CB-CB 4.16Å; R138-W222 VanDerWaalsContact O-CE3 3.24Å; N140-W222 HydrophobicContact CB-CD2 4.14Å; N140-W222 HydrophobicContact CB-CE3 3.57Å; N140-W222 HydrophobicContact CB-CH2 4.39Å; N140-W222 HydrophobicContact CB-CZ3 3.7Å; R220-W222 PolarHBondContact O-N 3.26Å; W222-Q274 PolarHBondContact O-NE2 2.98Å; W222-L314 HydrophobicContact CH2-CB 3.89Å; W222-L314 HydrophobicContact CH2-CD1 4.18Å; W222-L314 HydrophobicContact CZ3-CB 4.39Å; W222-L314 HydrophobicContact CZ3-CD1 4.16Å; W222-C316 HydrophobicContact CH2-CB 4.22Å; W222-C316 HydrophobicContact CZ2-CB 3.86Å; W222-T321 PolarHBondContact NE1-OG1 3Å; W222-W323 AromaticContact CD1-CD1 3.92Å; W222-W323 AromaticContact CD1-NE1 3.79Å; W222-C324 HydrophobicContact CB-CB 4.21Å; W222-C324 HydrophobicContact CD2-CB 3.4Å; W222-C324 VanDerWaalsContact CE2-CB 3.48Å; W222-C324 HydrophobicContact CE3-CB 3.96Å; W222-C324 HydrophobicContact CG-CB 3.5Å; W222-C324 HydrophobicContact CZ2-CB 4.13Å
223	G	98.1	Very high	98.3	Very high	9 Å²	9	31.7 Å²	31.7	9%	0.093	14%	0.144	C	C	.	.	S	Bend	trans	92.8	-174.6	-170.7	0	0	0	0	0	112.4	F139	F139-G223 PolarHBondContact O-N 3.45Å
224	W	97.8	Very high	98.3	Very high	96 Å²	96	27.7 Å²	27.7	36%	0.364	12%	0.121	S	C	.	.	S	Bend	trans	-78.3	127.4	-173	-177.1	85.5	0	0	0	113	Y194 R266 D267 Q268 R270	Y194-W224 HydrophobicContact CE1-CH2 4.26Å; Y194-W224 HydrophobicContact CE1-CZ2 4.01Å; Y194-W224 AromaticContact CZ-CZ2 3.74Å; Y194-W224 WeakPolarHBondContact OH-CZ2 3.29Å; W224-R266 HydrophobicContact CB-CB 4.25Å; W224-R266 HydrophobicContact CD2-CB 4.4Å; W224-R266 HydrophobicContact CG-CB 3.97Å; W224-R266 HydrophobicContact CG-CG 4.2Å; W224-D267 WeakPolarHBondContact CB-O 3.32Å; W224-D267 PolarHBondContact N-O 3.2Å; W224-Q268 HydrophobicContact CB-CG 4.41Å; W224-Q268 HydrophobicContact CD2-CG 4.21Å; W224-Q268 HydrophobicContact CE3-CG 3.7Å; W224-Q268 HydrophobicContact CZ3-CG 4.42Å; W224-R270 VanDerWaalsContact O-CZ 3.26Å; W224-R270 PolarHBondContact O-NH1 2.92Å; W224-R270 PolarHBondContact O-NH2 3.39Å
225	G	95.6	Very high	98.3	Very high	11 Å²	11	27.2 Å²	27.2	11%	0.113	12%	0.119	C	C	.	.	S	Bend	trans	97	158.1	158.3	0	0	0	0	0	116.2	E227	G225-E227 VanDerWaalsContact C-N 3.32Å; G225-E227 WeakPolarHBondContact CA-OE2 3.47Å
226	R	97.5	Very high	98.3	Very high	87 Å²	87	30 Å²	30	33%	0.328	13%	0.128	S	C	.	.	S	Bend	trans	80.9	-10.9	178.1	-55.5	-59.6	-169.5	-178.2	-2.3	116.1	F221 D228 D229 E230 Q278	F221-R226 HydrophobicContact CD1-CB 3.89Å; F221-R226 HydrophobicContact CE1-CB 3.56Å; F221-R226 WeakPolarHBondContact CE1-O 3.48Å; R226-D228 VanDerWaalsContact C-N 3.29Å; R226-D229 WeakPolarHBondContact CD-OD2 3.27Å; R226-D229 IonicContact CZ-OD2 3.62Å; R226-D229 IonicContact NE-OD2 2.65Å; R226-D229 IonicContact NH1-OD2 3.17Å; R226-D229 PolarHBondContact NH1-OD2 2.78Å; R226-D229 PolarHBondContact O-N 3.14Å; R226-E230 WeakPolarHBondContact O-CB 3.22Å; R226-E230 PolarHBondContact O-N 3.48Å; R226-Q278 HydrophobicContact CB-CB 4.19Å; R226-Q278 HydrophobicContact CG-CB 4.02Å; R226-Q278 HydrophobicContact CG-CG 4.13Å
227	E	98.6	Very high	98.2	Very high	17 Å²	17	33.3 Å²	33.3	8%	0.079	16%	0.163	C	C	.	.	H	α-helix	trans	-69.2	-33.5	176.4	86.8	-65.7	171.6	0	0	111.5	R141 A142 M217 F221 G225 F231	R141-E227 WeakPolarHBondContact CD-OE1 3.44Å; R141-E227 IonicContact CZ-OE1 3.3Å; R141-E227 IonicContact NE-OE1 2.77Å; R141-E227 IonicContact NH1-OE1 3.53Å; R141-E227 PolarHBondContact NH1-OE1 2.8Å; A142-E227 HydrophobicContact CB-CB 3.85Å; A142-E227 HydrophobicContact CB-CG 3.82Å; M217-E227 HydrophobicContact CE-CG 3.92Å; F221-E227 HydrophobicContact CB-CB 3.54Å; F221-E227 HydrophobicContact CD1-CB 4.19Å; F221-E227 HydrophobicContact CD2-CB 3.98Å; F221-E227 HydrophobicContact CG-CB 3.64Å; G225-E227 VanDerWaalsContact C-N 3.32Å; G225-E227 WeakPolarHBondContact CA-OE2 3.47Å; E227-F231 WeakPolarHBondContact O-CB 3.13Å; E227-F231 PolarHBondContact O-N 3.21Å
228	D	98.4	Very high	98.2	Very high	17 Å²	17	34.7 Å²	34.7	9%	0.091	18%	0.175	C	C	.	.	H	α-helix	trans	-68.8	-46.1	172.9	57.8	-15.9	0	0	0	112	V200 R226 E230 F231 Y232	V200-D228 HydrophobicContact CG2-CB 4.08Å; V200-D228 WeakPolarHBondContact CG2-O 3.32Å; R226-D228 VanDerWaalsContact C-N 3.29Å; D228-E230 VanDerWaalsContact C-N 3.28Å; D228-E230 PolarHBondContact O-N 3.44Å; D228-F231 PolarHBondContact O-N 2.87Å; D228-Y232 PolarHBondContact O-N 2.78Å
229	D	98.4	Very high	98.2	Very high	21 Å²	21	37.9 Å²	37.9	11%	0.112	21%	0.208	C	C	.	.	H	α-helix	trans	-58.6	-38.3	174.3	-74.9	-39	0	0	0	112.5	Y196 R226 R233	Y196-D229 VanDerWaalsContact CE2-OD1 3.31Å; Y196-D229 WeakPolarHBondContact CE2-OD1 3.16Å; Y196-D229 PolarHBondContact OH-OD1 2.95Å; Y196-D229 VanDerWaalsContact OH-OD1 3.12Å; R226-D229 WeakPolarHBondContact CD-OD2 3.27Å; R226-D229 IonicContact CZ-OD2 3.62Å; R226-D229 IonicContact NE-OD2 2.65Å; R226-D229 IonicContact NH1-OD2 3.17Å; R226-D229 PolarHBondContact NH1-OD2 2.78Å; R226-D229 PolarHBondContact O-N 3.14Å; D229-R233 PolarHBondContact O-N 2.87Å; D229-R233 PolarHBondContact O-NE 3.47Å
230	E	98.6	Very high	98.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-69.5	-44.1	174.7	-160.6	-83.7	167.6	0	0	111.5	F221 R226 D228 Y232 R233 R234 D282	F221-E230 HydrophobicContact CE2-CB 3.7Å; F221-E230 HydrophobicContact CE2-CG 3.78Å; F221-E230 HydrophobicContact CZ-CB 3.58Å; F221-E230 HydrophobicContact CZ-CG 3.81Å; R226-E230 WeakPolarHBondContact O-CB 3.22Å; R226-E230 PolarHBondContact O-N 3.48Å; D228-E230 VanDerWaalsContact C-N 3.28Å; D228-E230 PolarHBondContact O-N 3.44Å; E230-Y232 VanDerWaalsContact C-N 3.32Å; E230-Y232 PolarHBondContact O-N 3.3Å; E230-R233 VanDerWaalsContact CG-NH2 3.33Å; E230-R233 WeakPolarHBondContact O-CA 3.45Å; E230-R233 WeakPolarHBondContact O-CB 3.48Å; E230-R233 PolarHBondContact O-N 3.03Å; E230-R234 VanDerWaalsContact CD-NE 3.32Å; E230-R234 PolarHBondContact O-N 2.99Å; E230-R234 VanDerWaalsContact O-N 3.07Å; E230-R234 IonicContact OE1-CZ 3.32Å; E230-R234 IonicContact OE1-NE 3.29Å; E230-R234 PolarHBondContact OE1-NE 3.12Å; E230-R234 IonicContact OE1-NH2 2.86Å; E230-R234 PolarHBondContact OE1-NH2 3.01Å; E230-R234 WeakPolarHBondContact OE2-CD 3.3Å; E230-R234 IonicContact OE2-CZ 3.85Å; E230-R234 IonicContact OE2-NE 3.46Å; E230-R234 PolarHBondContact OE2-NE 3.41Å; E230-R234 IonicContact OE2-NH2 3.68Å; E230-D282 PolarHBondContact OE1-N 2.95Å
231	F	98.7	Very high	98.2	Very high	1 Å²	1	40 Å²	40	0%	0.004	22%	0.221	C	C	.	.	H	α-helix	trans	-64.6	-34.7	177.6	-167.1	-119.4	0	0	0	113	M161 L204 L206 Y211 C214 G216 M217 E227 D228 R233 R234 I235	M161-F231 HydrophobicContact CE-CD1 4.12Å; M161-F231 HydrophobicContact CE-CE1 3.73Å; M161-F231 HydrophobicContact SD-CE1 4.4Å; L204-F231 HydrophobicContact CD2-CD1 3.91Å; L204-F231 HydrophobicContact CD2-CE1 3.88Å; L206-F231 HydrophobicContact CD1-CE1 3.99Å; L206-F231 HydrophobicContact CD1-CZ 4.38Å; L206-F231 HydrophobicContact CD2-CE1 3.97Å; L206-F231 HydrophobicContact CD2-CZ 3.78Å; Y211-F231 HydrophobicContact CD2-CE2 4.46Å; Y211-F231 AromaticContact CD2-CZ 3.82Å; Y211-F231 HydrophobicContact CD2-CZ 3.82Å; Y211-F231 HydrophobicContact CE2-CE2 4.22Å; Y211-F231 AromaticContact CE2-CZ 3.81Å; Y211-F231 HydrophobicContact CE2-CZ 3.81Å; C214-F231 HydrophobicContact CB-CE2 3.81Å; C214-F231 HydrophobicContact CB-CZ 4.29Å; G216-F231 VanDerWaalsContact O-CE2 3.31Å; G216-F231 WeakPolarHBondContact O-CE2 3.43Å; M217-F231 HydrophobicContact CB-CD2 4.22Å; M217-F231 HydrophobicContact CE-CB 3.8Å; M217-F231 HydrophobicContact CE-CD1 4.4Å; M217-F231 HydrophobicContact CE-CG 4.08Å; M217-F231 HydrophobicContact CG-CB 4.31Å; M217-F231 HydrophobicContact CG-CD1 4.32Å; M217-F231 HydrophobicContact CG-CD2 3.59Å; M217-F231 HydrophobicContact CG-CE2 3.9Å; M217-F231 HydrophobicContact CG-CG 3.82Å; M217-F231 HydrophobicContact CG-CZ 4.39Å; E227-F231 WeakPolarHBondContact O-CB 3.13Å; E227-F231 PolarHBondContact O-N 3.21Å; D228-F231 PolarHBondContact O-N 2.87Å; F231-R233 VanDerWaalsContact C-N 3.26Å; F231-R233 PolarHBondContact O-N 2.99Å; F231-R234 HydrophobicContact CD2-CB 4.25Å; F231-R234 WeakPolarHBondContact O-CB 3.37Å; F231-R234 PolarHBondContact O-N 2.88Å; F231-R234 VanDerWaalsContact O-N 3.09Å; F231-I235 HydrophobicContact CD1-CD1 3.86Å; F231-I235 HydrophobicContact CD1-CG1 4.31Å; F231-I235 HydrophobicContact CE1-CD1 3.78Å; F231-I235 HydrophobicContact CE1-CG1 4.09Å; F231-I235 HydrophobicContact CZ-CG1 4.37Å; F231-I235 WeakPolarHBondContact O-CG1 3.31Å; F231-I235 PolarHBondContact O-N 3.38Å
