A0A2K5LDJ1_CERAT Loading...

Hyaluronan and proteoglycan link protein 2

Mediates a firm binding of versican V2 to hyaluronic acid. May play a pivotal role in the formation of the hyaluronan-associated matrix in the central nervous system (CNS) which facilitates neuronal conduction and general structural stabilization. Binds to hyaluronic acid.

AlphaFold DB , UniProt , Accession A0A2K5LDJ1, Species CERAT (Cercocebus atys, Sooty mangabey), Gene HAPLN2, Length 340 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28	Very low	35.4	Very low	245 Å²	245	134.1 Å²	134.1	100%	1.207	83%	0.831	S	S	*	*				0	137.9	0	-78.3	-177.9	172.7	0	0	108.2
2	P	43.5	Very low	35.5	Very low	130 Å²	130	132.1 Å²	132.1	84%	0.844	82%	0.824	S	S	*	*			trans	-111.3	162.6	-132.8	30.5	-14	0	0	0	112.8
3	G	31.2	Very low	35.7	Very low	83 Å²	83	137.9 Å²	137.9	86%	0.856	83%	0.831	S	S	*	*				123.2	153.6	93.8	0	0	0	0	0	108.5
4	G	33.3	Very low	36	Very low	73 Å²	73	139.5 Å²	139.5	75%	0.753	83%	0.831	S	S	*	*			cis	-152.9	-164.5	0	0	0	0	0	0	108
5	L	34.8	Very low	36	Very low	154 Å²	154	141.1 Å²	141.1	81%	0.806	83%	0.833	S	S	*	*			cis	-163.5	133.1	24.9	-100	147	0	0	0	107.8
6	T	34.2	Very low	35.9	Very low	112 Å²	112	146.3 Å²	146.3	69%	0.687	83%	0.834	S	S	*	*			trans	47.8	146.9	130.5	62.2	0	0	0	0	122.1
7	L	35.1	Very low	35.9	Very low	153 Å²	153	145.1 Å²	145.1	80%	0.801	83%	0.83	S	S	*	*			cis	-163.9	156	16.4	-134.5	124.4	0	0	0	108.3
8	P	45.2	Very low	35.8	Very low	109 Å²	109	145.6 Å²	145.6	71%	0.708	82%	0.821	S	S	*	*			trans	-101.3	161.6	-175.7	36.4	-27.9	0	0	0	113.6
9	T	35.9	Very low	35.8	Very low	135 Å²	135	143.8 Å²	143.8	83%	0.828	81%	0.814	S	S	*	*			trans	-143.7	115.6	166	-0.7	0	0	0	0	112.4
10	L	34.7	Very low	36	Very low	160 Å²	160	143.9 Å²	143.9	84%	0.838	81%	0.81	S	S	*	*			trans	38.4	107.4	151.7	-93.4	70.3	0	0	0	119.9
11	C	33.3	Very low	35.9	Very low	121 Å²	121	146.2 Å²	146.2	82%	0.818	81%	0.812	S	S	*	*			trans	-91.2	113	159.1	-159.9	0	0	0	0	109	F13	C11-F13 PolarHBondContact O-N 3.06Å
12	C	37.2	Very low	36.3	Very low	110 Å²	110	142.9 Å²	142.9	74%	0.743	79%	0.794	S	S	*	*			trans	-72.5	116.2	170.9	-80	0	0	0	0	110	L14	C12-L14 PolarHBondContact O-N 2.97Å
13	F	37	Very low	35.9	Very low	208 Å²	208	145.9 Å²	145.9	91%	0.912	79%	0.793	S	S	*	*			trans	-68.3	116.6	162.7	-85.4	-91.7	0	0	0	109.3	C11	C11-F13 PolarHBondContact O-N 3.06Å
14	L	39.9	Very low	36	Very low	160 Å²	160	145.4 Å²	145.4	84%	0.838	79%	0.788	S	S	*	*			trans	-113.8	130.7	162.4	-80.2	169.7	0	0	0	109.4	C12	C12-L14 PolarHBondContact O-N 2.97Å
