A0A2K5NBZ4_CERAT 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 , UniProt , Accession A0A2K5NBZ4, Species CERAT (Cercocebus atys, Sooty mangabey), Gene B4GALT7, Length 327 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	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 284.9 ms (Link to these results)

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