232	Y	98.7	Very high	98.2	Very high	54 Å²	54	40.4 Å²	40.4	21%	0.212	22%	0.224	C	C	.	.	H	α-helix	trans	-55.4	-42.7	169.8	175	-98	0	0	0	111.8	T198 V200 D228 E230 R234 I235 K236 L242	T198-Y232 HydrophobicContact CG2-CD1 4.14Å; T198-Y232 HydrophobicContact CG2-CE1 3.62Å; V200-Y232 HydrophobicContact CG1-CD2 3.73Å; V200-Y232 HydrophobicContact CG1-CG 4.44Å; D228-Y232 PolarHBondContact O-N 2.78Å; E230-Y232 VanDerWaalsContact C-N 3.32Å; E230-Y232 PolarHBondContact O-N 3.3Å; Y232-R234 VanDerWaalsContact C-N 3.34Å; Y232-I235 PolarHBondContact O-N 3.1Å; Y232-K236 HydrophobicContact CD1-CG 4.44Å; Y232-K236 HydrophobicContact CE1-CG 3.94Å; Y232-K236 HydrophobicContact CE2-CG 4.32Å; Y232-K236 WeakPolarHBondContact O-CG 3.44Å; Y232-K236 PolarHBondContact O-N 3.4Å; Y232-K236 VanDerWaalsContact OH-CE 3.29Å; Y232-K236 WeakPolarHBondContact OH-CE 3.48Å; Y232-L242 HydrophobicContact CD2-CD2 4.2Å; Y232-L242 HydrophobicContact CE2-CD2 4.04Å
233	R	98.5	Very high	98.2	Very high	72 Å²	72	43 Å²	43	27%	0.272	24%	0.235	S	C	.	.	H	α-helix	trans	-67.7	-34.1	177.4	-67.9	176.3	-71.2	158.9	0.7	111.8	D229 E230 F231 K236 G237 F279 K280 V281	D229-R233 PolarHBondContact O-N 2.87Å; D229-R233 PolarHBondContact O-NE 3.47Å; E230-R233 VanDerWaalsContact CG-NH2 3.33Å; E230-R233 WeakPolarHBondContact O-CA 3.45Å; E230-R233 WeakPolarHBondContact O-CB 3.48Å; E230-R233 PolarHBondContact O-N 3.03Å; F231-R233 VanDerWaalsContact C-N 3.26Å; F231-R233 PolarHBondContact O-N 2.99Å; R233-K236 PolarHBondContact O-N 3.4Å; R233-G237 PolarHBondContact O-N 3.09Å; R233-F279 PolarHBondContact NH1-O 3.21Å; R233-K280 VanDerWaalsContact NH1-C 3.28Å; R233-K280 PolarHBondContact NH1-O 3.1Å; R233-K280 PolarHBondContact NH2-O 3.16Å; R233-V281 HydrophobicContact CB-CG2 4.22Å
234	R	98.4	Very high	98.3	Very high	22 Å²	22	46.1 Å²	46.1	8%	0.083	24%	0.244	C	C	.	.	H	α-helix	trans	-64.3	-46.3	172.2	-65.1	-173.6	178.2	-133.1	-4.7	112.1	C214 N215 G216 E230 F231 Y232 K236 G237 A238 D282 G285	C214-R234 HydrophobicContact CB-CB 4.3Å; C214-R234 PolarHBondContact O-NH1 3.11Å; N215-R234 PolarHBondContact O-NH1 2.92Å; G216-R234 VanDerWaalsContact O-CD 3.26Å; G216-R234 WeakPolarHBondContact O-CD 3.3Å; G216-R234 PolarHBondContact O-NH1 3.02Å; E230-R234 VanDerWaalsContact CD-NE 3.32Å; E230-R234 PolarHBondContact O-N 2.99Å; E230-R234 VanDerWaalsContact O-N 3.07Å; E230-R234 IonicContact OE1-CZ 3.32Å; E230-R234 IonicContact OE1-NE 3.29Å; E230-R234 PolarHBondContact OE1-NE 3.12Å; E230-R234 IonicContact OE1-NH2 2.86Å; E230-R234 PolarHBondContact OE1-NH2 3.01Å; E230-R234 WeakPolarHBondContact OE2-CD 3.3Å; E230-R234 IonicContact OE2-CZ 3.85Å; E230-R234 IonicContact OE2-NE 3.46Å; E230-R234 PolarHBondContact OE2-NE 3.41Å; E230-R234 IonicContact OE2-NH2 3.68Å; F231-R234 HydrophobicContact CD2-CB 4.25Å; F231-R234 WeakPolarHBondContact O-CB 3.37Å; F231-R234 PolarHBondContact O-N 2.88Å; F231-R234 VanDerWaalsContact O-N 3.09Å; Y232-R234 VanDerWaalsContact C-N 3.34Å; R234-K236 VanDerWaalsContact C-N 3.3Å; R234-K236 PolarHBondContact O-N 2.75Å; R234-G237 PolarHBondContact O-N 3.33Å; R234-G237 VanDerWaalsContact O-N 3.14Å; R234-A238 WeakPolarHBondContact O-CB 3.27Å; R234-A238 PolarHBondContact O-N 2.8Å; R234-D282 PolarHBondContact NH2-O 2.91Å; R234-D282 IonicContact NH2-OD2 3.81Å; R234-G285 PolarHBondContact NH1-O 3.34Å; R234-G285 PolarHBondContact NH2-O 2.76Å
235	I	98.6	Very high	98.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-54.4	-48.7	174.9	-68.7	169.4	0	0	0	110.2	P182 L204 F231 Y232 A238 L240 L242	P182-I235 HydrophobicContact CB-CD1 4.11Å; P182-I235 HydrophobicContact CG-CD1 4.24Å; P182-I235 HydrophobicContact CG-CG1 4.24Å; P182-I235 HydrophobicContact CG-CG2 4.07Å; L204-I235 HydrophobicContact CD2-CD1 4.1Å; F231-I235 HydrophobicContact CD1-CD1 3.86Å; F231-I235 HydrophobicContact CD1-CG1 4.31Å; F231-I235 HydrophobicContact CE1-CD1 3.78Å; F231-I235 HydrophobicContact CE1-CG1 4.09Å; F231-I235 HydrophobicContact CZ-CG1 4.37Å; F231-I235 WeakPolarHBondContact O-CG1 3.31Å; F231-I235 PolarHBondContact O-N 3.38Å; Y232-I235 PolarHBondContact O-N 3.1Å; I235-A238 PolarHBondContact O-N 3.3Å; I235-L240 HydrophobicContact CG2-CB 3.89Å; I235-L240 WeakPolarHBondContact O-CB 3.2Å; I235-L240 PolarHBondContact O-N 2.91Å; I235-L240 VanDerWaalsContact O-N 3.07Å; I235-L242 HydrophobicContact CD1-CD1 4.41Å
236	K	98.3	Very high	98.4	Very high	95 Å²	95	47 Å²	47	41%	0.413	26%	0.263	S	S	.	.	H	α-helix	trans	-66.5	-40.4	177.2	-67.2	-55.8	-175.1	-173.5	0	113.2	Y232 R233 R234 A238 G239	Y232-K236 HydrophobicContact CD1-CG 4.44Å; Y232-K236 HydrophobicContact CE1-CG 3.94Å; Y232-K236 HydrophobicContact CE2-CG 4.32Å; Y232-K236 WeakPolarHBondContact O-CG 3.44Å; Y232-K236 PolarHBondContact O-N 3.4Å; Y232-K236 VanDerWaalsContact OH-CE 3.29Å; Y232-K236 WeakPolarHBondContact OH-CE 3.48Å; R233-K236 PolarHBondContact O-N 3.4Å; R234-K236 VanDerWaalsContact C-N 3.3Å; R234-K236 PolarHBondContact O-N 2.75Å; K236-A238 VanDerWaalsContact C-N 3.26Å; K236-A238 PolarHBondContact O-N 2.78Å; K236-G239 PolarHBondContact O-N 2.9Å; K236-G239 VanDerWaalsContact O-N 3.08Å
237	G	97.7	Very high	98.4	Very high	70 Å²	70	46.1 Å²	46.1	72%	0.722	28%	0.281	S	S	*	.	H	α-helix	trans	-64.4	-29.8	177	0	0	0	0	0	113.4	R233 R234 G239	R233-G237 PolarHBondContact O-N 3.09Å; R234-G237 PolarHBondContact O-N 3.33Å; R234-G237 VanDerWaalsContact O-N 3.14Å; G237-G239 PolarHBondContact O-N 3.02Å
238	A	98	Very high	98.4	Very high	31 Å²	31	46.5 Å²	46.5	26%	0.256	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	0.9	173.9	0	0	0	0	0	113.7	L213 R234 I235 K236 L240	L213-A238 HydrophobicContact CD2-CB 4.21Å; L213-A238 HydrophobicContact CG-CB 4.08Å; R234-A238 WeakPolarHBondContact O-CB 3.27Å; R234-A238 PolarHBondContact O-N 2.8Å; I235-A238 PolarHBondContact O-N 3.3Å; K236-A238 VanDerWaalsContact C-N 3.26Å; K236-A238 PolarHBondContact O-N 2.78Å; A238-L240 HydrophobicContact CB-CD1 4.22Å; A238-L240 HydrophobicContact CB-CG 4.13Å; A238-L240 PolarHBondContact O-N 3.22Å
239	G	98.4	Very high	98.4	Very high	69 Å²	69	51.8 Å²	51.8	71%	0.711	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	13.2	-177.5	0	0	0	0	0	114.2	K236 G237	K236-G239 PolarHBondContact O-N 2.9Å; K236-G239 VanDerWaalsContact O-N 3.08Å; G237-G239 PolarHBondContact O-N 3.02Å
240	L	98.6	Very high	98.4	Very high	21 Å²	21	53.4 Å²	53.4	11%	0.11	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-82.7	139.6	-178.2	-64.3	174.3	0	0	0	111.8	P182 H210 L213 I235 A238	P182-L240 HydrophobicContact CG-CB 4.41Å; P182-L240 HydrophobicContact CG-CD1 4.08Å; H210-L240 HydrophobicContact CB-CD1 3.92Å; L213-L240 HydrophobicContact CD2-CD1 4.34Å; L213-L240 HydrophobicContact CD2-CD2 4.08Å; L213-L240 HydrophobicContact CD2-CG 4.23Å; I235-L240 HydrophobicContact CG2-CB 3.89Å; I235-L240 WeakPolarHBondContact O-CB 3.2Å; I235-L240 PolarHBondContact O-N 2.91Å; I235-L240 VanDerWaalsContact O-N 3.07Å; A238-L240 HydrophobicContact CB-CD1 4.22Å; A238-L240 HydrophobicContact CB-CG 4.13Å; A238-L240 PolarHBondContact O-N 3.22Å
241	Q	98.5	Very high	98.3	Very high	120 Å²	120	54.8 Å²	54.8	56%	0.561	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-84.5	134.5	171.2	-175.7	168.6	-12.4	0	0	110.2	P182 F243	P182-Q241 WeakPolarHBondContact CD-O 3.42Å; Q241-F243 HydrophobicContact CB-CE2 3.8Å; Q241-F243 HydrophobicContact CB-CZ 4.02Å; Q241-F243 HydrophobicContact CG-CD2 4.41Å; Q241-F243 HydrophobicContact CG-CE1 4.25Å; Q241-F243 HydrophobicContact CG-CE2 3.8Å; Q241-F243 HydrophobicContact CG-CZ 3.71Å; Q241-F243 WeakPolarHBondContact O-CD2 3.41Å