15	L	36.8	Very low	36.6	Very low	163 Å²	163	150.4 Å²	150.4	85%	0.853	79%	0.792	S	S	*	*			trans	-58.9	128.7	-173.2	-69	143	0	0	0	112.4	V17	L15-V17 PolarHBondContact O-N 2.8Å
16	W	33.6	Very low	36.5	Very low	224 Å²	224	146.1 Å²	146.1	85%	0.848	79%	0.785	S	S	*	*			trans	-73.4	110.1	160.1	-96.1	11.5	0	0	0	109.3	F18	W16-F18 HydrophobicContact CD2-CE2 4Å; W16-F18 HydrophobicContact CE3-CD2 4.09Å; W16-F18 AromaticContact CE3-CE2 3.26Å; W16-F18 HydrophobicContact CE3-CE2 3.26Å; W16-F18 AromaticContact CE3-CZ 3.98Å; W16-F18 HydrophobicContact CE3-CZ 3.98Å; W16-F18 HydrophobicContact CH2-CE2 4.28Å; W16-F18 HydrophobicContact CH2-CZ 4.2Å; W16-F18 AromaticContact CZ3-CE2 3.42Å; W16-F18 HydrophobicContact CZ3-CE2 3.42Å; W16-F18 VanDerWaalsContact CZ3-CE2 3.42Å; W16-F18 AromaticContact CZ3-CZ 3.74Å; W16-F18 HydrophobicContact CZ3-CZ 3.74Å
17	V	36	Very low	36.7	Very low	126 Å²	126	147.7 Å²	147.7	76%	0.764	79%	0.79	S	S	*	*			trans	-99.7	102	160.3	179.7	0	0	0	0	106.9	L15 T19	L15-V17 PolarHBondContact O-N 2.8Å; V17-T19 PolarHBondContact O-N 2.85Å
18	F	34.8	Very low	37	Very low	154 Å²	154	146.1 Å²	146.1	68%	0.675	79%	0.788	S	S	*	*			trans	-72.1	110.7	165.7	-89.8	-82.3	0	0	0	108.6	W16 I20	W16-F18 HydrophobicContact CD2-CE2 4Å; W16-F18 HydrophobicContact CE3-CD2 4.09Å; W16-F18 AromaticContact CE3-CE2 3.26Å; W16-F18 HydrophobicContact CE3-CE2 3.26Å; W16-F18 AromaticContact CE3-CZ 3.98Å; W16-F18 HydrophobicContact CE3-CZ 3.98Å; W16-F18 HydrophobicContact CH2-CE2 4.28Å; W16-F18 HydrophobicContact CH2-CZ 4.2Å; W16-F18 AromaticContact CZ3-CE2 3.42Å; W16-F18 HydrophobicContact CZ3-CE2 3.42Å; W16-F18 VanDerWaalsContact CZ3-CE2 3.42Å; W16-F18 AromaticContact CZ3-CZ 3.74Å; W16-F18 HydrophobicContact CZ3-CZ 3.74Å; F18-I20 PolarHBondContact O-N 3.19Å
19	T	35.2	Very low	36.6	Very low	112 Å²	112	144.6 Å²	144.6	69%	0.687	79%	0.785	S	S	*	*			trans	-72.4	107.2	162.4	34.5	0	0	0	0	108.6	V17 F21	V17-T19 PolarHBondContact O-N 2.85Å; T19-F21 PolarHBondContact O-N 3.27Å; T19-F21 VanDerWaalsContact O-N 3.07Å
20	I	40.5	Very low	37	Very low	145 Å²	145	143.1 Å²	143.1	74%	0.744	78%	0.78	S	S	*	*			trans	-67.5	101.5	168.1	-61.9	169.4	0	0	0	106.9	F18 H22	F18-I20 PolarHBondContact O-N 3.19Å; I20-H22 PolarHBondContact O-N 2.84Å; I20-H22 VanDerWaalsContact O-N 3.09Å
21	F	33.5	Very low	37.4	Very low	193 Å²	193	143.4 Å²	143.4	85%	0.846	78%	0.777	S	S	*	*			trans	-69.1	102.1	162.7	-99.4	-89.8	0	0	0	107.7	T19 K23	T19-F21 PolarHBondContact O-N 3.27Å; T19-F21 VanDerWaalsContact O-N 3.07Å; F21-K23 PolarHBondContact O-N 2.7Å