242	L	98.7	Very high	98.3	Very high	27 Å²	27	61.3 Å²	61.3	14%	0.141	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-93.3	128.5	175.2	-176.6	75.3	0	0	0	108.6	P182 H184 V200 L204 Y232 I235	P182-L242 HydrophobicContact CB-CD1 4.06Å; H184-L242 HydrophobicContact CB-CD1 4.05Å; H184-L242 HydrophobicContact CB-CG 4.45Å; V200-L242 HydrophobicContact CG1-CD1 4.2Å; V200-L242 HydrophobicContact CG1-CD2 3.62Å; L204-L242 HydrophobicContact CD1-CD1 4.09Å; Y232-L242 HydrophobicContact CD2-CD2 4.2Å; Y232-L242 HydrophobicContact CE2-CD2 4.04Å; I235-L242 HydrophobicContact CD1-CD1 4.41Å
243	F	98.8	Very high	98.3	Very high	62 Å²	62	67.2 Å²	67.2	27%	0.272	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-108.9	156.9	176.3	-62.9	-90.5	0	0	0	110.7	A180 P182 F183 H184 Q241	A180-F243 HydrophobicContact CB-CD2 4.43Å; A180-F243 HydrophobicContact CB-CE1 4.5Å; A180-F243 HydrophobicContact CB-CE2 3.72Å; A180-F243 HydrophobicContact CB-CZ 3.75Å; A180-F243 WeakPolarHBondContact O-CE2 3.27Å; P182-F243 PolarHBondContact O-N 3.09Å; F183-F243 HydrophobicContact CD2-CB 3.6Å; F183-F243 HydrophobicContact CE2-CB 4.15Å; H184-F243 PolarHBondContact N-O 2.99Å; Q241-F243 HydrophobicContact CB-CE2 3.8Å; Q241-F243 HydrophobicContact CB-CZ 4.02Å; Q241-F243 HydrophobicContact CG-CD2 4.41Å; Q241-F243 HydrophobicContact CG-CE1 4.25Å; Q241-F243 HydrophobicContact CG-CE2 3.8Å; Q241-F243 HydrophobicContact CG-CZ 3.71Å; Q241-F243 WeakPolarHBondContact O-CD2 3.41Å
244	R	98.8	Very high	98.3	Very high	75 Å²	75	63.8 Å²	63.8	28%	0.283	38%	0.38	S	S	.	.			trans	-144.1	157.4	179.7	-75.7	176.4	179.1	154	-3.2	109.4	H184 P188 K197 Y199	H184-R244 HydrophobicContact CB-CG 3.96Å; H184-R244 PolarHBondContact ND1-NE 3.01Å; P188-R244 VanDerWaalsContact CD-CZ 3.45Å; K197-R244 PolarHBondContact O-NH1 3.32Å; K197-R244 PolarHBondContact O-NH2 2.83Å; Y199-R244 PolarHBondContact O-NH2 3.38Å
245	P	98.5	Very high	98.3	Very high	15 Å²	15	63.1 Å²	63.1	10%	0.097	38%	0.378	C	S	.	.			trans	-55.8	139.2	172.5	-23.5	31.9	0	0	0	111.9	L173 F183 H184 L190 I248	L173-P245 HydrophobicContact CD2-CB 4.21Å; L173-P245 HydrophobicContact CD2-CG 3.8Å; F183-P245 HydrophobicContact CE1-CG 3.92Å; F183-P245 HydrophobicContact CZ-CB 4.44Å; F183-P245 HydrophobicContact CZ-CG 3.89Å; H184-P245 VanDerWaalsContact O-CD 3.23Å; H184-P245 WeakPolarHBondContact O-CD 3.3Å; L190-P245 HydrophobicContact CD1-CB 4.03Å; L190-P245 HydrophobicContact CD1-CG 4.11Å; P245-I248 HydrophobicContact CB-CD1 4.39Å; P245-I248 HydrophobicContact CB-CG1 3.58Å
246	S	97.8	Very high	98.3	Very high	110 Å²	110	67.6 Å²	67.6	77%	0.769	40%	0.399	S	S	*	.			trans	-120.4	146.7	173.5	58.3	0	0	0	0	109.8	I248	S246-I248 VanDerWaalsContact C-N 3.26Å; S246-I248 PolarHBondContact O-N 3.03Å
247	G	97.6	Very high	98.3	Very high	69 Å²	69	65 Å²	65	71%	0.711	39%	0.388	S	S	*	.	S	Bend	trans	78.3	3.5	176.5	0	0	0	0	0	115.3	T249	G247-T249 PolarHBondContact O-N 3.35Å
248	I	98.3	Very high	98.3	Very high	26 Å²	26	64 Å²	64	13%	0.133	37%	0.366	C	S	.	.			trans	-71	121.9	176.7	-57.8	-59.6	0	0	0	110.2	E172 L173 L190 P245 S246 T250 T254	E172-I248 HydrophobicContact CB-CD1 3.58Å; L173-I248 HydrophobicContact CD2-CD1 4.42Å; L173-I248 HydrophobicContact CD2-CG1 4.38Å; L190-I248 HydrophobicContact CD1-CB 4.09Å; L190-I248 HydrophobicContact CD1-CG1 4.12Å; L190-I248 HydrophobicContact CD1-CG2 4.04Å; L190-I248 HydrophobicContact CD2-CB 3.95Å; L190-I248 HydrophobicContact CD2-CG2 3.65Å; P245-I248 HydrophobicContact CB-CD1 4.39Å; P245-I248 HydrophobicContact CB-CG1 3.58Å; S246-I248 VanDerWaalsContact C-N 3.26Å; S246-I248 PolarHBondContact O-N 3.03Å; I248-T250 VanDerWaalsContact CG2-OG1 3.24Å; I248-T250 WeakPolarHBondContact CG2-OG1 3.35Å; I248-T254 HydrophobicContact CG2-CG2 4.16Å
249	T	98.3	Very high	98.1	Very high	128 Å²	128	64 Å²	64	79%	0.785	36%	0.361	S	S	*	.			trans	-100.8	-7.3	-174.7	57.6	0	0	0	0	114.2	G247 G251	G247-T249 PolarHBondContact O-N 3.35Å; T249-G251 PolarHBondContact O-N 3.03Å
250	T	98.3	Very high	98	Very high	55 Å²	55	65.1 Å²	65.1	34%	0.337	35%	0.351	S	S	.	.			trans	-73.9	-8.7	-176.4	40.6	0	0	0	0	114.5	N170 I248 K253 T254	N170-T250 HydrophobicContact CB-CG2 4.32Å; N170-T250 WeakPolarHBondContact ND2-CG2 3.37Å; N170-T250 PolarHBondContact ND2-OG1 3.2Å; N170-T250 VanDerWaalsContact ND2-OG1 3.12Å; I248-T250 VanDerWaalsContact CG2-OG1 3.24Å; I248-T250 WeakPolarHBondContact CG2-OG1 3.35Å; T250-K253 PolarHBondContact O-N 2.98Å; T250-K253 VanDerWaalsContact O-N 3.09Å; T250-T254 WeakPolarHBondContact CB-OG1 3.47Å; T250-T254 PolarHBondContact OG1-OG1 2.02Å
251	G	97.8	Very high	97.8	Very high	28 Å²	28	68.2 Å²	68.2	29%	0.289	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	54.2	-136.5	176.5	0	0	0	0	0	112.7	T249 K253 T254	T249-G251 PolarHBondContact O-N 3.03Å; G251-K253 PolarHBondContact O-N 3.41Å; G251-K253 VanDerWaalsContact O-N 3.14Å; G251-T254 VanDerWaalsContact O-CB 3.26Å; G251-T254 WeakPolarHBondContact O-CB 3.3Å; G251-T254 PolarHBondContact O-N 2.81Å; G251-T254 VanDerWaalsContact O-N 3.1Å; G251-T254 PolarHBondContact O-OG1 3.04Å
252	Y	98.1	Very high	97.6	Very high	139 Å²	139	65.9 Å²	65.9	55%	0.545	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-72.1	-2.5	179	-54.2	-35.4	0	0	0	114.9	H195 T254	H195-Y252 AromaticContact CE1-CD1 3.97Å; H195-Y252 AromaticContact CE1-CE1 3.35Å; H195-Y252 WeakPolarHBondContact CE1-CE1 3.33Å; H195-Y252 AromaticContact CE1-CZ 3.54Å; H195-Y252 AromaticContact ND1-CE1 3.75Å; Y252-T254 VanDerWaalsContact C-N 3.34Å
253	K	98.3	Very high	97.4	Very high	177 Å²	177	73 Å²	73	77%	0.77	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-94.8	8.1	171.1	-60.7	-176.8	-179.1	179.9	0	112.4	T250 G251 F255	T250-K253 PolarHBondContact O-N 2.98Å; T250-K253 VanDerWaalsContact O-N 3.09Å; G251-K253 PolarHBondContact O-N 3.41Å; G251-K253 VanDerWaalsContact O-N 3.14Å; K253-F255 PolarHBondContact O-N 3.36Å
254	T	98.8	Very high	97.3	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	39%	0.39	C	S	.	.	S	Bend	trans	-63.2	-30.8	175.2	-59.2	0	0	0	0	112	L169 N170 L173 L190 I248 T250 G251 Y252	L169-T254 WeakPolarHBondContact CB-O 3.37Å; L169-T254 PolarHBondContact N-O 3.11Å; N170-T254 HydrophobicContact CB-CG2 4.27Å; L173-T254 HydrophobicContact CD1-CG2 3.85Å; L173-T254 HydrophobicContact CD2-CG2 3.94Å; L173-T254 HydrophobicContact CG-CG2 4.18Å; L190-T254 HydrophobicContact CB-CG2 4.29Å; L190-T254 HydrophobicContact CD1-CG2 4.24Å; I248-T254 HydrophobicContact CG2-CG2 4.16Å; T250-T254 WeakPolarHBondContact CB-OG1 3.47Å; T250-T254 PolarHBondContact OG1-OG1 2.02Å; G251-T254 VanDerWaalsContact O-CB 3.26Å; G251-T254 WeakPolarHBondContact O-CB 3.3Å; G251-T254 PolarHBondContact O-N 2.81Å; G251-T254 VanDerWaalsContact O-N 3.1Å; G251-T254 PolarHBondContact O-OG1 3.04Å; Y252-T254 VanDerWaalsContact C-N 3.34Å
255	F	98.8	Very high	97.2	Very high	8 Å²	8	75.6 Å²	75.6	4%	0.035	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	146.3	178	-56.8	-81.1	0	0	0	111.2	L166 L167 P168 L173 V185 A186 L190 I203 K253	L166-F255 HydrophobicContact CD1-CB 3.65Å; L166-F255 HydrophobicContact CD1-CG 4.13Å; L166-F255 HydrophobicContact CG-CB 4.12Å; L166-F255 HydrophobicContact CG-CD1 4.16Å; L166-F255 HydrophobicContact CG-CG 4.18Å; L167-F255 CarbonylContact O-C 3.52Å; L167-F255 WeakPolarHBondContact O-CA 3.08Å; P168-F255 HydrophobicContact CB-CD1 4.34Å; P168-F255 HydrophobicContact CB-CE1 4.22Å; L173-F255 HydrophobicContact CD1-CD1 4.47Å; L173-F255 HydrophobicContact CD1-CE1 3.58Å; L173-F255 HydrophobicContact CD1-CZ 3.73Å; L173-F255 HydrophobicContact CD2-CZ 4.25Å; V185-F255 HydrophobicContact CG1-CE1 4.05Å; V185-F255 HydrophobicContact CG1-CZ 3.93Å; V185-F255 WeakPolarHBondContact O-CZ 3.43Å; A186-F255 HydrophobicContact CB-CZ 4.41Å; L190-F255 HydrophobicContact CB-CD2 4.42Å; L190-F255 HydrophobicContact CB-CE2 3.81Å; I203-F255 HydrophobicContact CD1-CD1 4.07Å; I203-F255 HydrophobicContact CD1-CE1 3.7Å; K253-F255 PolarHBondContact O-N 3.36Å
256	H	98.6	Very high	97.1	Very high	94 Å²	94	77.9 Å²	77.9	44%	0.435	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	114	161.3	-168.7	42.1	0	0	0	109.1	L167 L169 L258	L167-H256 HydrophobicContact CB-CB 4.26Å; L167-H256 PolarHBondContact N-O 3.1Å; L167-H256 PolarHBondContact O-N 3.4Å; L169-H256 HydrophobicContact CD1-CB 4.07Å; L169-H256 HydrophobicContact CD2-CB 4.17Å; L169-H256 HydrophobicContact CG-CB 4.26Å; H256-L258 VanDerWaalsContact CD2-CD2 3.42Å; H256-L258 WeakPolarHBondContact CD2-CD2 3.37Å; H256-L258 WeakPolarHBondContact NE2-CD2 3.48Å
257	H	98.4	Very high	97.1	Very high	42 Å²	42	74.7 Å²	74.7	19%	0.194	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	98.3	179	-174.9	-148.3	0	0	0	110.1	D165 L166 P192 L193 H259	D165-H257 CarbonylContact O-C 3.59Å; D165-H257 VanDerWaalsContact O-CA 3.3Å; D165-H257 WeakPolarHBondContact O-CA 3.45Å; D165-H257 IonicContact OD1-CD2 3.62Å; D165-H257 IonicContact OD1-NE2 3.53Å; D165-H257 IonicContact OD2-NE2 2.68Å; L166-H257 HydrophobicContact CD1-CB 3.84Å; P192-H257 HydrophobicContact CG-CB 3.72Å; L193-H257 WeakPolarHBondContact CD1-CE1 3.33Å; H257-H259 AromaticContact CE1-CG 3.97Å; H257-H259 VanDerWaalsContact NE2-CB 3.33Å; H257-H259 WeakPolarHBondContact NE2-CB 3.21Å; H257-H259 AromaticContact NE2-CG 3.77Å; H257-H259 AromaticContact NE2-ND1 3.99Å; H257-H259 PolarHBondContact O-N 3.48Å
258	L	96.6	Very high	97	Very high	49 Å²	49	76.6 Å²	76.6	26%	0.257	38%	0.382	S	S	.	.			trans	-77.8	62.5	-178.1	-71.2	175.3	0	0	0	111.5	E107 V110 D165 L167 H256	E107-L258 HydrophobicContact CG-CB 4.3Å; V110-L258 HydrophobicContact CB-CD1 4.11Å; V110-L258 HydrophobicContact CG1-CD1 4.02Å; V110-L258 HydrophobicContact CG2-CD1 4.41Å; D165-L258 HydrophobicContact CB-CB 4.27Å; D165-L258 WeakPolarHBondContact CB-O 3.42Å; D165-L258 PolarHBondContact O-N 3.28Å; L167-L258 HydrophobicContact CD1-CD1 3.67Å; L167-L258 HydrophobicContact CD1-CG 4.41Å; L167-L258 HydrophobicContact CG-CD1 4.3Å; H256-L258 VanDerWaalsContact CD2-CD2 3.42Å; H256-L258 WeakPolarHBondContact CD2-CD2 3.37Å; H256-L258 WeakPolarHBondContact NE2-CD2 3.48Å
259	H	94.9	Very high	96.9	Very high	29 Å²	29	81.2 Å²	81.2	13%	0.134	40%	0.401	C	S	.	.			trans	-136.8	93.5	-172.1	-167.5	107.2	0	0	0	111.4	D165 H257 P261 R264 R266	D165-H259 IonicContact OD2-CE1 3.09Å; D165-H259 IonicContact OD2-CG 3.3Å; D165-H259 IonicContact OD2-ND1 2.62Å; D165-H259 PolarHBondContact OD2-ND1 3.26Å; H257-H259 AromaticContact CE1-CG 3.97Å; H257-H259 VanDerWaalsContact NE2-CB 3.33Å; H257-H259 WeakPolarHBondContact NE2-CB 3.21Å; H257-H259 AromaticContact NE2-CG 3.77Å; H257-H259 AromaticContact NE2-ND1 3.99Å; H257-H259 PolarHBondContact O-N 3.48Å; H259-P261 VanDerWaalsContact O-CD 3.29Å; H259-P261 WeakPolarHBondContact O-CD 3.36Å; H259-R264 PolarHBondContact NE2-O 2.83Å; H259-R264 VanDerWaalsContact NE2-O 3.14Å; H259-R266 PolarHBondContact CD2-NH2 3.25Å; H259-R266 VanDerWaalsContact NE2-CZ 3.27Å; H259-R266 PolarHBondContact NE2-NH1 2.91Å; H259-R266 PolarHBondContact NE2-NH2 3.27Å
260	D	95.3	Very high	96.8	Very high	94 Å²	94	78.2 Å²	78.2	50%	0.503	38%	0.376	S	S	.	.			trans	-75.2	113	167.2	-175.1	-30	0	0	0	109	A262 W263 R264	D260-A262 PolarHBondContact O-N 3.38Å; D260-A262 WeakPolarHBondContact OD1-CA 3.46Å; D260-A262 VanDerWaalsContact OD1-CB 3.29Å; D260-A262 WeakPolarHBondContact OD1-CB 3.08Å; D260-A262 PolarHBondContact OD1-N 2.85Å; D260-W263 HydrophobicContact CB-CB 4.14Å; D260-W263 PolarHBondContact O-N 3.21Å; D260-R264 WeakPolarHBondContact O-CB 3.46Å; D260-R264 PolarHBondContact O-N 3.48Å
261	P	94.3	Very high	96.5	Very high	86 Å²	86	76.8 Å²	76.8	56%	0.558	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-18.7	-177	29.4	-35.8	0	0	0	113.9	H259	H259-P261 VanDerWaalsContact O-CD 3.29Å; H259-P261 WeakPolarHBondContact O-CD 3.36Å
262	A	94.6	Very high	96.2	Very high	71 Å²	71	79.9 Å²	79.9	59%	0.587	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-38.8	175.4	0	0	0	0	0	111.5	D260 K265	D260-A262 PolarHBondContact O-N 3.38Å; D260-A262 WeakPolarHBondContact OD1-CA 3.46Å; D260-A262 VanDerWaalsContact OD1-CB 3.29Å; D260-A262 WeakPolarHBondContact OD1-CB 3.08Å; D260-A262 PolarHBondContact OD1-N 2.85Å; A262-K265 WeakPolarHBondContact O-CE 2.93Å
263	W	94.9	Very high	96	Very high	175 Å²	175	75 Å²	75	66%	0.663	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-48	179.1	-172.1	-119.7	0	0	0	112.4	D260 K265	D260-W263 HydrophobicContact CB-CB 4.14Å; D260-W263 PolarHBondContact O-N 3.21Å; W263-K265 PolarHBondContact O-N 3.4Å
264	R	95.9	Very high	95.8	Very high	28 Å²	28	67.1 Å²	67.1	11%	0.106	34%	0.343	C	S	.	.	S	Bend	trans	-97.3	67	-179.4	-57.8	-49.1	-164.8	-164.7	-5	110.8	E103 E106 E107 H259 D260 R266	E103-R264 PolarHBondContact O-NH1 3.4Å; E106-R264 IonicContact OE2-CZ 3.63Å; E106-R264 IonicContact OE2-NH2 3.44Å; E106-R264 PolarHBondContact OE2-NH2 2.77Å; E107-R264 IonicContact OE1-CZ 3.86Å; E107-R264 IonicContact OE1-NE 3.19Å; E107-R264 PolarHBondContact OE1-NE 2.79Å; E107-R264 IonicContact OE1-NH2 3.91Å; E107-R264 PolarHBondContact OE1-NH2 3.17Å; E107-R264 IonicContact OE2-CZ 3.64Å; E107-R264 IonicContact OE2-NE 3.89Å; E107-R264 IonicContact OE2-NH2 3.8Å; E107-R264 PolarHBondContact OE2-NH2 3.41Å; H259-R264 PolarHBondContact NE2-O 2.83Å; H259-R264 VanDerWaalsContact NE2-O 3.14Å; D260-R264 WeakPolarHBondContact O-CB 3.46Å; D260-R264 PolarHBondContact O-N 3.48Å; R264-R266 PolarHBondContact O-N 2.65Å
265	K	96.9	Very high	95.5	Very high	165 Å²	165	73.9 Å²	73.9	72%	0.717	37%	0.372	S	S	*	.			trans	-60.1	126.8	-179.9	-65.8	-177.6	-177.1	175.2	0	111.1	A262 W263	A262-K265 WeakPolarHBondContact O-CE 2.93Å; W263-K265 PolarHBondContact O-N 3.4Å
266	R	97.1	Very high	95.2	Very high	63 Å²	63	80 Å²	80	24%	0.238	40%	0.401	C	S	.	.			trans	-72.6	131.2	172	-67.8	178.4	179.7	77	8.8	109.6	Y194 W224 H259 R264 Q268	Y194-R266 PolarHBondContact OH-NE 3.18Å; W224-R266 HydrophobicContact CB-CB 4.25Å; W224-R266 HydrophobicContact CD2-CB 4.4Å; W224-R266 HydrophobicContact CG-CB 3.97Å; W224-R266 HydrophobicContact CG-CG 4.2Å; H259-R266 PolarHBondContact CD2-NH2 3.25Å; H259-R266 VanDerWaalsContact NE2-CZ 3.27Å; H259-R266 PolarHBondContact NE2-NH1 2.91Å; H259-R266 PolarHBondContact NE2-NH2 3.27Å; R264-R266 PolarHBondContact O-N 2.65Å; R266-Q268 VanDerWaalsContact C-N 3.31Å; R266-Q268 HydrophobicContact CB-CG 3.68Å; R266-Q268 PolarHBondContact O-N 2.83Å
267	D	97.3	Very high	94.9	Very high	42 Å²	42	78 Å²	78	23%	0.225	39%	0.392	C	S	.	.			trans	-78.1	79.7	174	177.8	13.9	0	0	0	111.2	R138 W224	R138-D267 IonicContact CZ-OD1 3.23Å; R138-D267 IonicContact CZ-OD2 2.73Å; R138-D267 VanDerWaalsContact CZ-OD2 3.3Å; R138-D267 IonicContact NE-OD1 2.78Å; R138-D267 IonicContact NE-OD2 3.38Å; R138-D267 PolarHBondContact NE-OD2 2.83Å; R138-D267 PolarHBondContact NH2-O 3.11Å; R138-D267 IonicContact NH2-OD1 2.7Å; R138-D267 PolarHBondContact NH2-OD1 3.48Å; R138-D267 IonicContact NH2-OD2 3.66Å; R138-D267 PolarHBondContact NH2-OD2 2.79Å; R138-D267 VanDerWaalsContact NH2-OD2 3.09Å; W224-D267 WeakPolarHBondContact CB-O 3.32Å; W224-D267 PolarHBondContact N-O 3.2Å
268	Q	96.1	Very high	94.6	Very high	109 Å²	109	76.9 Å²	76.9	51%	0.509	39%	0.387	S	S	.	.			trans	-92	-1.5	-174.5	-58.1	-175.3	-50.7	0	0	113.7	W224 R266 R270	W224-Q268 HydrophobicContact CB-CG 4.41Å; W224-Q268 HydrophobicContact CD2-CG 4.21Å; W224-Q268 HydrophobicContact CE3-CG 3.7Å; W224-Q268 HydrophobicContact CZ3-CG 4.42Å; R266-Q268 VanDerWaalsContact C-N 3.31Å; R266-Q268 HydrophobicContact CB-CG 3.68Å; R266-Q268 PolarHBondContact O-N 2.83Å; Q268-R270 PolarHBondContact O-N 2.95Å; Q268-R270 PolarHBondContact O-NH1 3.31Å; Q268-R270 VanDerWaalsContact O-NH1 3.17Å
269	K	95.9	Very high	94.4	Very high	123 Å²	123	79.9 Å²	79.9	54%	0.535	40%	0.398	S	S	.	.			trans	-57.8	133	-177.7	-172.1	179.2	178	-172	0	109.6	R138 I271 Q274	R138-K269 PolarHBondContact NH1-O 3.38Å; R138-K269 PolarHBondContact NH2-O 2.82Å; K269-I271 HydrophobicContact CD-CG1 4.37Å; K269-I271 HydrophobicContact CG-CG1 4.28Å; K269-Q274 PolarHBondContact O-OE1 3.46Å
270	R	95.6	Very high	94.2	Very high	66 Å²	66	83.8 Å²	83.8	25%	0.249	42%	0.415	C	S	.	.			trans	-106.5	121.6	173.7	-62.1	-58.6	-174.8	-112.9	11	109.1	W224 Q268 K275	W224-R270 VanDerWaalsContact O-CZ 3.26Å; W224-R270 PolarHBondContact O-NH1 2.92Å; W224-R270 PolarHBondContact O-NH2 3.39Å; Q268-R270 PolarHBondContact O-N 2.95Å; Q268-R270 PolarHBondContact O-NH1 3.31Å; Q268-R270 VanDerWaalsContact O-NH1 3.17Å; R270-K275 HydrophobicContact CB-CB 4.28Å