22	H	36.3	Very low	38.4	Very low	176 Å²	176	142.6 Å²	142.6	82%	0.815	77%	0.77	S	S	*	*			trans	-61.7	105.2	162.6	-98.1	-10.2	0	0	0	108.3	I20 G24	I20-H22 PolarHBondContact O-N 2.84Å; I20-H22 VanDerWaalsContact O-N 3.09Å; H22-G24 PolarHBondContact O-N 3.34Å
23	K	36	Very low	39.3	Very low	192 Å²	192	138.3 Å²	138.3	84%	0.835	75%	0.745	S	S	*	*			trans	-67.7	88.4	165.1	-163.9	176.1	-173.1	-179	0	106.8	F21 Q25	F21-K23 PolarHBondContact O-N 2.7Å; K23-Q25 PolarHBondContact O-N 2.77Å
24	G	33.4	Very low	40.5	Very low	73 Å²	73	131.7 Å²	131.7	75%	0.753	72%	0.723	S	S	*	*			trans	-61.9	100.5	167.5	0	0	0	0	0	108.2	H22 G26	H22-G24 PolarHBondContact O-N 3.34Å; G24-G26 PolarHBondContact O-N 3.14Å
25	Q	44.5	Very low	42.2	Very low	178 Å²	178	130.7 Å²	130.7	83%	0.832	71%	0.714	S	S	*	*			trans	-75.2	79.9	166.8	-169.3	146.4	-3	0	0	107.1	K23	K23-Q25 PolarHBondContact O-N 2.77Å
26	G	32.2	Very low	44.6	Very low	65 Å²	65	124.6 Å²	124.6	67%	0.67	68%	0.679	S	S	*	*			trans	-81.7	111.2	162	0	0	0	0	0	107.4	G24	G24-G26 PolarHBondContact O-N 3.14Å
27	D	40.2	Very low	47.4	Very low	145 Å²	145	114.4 Å²	114.4	78%	0.775	64%	0.642	S	S	*	*			trans	-50.1	128.3	157.9	-84.4	-36.3	0	0	0	107.8	A29	D27-A29 VanDerWaalsContact C-N 3.33Å; D27-A29 PolarHBondContact O-N 2.74Å
28	P	40.8	Very low	50.1	Low	119 Å²	119	112.5 Å²	112.5	77%	0.773	63%	0.627	S	S	*	*			trans	-65.2	105.9	164.9	27	-27.9	0	0	0	105.6	S30	P28-S30 PolarHBondContact O-N 2.9Å
29	A	37.6	Very low	52.7	Low	77 Å²	77	110.4 Å²	110.4	64%	0.636	63%	0.628	S	S	*	*			trans	-53	104.3	168.8	0	0	0	0	0	107.4	D27 H31	D27-A29 VanDerWaalsContact C-N 3.33Å; D27-A29 PolarHBondContact O-N 2.74Å; A29-H31 VanDerWaalsContact C-N 3.27Å; A29-H31 PolarHBondContact O-N 3.01Å
30	S	44.3	Very low	55.4	Low	105 Å²	105	106.6 Å²	106.6	73%	0.734	61%	0.606	S	S	*	*			trans	-69.7	96.9	164.5	73.2	0	0	0	0	105.4	P28 P32	P28-S30 PolarHBondContact O-N 2.9Å; S30-P32 WeakPolarHBondContact O-CD 3.38Å
31	H	42.3	Very low	57.7	Low	165 Å²	165	107.1 Å²	107.1	76%	0.764	61%	0.608	S	S	*	*			trans	-84.4	101	154.7	-73.8	16.4	0	0	0	105	A29 G33	A29-H31 VanDerWaalsContact C-N 3.27Å; A29-H31 PolarHBondContact O-N 3.01Å; H31-G33 PolarHBondContact O-N 3.27Å
32	P	54.4	Low	60.5	Low	104 Å²	104	104 Å²	104	68%	0.675	60%	0.596	S	S	*	*			trans	-74.1	85.4	166	31.4	-25	0	0	0	104.9	S30	S30-P32 WeakPolarHBondContact O-CD 3.38Å
33	G	56.4	Low	63.2	Low	21 Å²	21	102.2 Å²	102.2	22%	0.216	59%	0.588	C	S	.	*			trans	-50.5	151.4	159.1	0	0	0	0	0	108.6	H31 H35	H31-G33 PolarHBondContact O-N 3.27Å; G33-H35 PolarHBondContact O-N 2.94Å