271	I	92.7	Very high	93.9	Very high	24 Å²	24	82.3 Å²	82.3	12%	0.123	41%	0.408	C	S	.	.			trans	-105.3	116.1	-172.9	-55.2	175.5	0	0	0	109.4	K269 A273 Q274 W323 T325	K269-I271 HydrophobicContact CD-CG1 4.37Å; K269-I271 HydrophobicContact CG-CG1 4.28Å; I271-A273 PolarHBondContact O-N 3.45Å; I271-Q274 WeakPolarHBondContact O-CB 3.22Å; I271-Q274 PolarHBondContact O-N 2.87Å; I271-W323 HydrophobicContact CB-CB 4.03Å; I271-T325 VanDerWaalsContact CD1-O 3.26Å; I271-T325 WeakPolarHBondContact CD1-O 3.49Å
272	A	91.9	Very high	93.9	Very high	93 Å²	93	79 Å²	79	77%	0.769	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.8	-119.9	176.1	0	0	0	0	0	113.4	Q274 K275	A272-Q274 PolarHBondContact O-N 3.48Å; A272-Q274 VanDerWaalsContact O-N 3.16Å; A272-K275 PolarHBondContact O-N 2.9Å
273	A	92.9	Very high	93.7	Very high	38 Å²	38	86.5 Å²	86.5	31%	0.314	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.6	-178.1	0	0	0	0	0	113.9	I271 K275 Q276 E277 W323	I271-A273 PolarHBondContact O-N 3.45Å; A273-K275 PolarHBondContact O-N 3.32Å; A273-Q276 PolarHBondContact O-N 3.18Å; A273-E277 HydrophobicContact CB-CG 4.34Å; A273-E277 WeakPolarHBondContact O-CG 3.49Å; A273-E277 PolarHBondContact O-N 3.38Å; A273-W323 HydrophobicContact CB-CZ3 4.41Å
274	Q	94.9	Very high	93.5	Very high	11 Å²	11	86.2 Å²	86.2	5%	0.051	41%	0.406	C	S	.	.	H	α-helix	trans	-52.3	-35.3	178.7	-170.3	-177.3	27.3	0	0	112.4	W222 K269 I271 A272 Q276 E277 Q278 W323	W222-Q274 PolarHBondContact O-NE2 2.98Å; K269-Q274 PolarHBondContact O-OE1 3.46Å; I271-Q274 WeakPolarHBondContact O-CB 3.22Å; I271-Q274 PolarHBondContact O-N 2.87Å; A272-Q274 PolarHBondContact O-N 3.48Å; A272-Q274 VanDerWaalsContact O-N 3.16Å; Q274-Q276 PolarHBondContact O-N 2.87Å; Q274-E277 PolarHBondContact O-N 2.74Å; Q274-Q278 WeakPolarHBondContact O-CB 3.38Å; Q274-Q278 WeakPolarHBondContact O-CG 3.49Å; Q274-Q278 PolarHBondContact O-N 3.26Å; Q274-Q278 VanDerWaalsContact O-N 3.11Å; Q274-W323 HydrophobicContact CB-CB 3.83Å; Q274-W323 HydrophobicContact CB-CD2 3.78Å; Q274-W323 HydrophobicContact CB-CE3 4.03Å; Q274-W323 HydrophobicContact CB-CG 3.68Å; Q274-W323 HydrophobicContact CG-CB 4.06Å; Q274-W323 HydrophobicContact CG-CD2 3.96Å; Q274-W323 HydrophobicContact CG-CG 3.63Å; Q274-W323 VanDerWaalsContact NE2-CD1 3.31Å
275	K	92.7	Very high	93.3	Very high	142 Å²	142	85.5 Å²	85.5	62%	0.617	41%	0.406	S	S	*	.	H	α-helix	trans	-60.5	-32.3	179.9	-171.6	176.2	179.5	-178.6	0	112.3	R270 A272 A273 Q278 F279	R270-K275 HydrophobicContact CB-CB 4.28Å; A272-K275 PolarHBondContact O-N 2.9Å; A273-K275 PolarHBondContact O-N 3.32Å; K275-Q278 PolarHBondContact O-NE2 3.31Å; K275-F279 WeakPolarHBondContact O-CD2 3.4Å; K275-F279 VanDerWaalsContact O-CE2 3.25Å; K275-F279 WeakPolarHBondContact O-CE2 3.43Å
276	Q	92.4	Very high	93.4	Very high	136 Å²	136	77.6 Å²	77.6	64%	0.636	37%	0.372	S	S	*	.	H	α-helix	trans	-91.8	-44.3	-180	-65.2	161.3	-17.7	0	0	110.8	A273 Q274 Q278 F279	A273-Q276 PolarHBondContact O-N 3.18Å; Q274-Q276 PolarHBondContact O-N 2.87Å; Q276-Q278 VanDerWaalsContact C-N 3.29Å; Q276-Q278 PolarHBondContact O-N 2.73Å; Q276-F279 PolarHBondContact O-N 3.23Å
277	E	92.6	Very high	93.5	Very high	51 Å²	51	75.4 Å²	75.4	24%	0.238	37%	0.365	C	S	.	.	H	α-helix	trans	-62.7	-32.7	-176.9	-64.5	-55.3	131.3	0	0	113	A273 Q274 F279 K280 W323	A273-E277 HydrophobicContact CB-CG 4.34Å; A273-E277 WeakPolarHBondContact O-CG 3.49Å; A273-E277 PolarHBondContact O-N 3.38Å; Q274-E277 PolarHBondContact O-N 2.74Å; E277-F279 PolarHBondContact O-N 2.78Å; E277-K280 VanDerWaalsContact CD-NZ 3.28Å; E277-K280 PolarHBondContact O-N 2.7Å; E277-K280 IonicContact OE1-NZ 3.86Å; E277-K280 PolarHBondContact OE1-NZ 2.68Å; E277-K280 WeakPolarHBondContact OE2-CD 3.38Å; E277-K280 IonicContact OE2-NZ 3.93Å; E277-K280 PolarHBondContact OE2-NZ 3.09Å; E277-W323 HydrophobicContact CB-CH2 3.8Å; E277-W323 HydrophobicContact CB-CZ2 4.19Å; E277-W323 HydrophobicContact CB-CZ3 4.38Å; E277-W323 HydrophobicContact CG-CH2 3.66Å; E277-W323 HydrophobicContact CG-CZ3 3.96Å
278	Q	92	Very high	93.5	Very high	20 Å²	20	79 Å²	79	9%	0.093	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-15.8	-177.7	72.2	-175.9	-38	0	0	115.1	F221 R226 Q274 K275 Q276	F221-Q278 HydrophobicContact CE1-CB 4.26Å; R226-Q278 HydrophobicContact CB-CB 4.19Å; R226-Q278 HydrophobicContact CG-CB 4.02Å; R226-Q278 HydrophobicContact CG-CG 4.13Å; Q274-Q278 WeakPolarHBondContact O-CB 3.38Å; Q274-Q278 WeakPolarHBondContact O-CG 3.49Å; Q274-Q278 PolarHBondContact O-N 3.26Å; Q274-Q278 VanDerWaalsContact O-N 3.11Å; K275-Q278 PolarHBondContact O-NE2 3.31Å; Q276-Q278 VanDerWaalsContact C-N 3.29Å; Q276-Q278 PolarHBondContact O-N 2.73Å
279	F	92.1	Very high	93.6	Very high	111 Å²	111	76.3 Å²	76.3	49%	0.487	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-8.4	179.9	-62.1	-73.1	0	0	0	113.2	R233 K275 Q276 E277	R233-F279 PolarHBondContact NH1-O 3.21Å; K275-F279 WeakPolarHBondContact O-CD2 3.4Å; K275-F279 VanDerWaalsContact O-CE2 3.25Å; K275-F279 WeakPolarHBondContact O-CE2 3.43Å; Q276-F279 PolarHBondContact O-N 3.23Å; E277-F279 PolarHBondContact O-N 2.78Å
280	K	91.3	Very high	93.8	Very high	112 Å²	112	71.2 Å²	71.2	49%	0.487	36%	0.355	S	S	.	.	S	Bend	trans	-79.1	153.6	178.1	-62	-177.6	-172.6	167.9	0	110.2	R233 E277	R233-K280 VanDerWaalsContact NH1-C 3.28Å; R233-K280 PolarHBondContact NH1-O 3.1Å; R233-K280 PolarHBondContact NH2-O 3.16Å; E277-K280 VanDerWaalsContact CD-NZ 3.28Å; E277-K280 PolarHBondContact O-N 2.7Å; E277-K280 IonicContact OE1-NZ 3.86Å; E277-K280 PolarHBondContact OE1-NZ 2.68Å; E277-K280 WeakPolarHBondContact OE2-CD 3.38Å; E277-K280 IonicContact OE2-NZ 3.93Å; E277-K280 PolarHBondContact OE2-NZ 3.09Å
281	V	88.5	Confident	93.9	Very high	62 Å²	62	74.6 Å²	74.6	38%	0.376	37%	0.371	S	S	.	.			trans	-83.5	127.4	166.5	-179.5	0	0	0	0	106	R233 R283	R233-V281 HydrophobicContact CB-CG2 4.22Å; V281-R283 HydrophobicContact CG1-CG 4.23Å; V281-R283 PolarHBondContact O-N 2.95Å
282	D	93.3	Very high	94.2	Very high	18 Å²	18	76.5 Å²	76.5	10%	0.096	38%	0.377	C	S	.	.			trans	-81.4	108.7	172.5	176.3	14	0	0	0	107.7	S218 R220 E230 R234 E284 G285	S218-D282 WeakPolarHBondContact CB-OD2 3.49Å; S218-D282 WeakPolarHBondContact OG-CB 3.33Å; S218-D282 PolarHBondContact OG-OD2 3.04Å; R220-D282 WeakPolarHBondContact CD-OD2 3.42Å; R220-D282 WeakPolarHBondContact CG-OD2 3.1Å; E230-D282 PolarHBondContact OE1-N 2.95Å; R234-D282 PolarHBondContact NH2-O 2.91Å; R234-D282 IonicContact NH2-OD2 3.81Å; D282-E284 PolarHBondContact OD1-N 3.22Å; D282-G285 PolarHBondContact OD1-N 3.41Å; D282-G285 WeakPolarHBondContact OD2-CA 3.42Å
283	R	90.6	Very high	94.5	Very high	228 Å²	228	76.6 Å²	76.6	86%	0.86	36%	0.362	S	S	*	.	S	Bend	trans	-93.3	-10.1	-178.4	-66.9	-174.3	176.4	169.5	-1.5	113.3	V281	V281-R283 HydrophobicContact CG1-CG 4.23Å; V281-R283 PolarHBondContact O-N 2.95Å
284	E	90.6	Very high	94.8	Very high	169 Å²	169	76.5 Å²	76.5	79%	0.79	36%	0.357	S	S	*	.	S	Bend	trans	-107.2	-40.4	-171.1	-62.1	179.3	175.1	0	0	110.7	D282	D282-E284 PolarHBondContact OD1-N 3.22Å
285	G	92.8	Very high	95	Very high	12 Å²	12	81 Å²	81	12%	0.124	38%	0.382	C	S	.	.			trans	-88.2	162	-177.6	0	0	0	0	0	114.2	R234 D282 T289	R234-G285 PolarHBondContact NH1-O 3.34Å; R234-G285 PolarHBondContact NH2-O 2.76Å; D282-G285 PolarHBondContact OD1-N 3.41Å; D282-G285 WeakPolarHBondContact OD2-CA 3.42Å; G285-T289 VanDerWaalsContact CA-OG1 3.26Å; G285-T289 WeakPolarHBondContact CA-OG1 3.38Å
286	G	98.1	Very high	95.2	Very high	0 Å²	0	76 Å²	76	0%	0	37%	0.365	C	S	.	.	S	Bend	trans	160.6	-157.8	-178.9	0	0	0	0	0	114.1	N215 M217 N219 N288 T289 V290	N215-G286 CarbonylContact O-C 3.57Å; N215-G286 WeakPolarHBondContact O-CA 3.25Å; M217-G286 WeakPolarHBondContact O-CA 3.08Å; N219-G286 PolarHBondContact ND2-O 3.17Å; G286-N288 VanDerWaalsContact C-N 3.28Å; G286-N288 PolarHBondContact O-N 3.25Å; G286-T289 PolarHBondContact N-OG1 3.32Å; G286-T289 PolarHBondContact O-N 3.32Å; G286-T289 VanDerWaalsContact O-N 3.12Å; G286-T289 PolarHBondContact O-OG1 2.96Å; G286-T289 VanDerWaalsContact O-OG1 3.11Å; G286-V290 PolarHBondContact O-N 3.41Å; G286-V290 VanDerWaalsContact O-N 3.12Å
287	L	98.6	Very high	95.5	Very high	16 Å²	16	75.1 Å²	75.1	8%	0.084	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-44.1	175.8	-177.4	60.6	0	0	0	112.6	N146 F149 L150 Y211 Q212 N215 T289 V290	N146-L287 HydrophobicContact CB-CD1 4.01Å; F149-L287 HydrophobicContact CB-CD1 4.3Å; F149-L287 HydrophobicContact CD1-CD1 3.76Å; F149-L287 HydrophobicContact CD1-CD2 3.74Å; F149-L287 HydrophobicContact CD1-CG 4.36Å; F149-L287 HydrophobicContact CE1-CD2 3.69Å; F149-L287 HydrophobicContact CG-CD1 4.27Å; F149-L287 HydrophobicContact CZ-CD2 4.4Å; L150-L287 HydrophobicContact CD1-CD1 4.06Å; L150-L287 HydrophobicContact CD2-CD1 3.8Å; L150-L287 HydrophobicContact CD2-CG 4.23Å; L150-L287 HydrophobicContact CG-CD1 3.65Å; Y211-L287 HydrophobicContact CD1-CD2 4.16Å; Y211-L287 HydrophobicContact CE1-CD1 4.19Å; Y211-L287 HydrophobicContact CE1-CD2 4.31Å; Q212-L287 HydrophobicContact CG-CD2 4.22Å; N215-L287 PolarHBondContact O-N 3.27Å; N215-L287 PolarHBondContact OD1-N 3.14Å; L287-T289 VanDerWaalsContact C-N 3.27Å; L287-T289 PolarHBondContact O-N 3.34Å; L287-V290 WeakPolarHBondContact O-CG1 3.13Å
288	N	98.4	Very high	95.8	Very high	117 Å²	117	76 Å²	76	63%	0.626	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-7.7	-177.6	64.1	-0.4	0	0	0	115	N215 G286	N215-N288 PolarHBondContact ND2-ND2 2.79Å; N215-N288 PolarHBondContact ND2-OD1 3.23Å; N215-N288 PolarHBondContact OD1-N 3.21Å; N215-N288 VanDerWaalsContact OD1-N 3.11Å; N215-N288 PolarHBondContact OD1-ND2 3.23Å; N215-N288 PolarHBondContact OD1-OD1 3.37Å; N215-N288 VanDerWaalsContact OD1-OD1 3.11Å; G286-N288 VanDerWaalsContact C-N 3.28Å; G286-N288 PolarHBondContact O-N 3.25Å
289	T	98.6	Very high	96	Very high	54 Å²	54	79.4 Å²	79.4	33%	0.331	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.8	-5.2	-177.2	50.8	0	0	0	0	113.5	N219 G285 G286 L287 K291	N219-T289 PolarHBondContact ND2-OG1 2.81Å; G285-T289 VanDerWaalsContact CA-OG1 3.26Å; G285-T289 WeakPolarHBondContact CA-OG1 3.38Å; G286-T289 PolarHBondContact N-OG1 3.32Å; G286-T289 PolarHBondContact O-N 3.32Å; G286-T289 VanDerWaalsContact O-N 3.12Å; G286-T289 PolarHBondContact O-OG1 2.96Å; G286-T289 VanDerWaalsContact O-OG1 3.11Å; L287-T289 VanDerWaalsContact C-N 3.27Å; L287-T289 PolarHBondContact O-N 3.34Å; T289-K291 PolarHBondContact O-N 3.48Å
290	V	98.8	Very high	96.3	Very high	16 Å²	16	77 Å²	77	10%	0.097	39%	0.387	C	S	.	.			trans	-56.9	130.4	178.5	68.9	0	0	0	0	109.9	A143 N146 V147 L150 N219 G286 L287 Y292	A143-V290 HydrophobicContact CB-CG2 4.3Å; N146-V290 HydrophobicContact CB-CB 4.23Å; N146-V290 HydrophobicContact CB-CG1 4.15Å; N146-V290 HydrophobicContact CB-CG2 4.34Å; V147-V290 HydrophobicContact CG2-CG2 4Å; L150-V290 HydrophobicContact CD1-CG1 3.69Å; N219-V290 WeakPolarHBondContact ND2-CA 3.25Å; N219-V290 PolarHBondContact ND2-N 3.03Å; N219-V290 WeakPolarHBondContact OD1-CB 3.34Å; N219-V290 WeakPolarHBondContact OD1-CG2 3.37Å; G286-V290 PolarHBondContact O-N 3.41Å; G286-V290 VanDerWaalsContact O-N 3.12Å; L287-V290 WeakPolarHBondContact O-CG1 3.13Å; V290-Y292 HydrophobicContact CG1-CD1 3.91Å; V290-Y292 HydrophobicContact CG1-CE1 3.93Å; V290-Y292 HydrophobicContact CG2-CD1 4.27Å
291	K	98.7	Very high	96.5	Very high	136 Å²	136	75.1 Å²	75.1	59%	0.591	39%	0.389	S	S	*	.			trans	-110.9	118.9	179.7	-61.7	-55.8	-178.2	-175.1	0	108.3	T289 D315	T289-K291 PolarHBondContact O-N 3.48Å; K291-D315 HydrophobicContact CB-CB 3.72Å; K291-D315 PolarHBondContact O-N 3.47Å
292	Y	98.8	Very high	97	Very high	64 Å²	64	72.8 Å²	72.8	25%	0.251	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	169	-175.6	72.8	-77.8	0	0	0	111.3	V147 L150 E151 V290 V294 M313	V147-Y292 HydrophobicContact CB-CD2 4.28Å; V147-Y292 HydrophobicContact CB-CE2 4.33Å; V147-Y292 HydrophobicContact CB-CG 4.45Å; V147-Y292 HydrophobicContact CG1-CD2 3.55Å; V147-Y292 HydrophobicContact CG1-CE2 3.46Å; V147-Y292 VanDerWaalsContact CG1-CE2 3.46Å; V147-Y292 HydrophobicContact CG1-CG 4.2Å; V147-Y292 HydrophobicContact CG2-CD1 3.62Å; V147-Y292 HydrophobicContact CG2-CD2 3.72Å; V147-Y292 HydrophobicContact CG2-CE1 4.03Å; V147-Y292 HydrophobicContact CG2-CE2 4.13Å; V147-Y292 HydrophobicContact CG2-CG 3.44Å; V147-Y292 VanDerWaalsContact CG2-CG 3.44Å; L150-Y292 HydrophobicContact CD1-CE1 3.79Å; E151-Y292 HydrophobicContact CG-CE2 4.05Å; E151-Y292 VanDerWaalsContact OE1-CE2 3.22Å; E151-Y292 WeakPolarHBondContact OE1-CE2 3.48Å; E151-Y292 VanDerWaalsContact OE1-CZ 3.31Å; E151-Y292 PolarHBondContact OE1-OH 2.87Å; V290-Y292 HydrophobicContact CG1-CD1 3.91Å; V290-Y292 HydrophobicContact CG1-CE1 3.93Å; V290-Y292 HydrophobicContact CG2-CD1 4.27Å; Y292-V294 HydrophobicContact CD2-CG2 4.3Å; Y292-V294 HydrophobicContact CE2-CG2 3.96Å; Y292-M313 CarbonylContact C-O 3.59Å; Y292-M313 WeakPolarHBondContact CA-O 3.24Å
293	H	98.3	Very high	97	Very high	96 Å²	96	76 Å²	76	44%	0.444	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	150.8	157.2	66.2	-85.1	0	0	0	110.3	M313	H293-M313 WeakPolarHBondContact CE1-CB 3.35Å; H293-M313 VanDerWaalsContact CE1-CG 3.47Å; H293-M313 WeakPolarHBondContact CE1-CG 3.47Å; H293-M313 PolarHBondContact N-O 3.38Å; H293-M313 WeakPolarHBondContact ND1-CB 3.38Å; H293-M313 WeakPolarHBondContact NE2-CB 3.4Å; H293-M313 WeakPolarHBondContact NE2-CG 3.4Å; H293-M313 PolarHBondContact O-N 3.46Å
294	V	98.7	Very high	97.2	Very high	36 Å²	36	68 Å²	68	22%	0.218	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	110.6	170.1	-178	0	0	0	0	107.5	E151 Y292 S296 R297 N311	E151-V294 HydrophobicContact CG-CG2 3.99Å; Y292-V294 HydrophobicContact CD2-CG2 4.3Å; Y292-V294 HydrophobicContact CE2-CG2 3.96Å; V294-S296 WeakPolarHBondContact CG1-O 3.47Å; V294-R297 HydrophobicContact CG1-CG 3.82Å; V294-N311 CarbonylContact C-O 3.58Å; V294-N311 WeakPolarHBondContact CA-O 3.45Å
295	D	98.3	Very high	97.5	Very high	106 Å²	106	60.1 Å²	60.1	57%	0.567	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	-43.4	179.1	179.8	67.4	0	0	0	111.1	N311 M313	D295-N311 HydrophobicContact CB-CB 4.25Å; D295-N311 PolarHBondContact N-O 2.89Å; D295-M313 HydrophobicContact CB-CG 4.29Å
296	S	98.4	Very high	97.7	Very high	37 Å²	37	62 Å²	62	26%	0.259	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	157.8	175.5	74.3	0	0	0	0	112.6	V294 N311	V294-S296 WeakPolarHBondContact CG1-O 3.47Å; S296-N311 PolarHBondContact O-N 2.74Å; S296-N311 WeakPolarHBondContact OG-CB 3.49Å; S296-N311 PolarHBondContact OG-ND2 3.48Å
297	R	98.6	Very high	97.7	Very high	116 Å²	116	62.2 Å²	62.2	44%	0.438	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129.8	170.1	-54.9	-172.9	-168.7	-109.6	-5.8	109.3	E151 V294 V309 L310	E151-R297 IonicContact OE2-CZ 3.35Å; E151-R297 VanDerWaalsContact OE2-CZ 3.26Å; E151-R297 IonicContact OE2-NH1 2.75Å; E151-R297 PolarHBondContact OE2-NH1 3.31Å; E151-R297 IonicContact OE2-NH2 2.69Å; E151-R297 PolarHBondContact OE2-NH2 3.36Å; V294-R297 HydrophobicContact CG1-CG 3.82Å; R297-V309 WeakPolarHBondContact CA-O 3.29Å; R297-L310 HydrophobicContact CB-CD2 4.24Å; R297-L310 HydrophobicContact CG-CD2 3.69Å
298	T	98	Very high	97.7	Very high	70 Å²	70	62.3 Å²	62.3	43%	0.429	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	121.4	-177.5	-54.5	0	0	0	0	109.6	L300 V309	T298-L300 PolarHBondContact O-N 3.2Å; T298-V309 PolarHBondContact N-O 3.05Å; T298-V309 PolarHBondContact O-N 3.45Å
299	A	97.4	Very high	97.7	Very high	92 Å²	92	57.8 Å²	57.8	76%	0.76	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	127.7	165.8	0	0	0	0	0	108.8
300	L	96.8	Very high	97.7	Very high	59 Å²	59	55.2 Å²	55.2	31%	0.309	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	142.6	179.1	178.8	66.4	0	0	0	108.9	L108 T298 V302 P306 C307 V309	L108-L300 HydrophobicContact CD2-CD2 4.35Å; T298-L300 PolarHBondContact O-N 3.2Å; L300-V302 HydrophobicContact CD2-CG2 4.02Å; L300-V302 HydrophobicContact CG-CG2 4.08Å; L300-P306 CarbonylContact O-C 3.55Å; L300-C307 PolarHBondContact N-O 2.94Å; L300-C307 PolarHBondContact O-N 2.89Å; L300-C307 VanDerWaalsContact O-O 3.05Å; L300-V309 HydrophobicContact CB-CG2 4Å; L300-V309 HydrophobicContact CD2-CG2 3.89Å