34	P	61	Low	66.1	Low	68 Å²	68	96.1 Å²	96.1	44%	0.442	57%	0.567	S	S	.	*			trans	-59.8	106.5	179.3	24.8	-32.9	0	0	0	109.4	Y36 T61	P34-Y36 HydrophobicContact CB-CE1 4.35Å; P34-Y36 HydrophobicContact CG-CE1 4.17Å; P34-Y36 HydrophobicContact CG-CE2 3.86Å; P34-Y36 WeakPolarHBondContact CG-OH 3.02Å; P34-Y36 WeakPolarHBondContact O-CD2 3.32Å; P34-Y36 VanDerWaalsContact O-CE2 3.32Å; P34-Y36 WeakPolarHBondContact O-CE2 3.24Å; P34-Y36 PolarHBondContact O-N 2Å; P34-T61 HydrophobicContact CB-CG2 4.36Å
35	H	76.6	Confident	69.1	Low	140 Å²	140	94.1 Å²	94.1	65%	0.648	54%	0.539	S	S	*	.			trans	-60.5	103.2	172.8	-73.4	-62.6	0	0	0	109.5	G33 E137	G33-H35 PolarHBondContact O-N 2.94Å; H35-E137 VanDerWaalsContact CA-OE1 3.28Å; H35-E137 WeakPolarHBondContact CA-OE1 3.31Å
36	Y	87	Confident	71.5	Confident	34 Å²	34	91.5 Å²	91.5	13%	0.133	53%	0.526	C	S	.	.			trans	-76.9	-31.9	-176	-67.2	-73	0	0	0	112.2	P34 L59 G60 T61 P63 L130 N132 E137	P34-Y36 HydrophobicContact CB-CE1 4.35Å; P34-Y36 HydrophobicContact CG-CE1 4.17Å; P34-Y36 HydrophobicContact CG-CE2 3.86Å; P34-Y36 WeakPolarHBondContact CG-OH 3.02Å; P34-Y36 WeakPolarHBondContact O-CD2 3.32Å; P34-Y36 VanDerWaalsContact O-CE2 3.32Å; P34-Y36 WeakPolarHBondContact O-CE2 3.24Å; P34-Y36 PolarHBondContact O-N 2Å; Y36-L59 CarbonylContact O-C 3.57Å; Y36-L59 WeakPolarHBondContact O-CA 3.36Å; Y36-G60 PolarHBondContact O-N 2.03Å; Y36-T61 HydrophobicContact CD1-CG2 3.46Å; Y36-T61 VanDerWaalsContact CD1-CG2 3.46Å; Y36-T61 HydrophobicContact CE1-CG2 3.79Å; Y36-T61 HydrophobicContact CG-CG2 4.4Å; Y36-P63 HydrophobicContact CD1-CB 4.3Å; Y36-P63 HydrophobicContact CD1-CG 3.46Å; Y36-P63 VanDerWaalsContact CD1-CG 3.46Å; Y36-P63 HydrophobicContact CE1-CB 3.89Å; Y36-P63 HydrophobicContact CE1-CG 3.56Å; Y36-P63 HydrophobicContact CG-CG 4.03Å; Y36-L130 HydrophobicContact CD2-CD2 4.37Å; Y36-L130 HydrophobicContact CG-CD2 4.25Å; Y36-N132 WeakPolarHBondContact CE2-ND2 3.44Å; Y36-E137 WeakPolarHBondContact CA-OE2 3.46Å; Y36-E137 VanDerWaalsContact N-CD 3.27Å; Y36-E137 PolarHBondContact N-OE1 3.46Å; Y36-E137 PolarHBondContact N-OE2 3.02Å
37	L	91.9	Very high	74.5	Confident	11 Å²	11	88.8 Å²	88.8	6%	0.058	50%	0.497	C	S	.	.	B	Isolated β-bridge	trans	-102.1	133	177.7	-65.1	-179.6	0	0	0	111.5	L59 L130 E137 V139	L37-L59 HydrophobicContact CD2-CG 4.32Å; L37-L130 HydrophobicContact CD1-CB 4.08Å; L37-L130 HydrophobicContact CD2-CB 4.12Å; L37-L130 HydrophobicContact CD2-CD1 4.13Å; L37-L130 HydrophobicContact CG-CB 4.09Å; L37-E137 HydrophobicContact CD1-CB 4.02Å; L37-E137 WeakPolarHBondContact CD1-O 3.45Å; L37-E137 HydrophobicContact CG-CB 4.22Å; L37-E137 PolarHBondContact N-OE2 2.99Å; L37-V139 HydrophobicContact CB-CG1 4.07Å; L37-V139 HydrophobicContact CD1-CG1 4.26Å; L37-V139 HydrophobicContact CD1-CG2 4.44Å