301	S	97.2	Very high	97.7	Very high	73 Å²	73	56 Å²	56	51%	0.51	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.2	170	-177.4	0	0	0	0	108.9	G304 A305	S301-G304 VanDerWaalsContact OG-C 3.26Å; S301-G304 WeakPolarHBondContact OG-CA 3.26Å; S301-G304 PolarHBondContact OG-N 3.36Å; S301-G304 PolarHBondContact OG-O 3.36Å; S301-A305 WeakPolarHBondContact CA-O 3.08Å
302	V	97.5	Very high	97.7	Very high	14 Å²	14	49.5 Å²	49.5	9%	0.085	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	106.7	179.4	-179.6	0	0	0	0	107.9	L109 V112 P113 L300 G304 A305	L109-V302 HydrophobicContact CD2-CG1 3.9Å; L109-V302 WeakPolarHBondContact O-CG1 3.08Å; V112-V302 HydrophobicContact CB-CB 3.97Å; V112-V302 HydrophobicContact CB-CG1 4.45Å; V112-V302 HydrophobicContact CB-CG2 4.16Å; V112-V302 HydrophobicContact CG1-CB 3.95Å; V112-V302 HydrophobicContact CG1-CG2 4.23Å; V112-V302 HydrophobicContact CG2-CG2 4.3Å; P113-V302 HydrophobicContact CG-CG1 4.27Å; L300-V302 HydrophobicContact CD2-CG2 4.02Å; L300-V302 HydrophobicContact CG-CG2 4.08Å; V302-G304 PolarHBondContact O-N 3.01Å; V302-A305 PolarHBondContact N-O 3.36Å; V302-A305 PolarHBondContact O-N 2.95Å; V302-A305 VanDerWaalsContact O-N 3.1Å
303	G	93.9	Very high	97.7	Very high	85 Å²	85	49.4 Å²	49.4	88%	0.876	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	31.4	-177	0	0	0	0	0	113.4	A305	G303-A305 VanDerWaalsContact C-N 3.34Å
304	G	94.8	Very high	97.8	Very high	61 Å²	61	45.2 Å²	45.2	63%	0.629	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	-22.8	-176.5	0	0	0	0	0	114.4	S301 V302	S301-G304 VanDerWaalsContact OG-C 3.26Å; S301-G304 WeakPolarHBondContact OG-CA 3.26Å; S301-G304 PolarHBondContact OG-N 3.36Å; S301-G304 PolarHBondContact OG-O 3.36Å; V302-G304 PolarHBondContact O-N 3.01Å
305	A	96.9	Very high	97.8	Very high	3 Å²	3	48.6 Å²	48.6	3%	0.025	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	124.2	179.1	0	0	0	0	0	111.2	V112 P113 H116 S301 V302 G303	V112-A305 HydrophobicContact CG1-CB 3.86Å; P113-A305 HydrophobicContact CB-CB 4.29Å; H116-A305 HydrophobicContact CB-CB 3.69Å; S301-A305 WeakPolarHBondContact CA-O 3.08Å; V302-A305 PolarHBondContact N-O 3.36Å; V302-A305 PolarHBondContact O-N 2.95Å; V302-A305 VanDerWaalsContact O-N 3.1Å; G303-A305 VanDerWaalsContact C-N 3.34Å
306	P	97.1	Very high	97.8	Very high	52 Å²	52	44 Å²	44	34%	0.338	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	147.9	-176.8	32.7	-34.9	0	0	0	112.7	L300	L300-P306 CarbonylContact O-C 3.55Å
307	C	98	Very high	97.7	Very high	4 Å²	4	46.6 Å²	46.6	3%	0.027	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	161.5	165.7	66.1	0	0	0	0	111.1	V112 I128 V130 L300	V112-C307 HydrophobicContact CG1-CB 4.22Å; V112-C307 HydrophobicContact CG2-CB 4.42Å; I128-C307 HydrophobicContact CB-CB 3.79Å; I128-C307 HydrophobicContact CG2-CB 3.95Å; I128-C307 CarbonylContact O-C 3.48Å; I128-C307 WeakPolarHBondContact O-CA 3.34Å; I128-C307 WeakPolarHBondContact O-CB 3.32Å; V130-C307 HydrophobicContact CG2-CB 4.44Å; L300-C307 PolarHBondContact N-O 2.94Å; L300-C307 PolarHBondContact O-N 2.89Å; L300-C307 VanDerWaalsContact O-O 3.05Å
308	T	98.6	Very high	97.6	Very high	18 Å²	18	46.7 Å²	46.7	11%	0.11	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.7	171.8	-63.8	0	0	0	0	109.6	H127 I128 Y129 V130 L310	H127-T308 PolarHBondContact NE2-OG1 3.38Å; I128-T308 PolarHBondContact O-N 3.45Å; Y129-T308 CarbonylContact C-O 3.4Å; Y129-T308 WeakPolarHBondContact CA-O 3.49Å; Y129-T308 HydrophobicContact CD1-CG2 4.5Å; V130-T308 PolarHBondContact N-O 2.93Å; T308-L310 HydrophobicContact CG2-CD2 3.77Å; T308-L310 HydrophobicContact CG2-CG 4.34Å
309	V	98.8	Very high	97.5	Very high	21 Å²	21	49.9 Å²	49.9	13%	0.127	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	123.6	169.6	-173.6	0	0	0	0	109.2	V130 N132 R297 T298 L300	V130-V309 HydrophobicContact CB-CB 4.45Å; V130-V309 HydrophobicContact CB-CG1 4.43Å; V130-V309 HydrophobicContact CB-CG2 4.11Å; V130-V309 HydrophobicContact CG1-CG1 4.47Å; V130-V309 HydrophobicContact CG2-CG2 4.41Å; N132-V309 HydrophobicContact CB-CG1 3.98Å; R297-V309 WeakPolarHBondContact CA-O 3.29Å; T298-V309 PolarHBondContact N-O 3.05Å; T298-V309 PolarHBondContact O-N 3.45Å; L300-V309 HydrophobicContact CB-CG2 4Å; L300-V309 HydrophobicContact CD2-CG2 3.89Å
310	L	98.8	Very high	97.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	113.1	171.1	-56.9	-178.7	0	0	0	108.1	Y129 V130 L131 N132 E151 R297 T308 I312	Y129-L310 HydrophobicContact CD1-CD1 4.26Å; V130-L310 PolarHBondContact O-N 3.35Å; L131-L310 HydrophobicContact CD2-CD1 3.95Å; N132-L310 WeakPolarHBondContact CA-O 3.41Å; N132-L310 WeakPolarHBondContact CB-O 3.29Å; N132-L310 PolarHBondContact N-O 3Å; E151-L310 HydrophobicContact CB-CD1 3.63Å; E151-L310 HydrophobicContact CG-CD1 4.35Å; R297-L310 HydrophobicContact CB-CD2 4.24Å; R297-L310 HydrophobicContact CG-CD2 3.69Å; T308-L310 HydrophobicContact CG2-CD2 3.77Å; T308-L310 HydrophobicContact CG2-CG 4.34Å; L310-I312 HydrophobicContact CB-CD1 4.1Å; L310-I312 HydrophobicContact CB-CG1 4Å; L310-I312 PolarHBondContact O-N 3.34Å
311	N	98.9	Very high	97.4	Very high	32 Å²	32	44.8 Å²	44.8	17%	0.171	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	108.8	170	-75.4	-12.4	0	0	0	108.2	N132 V134 V294 D295 S296	N132-N311 PolarHBondContact ND2-OD1 3.33Å; V134-N311 HydrophobicContact CG1-CB 3.89Å; V134-N311 HydrophobicContact CG2-CB 4.05Å; V294-N311 CarbonylContact C-O 3.58Å; V294-N311 WeakPolarHBondContact CA-O 3.45Å; D295-N311 HydrophobicContact CB-CB 4.25Å; D295-N311 PolarHBondContact N-O 2.89Å; S296-N311 PolarHBondContact O-N 2.74Å; S296-N311 WeakPolarHBondContact OG-CB 3.49Å; S296-N311 PolarHBondContact OG-ND2 3.48Å
312	I	98.9	Very high	97.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.9	-171.1	-61.4	160.5	0	0	0	109.1	L131 N132 Q133 V134 L144 V147 L310 L314	L131-I312 HydrophobicContact CB-CD1 3.75Å; L131-I312 HydrophobicContact CD2-CD1 4.07Å; N132-I312 PolarHBondContact O-N 3.48Å; Q133-I312 WeakPolarHBondContact CA-O 3.26Å; V134-I312 WeakPolarHBondContact CG2-O 3.18Å; V134-I312 PolarHBondContact N-O 2.89Å; L144-I312 HydrophobicContact CD2-CB 4.07Å; L144-I312 HydrophobicContact CD2-CD1 3.82Å; L144-I312 HydrophobicContact CD2-CG2 4.05Å; V147-I312 HydrophobicContact CB-CD1 4.12Å; V147-I312 HydrophobicContact CB-CG2 4.34Å; V147-I312 HydrophobicContact CG1-CD1 3.57Å; V147-I312 HydrophobicContact CG1-CG1 3.8Å; V147-I312 HydrophobicContact CG1-CG2 3.96Å; V147-I312 HydrophobicContact CG2-CG2 4.09Å; L310-I312 HydrophobicContact CB-CD1 4.1Å; L310-I312 HydrophobicContact CB-CG1 4Å; L310-I312 PolarHBondContact O-N 3.34Å; I312-L314 HydrophobicContact CG2-CD2 3.71Å; I312-L314 HydrophobicContact CG2-CG 4.1Å
313	M	98.8	Very high	97.4	Very high	62 Å²	62	44.1 Å²	44.1	31%	0.305	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	104.8	169.7	-73.9	-73.7	-71.2	0	0	108.3	V134 D135 Y292 H293 D295	V134-M313 HydrophobicContact CB-SD 4.45Å; V134-M313 HydrophobicContact CG2-CG 3.7Å; V134-M313 HydrophobicContact CG2-SD 3.72Å; D135-M313 VanDerWaalsContact CA-SD 3.52Å; D135-M313 HydrophobicContact CB-CE 4.23Å; D135-M313 HydrophobicContact CB-SD 3.79Å; D135-M313 PolarHBondContact N-SD 3.26Å; D135-M313 VanDerWaalsContact N-SD 3.4Å; Y292-M313 CarbonylContact C-O 3.59Å; Y292-M313 WeakPolarHBondContact CA-O 3.24Å; H293-M313 WeakPolarHBondContact CE1-CB 3.35Å; H293-M313 VanDerWaalsContact CE1-CG 3.47Å; H293-M313 WeakPolarHBondContact CE1-CG 3.47Å; H293-M313 PolarHBondContact N-O 3.38Å; H293-M313 WeakPolarHBondContact ND1-CB 3.38Å; H293-M313 WeakPolarHBondContact NE2-CB 3.4Å; H293-M313 WeakPolarHBondContact NE2-CG 3.4Å; H293-M313 PolarHBondContact O-N 3.46Å; D295-M313 HydrophobicContact CB-CG 4.29Å