38	L	92.5	Very high	77	Confident	85 Å²	85	86.3 Å²	86.3	45%	0.445	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-77.9	140.3	171	-61	-177.5	0	0	0	110.2	V58	L38-V58 HydrophobicContact CB-CB 4.48Å; L38-V58 HydrophobicContact CD1-CB 4.26Å; L38-V58 HydrophobicContact CD1-CG1 3.82Å; L38-V58 PolarHBondContact N-O 3.2Å
39	P	90.4	Very high	79.6	Confident	110 Å²	110	83.3 Å²	83.3	71%	0.714	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-63.1	139.4	172.9	27.1	-33.5	0	0	0	109.9
40	P	90.6	Very high	82.3	Confident	32 Å²	32	82.2 Å²	82.2	21%	0.208	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-69.1	140.4	178.7	29.4	-34.4	0	0	0	110.9	H42 E43 L141	P40-H42 VanDerWaalsContact C-N 3.26Å; P40-H42 PolarHBondContact O-N 3.31Å; P40-E43 HydrophobicContact CG-CG 4.29Å; P40-L141 HydrophobicContact CB-CD2 3.59Å; P40-L141 HydrophobicContact CG-CD2 3.87Å
41	I	90.4	Very high	84.7	Confident	156 Å²	156	78 Å²	78	80%	0.8	42%	0.422	S	S	*	.	S	Bend	trans	-64.3	-36.7	174.2	-59	173.7	0	0	0	110.5
42	H	92.4	Very high	87.3	Confident	127 Å²	127	74.2 Å²	74.2	59%	0.588	41%	0.41	S	S	*	.			trans	-126.9	120.1	177.2	-57.7	-54.6	0	0	0	109.6	P40 V44 I45 L141	P40-H42 VanDerWaalsContact C-N 3.26Å; P40-H42 PolarHBondContact O-N 3.31Å; H42-V44 VanDerWaalsContact C-N 3.33Å; H42-I45 HydrophobicContact CB-CD1 4.27Å; H42-L141 WeakPolarHBondContact O-CD2 3.37Å
43	E	93.1	Very high	89.3	Confident	139 Å²	139	69.4 Å²	69.4	65%	0.65	38%	0.38	S	S	*	.	S	Bend	trans	-77.7	-21.6	176.1	-64.1	-173.2	172.1	0	0	112.7	P40 L141 T142	P40-E43 HydrophobicContact CG-CG 4.29Å; E43-L141 CarbonylContact O-C 3.55Å; E43-L141 WeakPolarHBondContact O-CA 3.44Å; E43-T142 PolarHBondContact O-N 3.04Å
44	V	95.8	Very high	91.3	Very high	65 Å²	65	70.7 Å²	70.7	39%	0.394	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.8	179	-177.9	0	0	0	0	109.1	H42 T142	H42-V44 VanDerWaalsContact C-N 3.33Å; V44-T142 CarbonylContact C-O 3.46Å; V44-T142 WeakPolarHBondContact CA-O 3.32Å