314	L	98.8	Very high	97.5	Very high	8 Å²	8	40 Å²	40	4%	0.042	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	142.2	174	-60.5	177.3	0	0	0	110.1	Q133 D135 F137 N140 A143 L144 V147 W222 I312	Q133-L314 HydrophobicContact CG-CD1 4.08Å; Q133-L314 HydrophobicContact CG-CG 4.35Å; D135-L314 WeakPolarHBondContact OD2-CB 3.31Å; D135-L314 PolarHBondContact OD2-N 2.95Å; F137-L314 WeakPolarHBondContact CD2-O 3.22Å; F137-L314 VanDerWaalsContact CE2-O 3.3Å; F137-L314 WeakPolarHBondContact CE2-O 3.33Å; N140-L314 HydrophobicContact CB-CD1 3.85Å; A143-L314 HydrophobicContact CB-CD1 3.82Å; A143-L314 HydrophobicContact CB-CD2 4.16Å; L144-L314 HydrophobicContact CD2-CD1 4.31Å; L144-L314 HydrophobicContact CG-CD1 4.32Å; V147-L314 HydrophobicContact CG2-CD2 3.87Å; W222-L314 HydrophobicContact CH2-CB 3.89Å; W222-L314 HydrophobicContact CH2-CD1 4.18Å; W222-L314 HydrophobicContact CZ3-CB 4.39Å; W222-L314 HydrophobicContact CZ3-CD1 4.16Å; I312-L314 HydrophobicContact CG2-CD2 3.71Å; I312-L314 HydrophobicContact CG2-CG 4.1Å
315	D	98.5	Very high	97.6	Very high	107 Å²	107	38.5 Å²	38.5	57%	0.572	22%	0.218	S	C	*	.			trans	-89.9	150.7	169.2	-170.6	16.2	0	0	0	110.5	K291	K291-D315 HydrophobicContact CB-CB 3.72Å; K291-D315 PolarHBondContact O-N 3.47Å
316	C	98.1	Very high	97	Very high	10 Å²	10	44.2 Å²	44.2	7%	0.068	24%	0.243	C	C	.	.			trans	-130.1	115.9	174.7	172.8	0	0	0	0	110.8	F137 W222 K318 C324	F137-C316 HydrophobicContact CD1-CB 4.1Å; F137-C316 HydrophobicContact CD2-CB 4.01Å; F137-C316 HydrophobicContact CE1-CB 3.85Å; F137-C316 HydrophobicContact CE2-CB 3.73Å; F137-C316 HydrophobicContact CG-CB 4.19Å; F137-C316 HydrophobicContact CZ-CB 3.65Å; W222-C316 HydrophobicContact CH2-CB 4.22Å; W222-C316 HydrophobicContact CZ2-CB 3.86Å; C316-K318 PolarHBondContact O-N 2.97Å; C316-K318 VanDerWaalsContact O-N 3.09Å; C316-C324 HydrophobicContact CB-CB 3.77Å; C316-C324 WeakPolarHBondContact CB-SG 3.49Å; C316-C324 WeakPolarHBondContact SG-CB 3.37Å; C316-C324 CovalentContact SG-SG 2.02Å; C316-C324 PolarHBondContact SG-SG 3.48Å
317	D	97.3	Very high	95.2	Very high	91 Å²	91	48.1 Å²	48.1	49%	0.487	27%	0.272	S	S	.	.			trans	-70.4	100.9	159.1	-178.3	-13.8	0	0	0	109	T319 A320 T321	D317-T319 PolarHBondContact O-N 2.97Å; D317-T319 WeakPolarHBondContact OD1-CA 3.44Å; D317-T319 WeakPolarHBondContact OD1-CB 3.38Å; D317-T319 PolarHBondContact OD1-N 3.33Å; D317-A320 HydrophobicContact CB-CB 4.09Å; D317-A320 PolarHBondContact O-N 2.99Å; D317-A320 PolarHBondContact OD1-N 3.35Å; D317-A320 WeakPolarHBondContact OD2-CB 3.34Å; D317-T321 PolarHBondContact O-N 3.38Å; D317-T321 PolarHBondContact O-OG1 2.95Å
318	K	96.7	Very high	95.1	Very high	119 Å²	119	50.4 Å²	50.4	52%	0.517	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-18.2	178.8	-64.8	-179.6	-177.3	175.8	0	112.9	C316 P322	C316-K318 PolarHBondContact O-N 2.97Å; C316-K318 VanDerWaalsContact O-N 3.09Å; K318-P322 VanDerWaalsContact O-CA 3.24Å; K318-P322 WeakPolarHBondContact O-CA 3.38Å; K318-P322 VanDerWaalsContact O-CB 3.25Å; K318-P322 WeakPolarHBondContact O-CB 3.48Å; K318-P322 WeakPolarHBondContact O-CD 3.44Å
319	T	95.8	Very high	94.9	Very high	136 Å²	136	52.1 Å²	52.1	83%	0.834	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-41.6	174.5	-46.9	0	0	0	0	109.7	D317	D317-T319 PolarHBondContact O-N 2.97Å; D317-T319 WeakPolarHBondContact OD1-CA 3.44Å; D317-T319 WeakPolarHBondContact OD1-CB 3.38Å; D317-T319 PolarHBondContact OD1-N 3.33Å
320	A	95.3	Very high	94.7	Very high	36 Å²	36	53.8 Å²	53.8	30%	0.298	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-36.6	178.9	0	0	0	0	0	113.9	R220 D317	R220-A320 PolarHBondContact NH2-O 3.25Å; D317-A320 HydrophobicContact CB-CB 4.09Å; D317-A320 PolarHBondContact O-N 2.99Å; D317-A320 PolarHBondContact OD1-N 3.35Å; D317-A320 WeakPolarHBondContact OD2-CB 3.34Å
321	T	96.5	Very high	94.4	Very high	9 Å²	9	56.9 Å²	56.9	6%	0.055	32%	0.32	C	S	.	.			trans	-136.4	62.6	-175.2	56.9	0	0	0	0	112.2	R220 W222 D317 W323 C324	R220-T321 HydrophobicContact CB-CG2 3.95Å; R220-T321 HydrophobicContact CG-CG2 4Å; W222-T321 PolarHBondContact NE1-OG1 3Å; D317-T321 PolarHBondContact O-N 3.38Å; D317-T321 PolarHBondContact O-OG1 2.95Å; T321-W323 HydrophobicContact CG2-CH2 4.14Å; T321-W323 HydrophobicContact CG2-CZ2 3.64Å; T321-W323 PolarHBondContact O-N 2.96Å; T321-C324 WeakPolarHBondContact O-CB 3.47Å; T321-C324 PolarHBondContact O-N 3.38Å; T321-C324 PolarHBondContact O-SG 3.35Å; T321-C324 VanDerWaalsContact O-SG 3.41Å
322	P	96.8	Very high	94.1	Very high	60 Å²	60	58.5 Å²	58.5	39%	0.39	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-58.1	-22.5	-176	21.2	-32.8	0	0	0	114.1	K318 C324 T325	K318-P322 VanDerWaalsContact O-CA 3.24Å; K318-P322 WeakPolarHBondContact O-CA 3.38Å; K318-P322 VanDerWaalsContact O-CB 3.25Å; K318-P322 WeakPolarHBondContact O-CB 3.48Å; K318-P322 WeakPolarHBondContact O-CD 3.44Å; P322-C324 PolarHBondContact O-N 3.32Å; P322-T325 PolarHBondContact O-OG1 2.95Å
323	W	97.2	Very high	93.8	Very high	12 Å²	12	62.4 Å²	62.4	5%	0.045	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-73.1	3.5	177.1	58.1	84.1	0	0	0	114.5	R138 R220 W222 I271 A273 Q274 E277 T321 T325	R138-W323 WeakPolarHBondContact CD-O 3.34Å; R138-W323 PolarHBondContact NH1-O 3.32Å; R220-W323 PolarHBondContact O-NE1 3.49Å; W222-W323 AromaticContact CD1-CD1 3.92Å; W222-W323 AromaticContact CD1-NE1 3.79Å; I271-W323 HydrophobicContact CB-CB 4.03Å; A273-W323 HydrophobicContact CB-CZ3 4.41Å; Q274-W323 HydrophobicContact CB-CB 3.83Å; Q274-W323 HydrophobicContact CB-CD2 3.78Å; Q274-W323 HydrophobicContact CB-CE3 4.03Å; Q274-W323 HydrophobicContact CB-CG 3.68Å; Q274-W323 HydrophobicContact CG-CB 4.06Å; Q274-W323 HydrophobicContact CG-CD2 3.96Å; Q274-W323 HydrophobicContact CG-CG 3.63Å; Q274-W323 VanDerWaalsContact NE2-CD1 3.31Å; E277-W323 HydrophobicContact CB-CH2 3.8Å; E277-W323 HydrophobicContact CB-CZ2 4.19Å; E277-W323 HydrophobicContact CB-CZ3 4.38Å; E277-W323 HydrophobicContact CG-CH2 3.66Å; E277-W323 HydrophobicContact CG-CZ3 3.96Å; T321-W323 HydrophobicContact CG2-CH2 4.14Å; T321-W323 HydrophobicContact CG2-CZ2 3.64Å; T321-W323 PolarHBondContact O-N 2.96Å; W323-T325 PolarHBondContact O-N 2.93Å
324	C	97.3	Very high	93.5	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-68.4	-21.8	170.7	71.1	0	0	0	0	113.2	F137 R138 W222 C316 T321 P322	F137-C324 WeakPolarHBondContact CA-O 3.48Å; F137-C324 WeakPolarHBondContact CB-O 3.33Å; F137-C324 HydrophobicContact CD1-CB 4.32Å; R138-C324 WeakPolarHBondContact CG-O 3.32Å; R138-C324 PolarHBondContact N-O 2.77Å; W222-C324 HydrophobicContact CB-CB 4.21Å; W222-C324 HydrophobicContact CD2-CB 3.4Å; W222-C324 VanDerWaalsContact CE2-CB 3.48Å; W222-C324 HydrophobicContact CE3-CB 3.96Å; W222-C324 HydrophobicContact CG-CB 3.5Å; W222-C324 HydrophobicContact CZ2-CB 4.13Å; C316-C324 HydrophobicContact CB-CB 3.77Å; C316-C324 WeakPolarHBondContact CB-SG 3.49Å; C316-C324 WeakPolarHBondContact SG-CB 3.37Å; C316-C324 CovalentContact SG-SG 2.02Å; C316-C324 PolarHBondContact SG-SG 3.48Å; T321-C324 WeakPolarHBondContact O-CB 3.47Å; T321-C324 PolarHBondContact O-N 3.38Å; T321-C324 PolarHBondContact O-SG 3.35Å; T321-C324 VanDerWaalsContact O-SG 3.41Å; P322-C324 PolarHBondContact O-N 3.32Å
325	T	95.8	Very high	93	Very high	28 Å²	28	66.6 Å²	66.6	17%	0.172	38%	0.378	C	S	.	.	S	Bend	trans	-108.7	163.7	171.3	46.9	0	0	0	0	111	F137 I271 P322 W323 S327	F137-T325 HydrophobicContact CD1-CG2 3.61Å; F137-T325 HydrophobicContact CE1-CG2 3.78Å; I271-T325 VanDerWaalsContact CD1-O 3.26Å; I271-T325 WeakPolarHBondContact CD1-O 3.49Å; P322-T325 PolarHBondContact O-OG1 2.95Å; W323-T325 PolarHBondContact O-N 2.93Å; T325-S327 PolarHBondContact O-N 3.35Å; T325-S327 PolarHBondContact OG1-OG 3.36Å
326	F	85.9	Confident	92.6	Very high	124 Å²	124	63.3 Å²	63.3	54%	0.544	36%	0.362	S	S	.	.			trans	-80.7	5.7	175.9	-72.5	-67.1	0	0	0	114.7	R138	R138-F326 HydrophobicContact CG-CD1 4.4Å; R138-F326 HydrophobicContact CG-CD2 4.39Å; R138-F326 HydrophobicContact CG-CE1 4Å; R138-F326 HydrophobicContact CG-CE2 3.99Å; R138-F326 HydrophobicContact CG-CZ 3.78Å
327	S	58.5	Low	92.1	Very high	134 Å²	134	68.1 Å²	68.1	94%	0.937	39%	0.389	S	S	*	.			trans	-60.1	0	178.8	53.3	0	0	0	0	113.3	T325	T325-S327 PolarHBondContact O-N 3.35Å; T325-S327 PolarHBondContact OG1-OG 3.36Å

Retrieved 327 of 327 residues in 135.7 ms (Link to these results)

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