45	I	96.9	Very high	93	Very high	30 Å²	30	67.5 Å²	67.5	15%	0.154	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	114.3	176.4	-53.3	-55.8	0	0	0	107.8	H42 L55 P56 T142 L143 S144	H42-I45 HydrophobicContact CB-CD1 4.27Å; I45-L55 HydrophobicContact CB-CD2 4.01Å; I45-L55 HydrophobicContact CG1-CD2 3.87Å; I45-L55 HydrophobicContact CG2-CD2 4.39Å; I45-P56 HydrophobicContact CD1-CG 4.18Å; I45-T142 PolarHBondContact N-O 2.85Å; I45-L143 HydrophobicContact CG2-CD1 4.43Å; I45-L143 WeakPolarHBondContact O-CA 3.32Å; I45-S144 PolarHBondContact O-N 3.15Å
46	H	95.4	Very high	93.9	Very high	123 Å²	123	62.5 Å²	62.5	57%	0.569	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	139.1	176.8	-64.6	-84.4	0	0	0	110.7	S144	H46-S144 WeakPolarHBondContact CA-O 3.1Å
47	S	95.6	Very high	94.3	Very high	9 Å²	9	61 Å²	61	6%	0.063	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	176.2	178.7	-167.2	0	0	0	0	110.6	S144 L145 E146	S47-S144 PolarHBondContact N-O 2.92Å; S47-L145 WeakPolarHBondContact O-CA 3.24Å; S47-E146 PolarHBondContact O-N 3.43Å
48	H	92.6	Very high	94.4	Very high	92 Å²	92	62.2 Å²	62.2	43%	0.426	35%	0.345	S	S	.	.			trans	-132.4	163.1	173.6	55.8	-88.8	0	0	0	110.6	G50 A51	H48-G50 PolarHBondContact O-N 3.05Å; H48-A51 WeakPolarHBondContact O-CB 2.96Å; H48-A51 PolarHBondContact O-N 3.31Å; H48-A51 VanDerWaalsContact O-N 3.15Å
49	R	94.2	Very high	94.4	Very high	56 Å²	56	58.2 Å²	58.2	21%	0.211	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	135.7	178.2	-173.6	-168.4	-69.7	-178.3	3.7	110.6	A51 V118 L120 D174 T242 S243	R49-A51 PolarHBondContact O-N 3.05Å; R49-V118 CarbonylContact C-O 3.42Å; R49-V118 WeakPolarHBondContact CA-O 3.41Å; R49-L120 VanDerWaalsContact NH2-CG 3.3Å; R49-D174 IonicContact CZ-OD1 2.69Å; R49-D174 IonicContact CZ-OD2 2.73Å; R49-D174 VanDerWaalsContact NH1-CG 3.25Å; R49-D174 IonicContact NH1-OD1 2.79Å; R49-D174 PolarHBondContact NH1-OD1 2.9Å; R49-D174 IonicContact NH1-OD2 2.98Å; R49-D174 PolarHBondContact NH1-OD2 3.25Å; R49-D174 PolarHBondContact NH2-O 2.92Å; R49-D174 VanDerWaalsContact NH2-O 3.14Å; R49-D174 IonicContact NH2-OD1 2.75Å; R49-D174 IonicContact NH2-OD2 3.31Å; R49-D174 PolarHBondContact NH2-OD2 3.22Å; R49-T242 PolarHBondContact NH2-OG1 3.17Å; R49-S243 PolarHBondContact N-OG 3.47Å
50	G	93.8	Very high	94.4	Very high	55 Å²	55	54.8 Å²	54.8	57%	0.567	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	-16	-178.6	0	0	0	0	0	114.7	H48 V118	H48-G50 PolarHBondContact O-N 3.05Å; G50-V118 PolarHBondContact N-O 3.47Å
51	A	94.8	Very high	94.3	Very high	16 Å²	16	56.4 Å²	56.4	13%	0.132	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-68	167.5	179.7	0	0	0	0	0	112.8	H48 R49 G117 V118	H48-A51 WeakPolarHBondContact O-CB 2.96Å; H48-A51 PolarHBondContact O-N 3.31Å; H48-A51 VanDerWaalsContact O-N 3.15Å; R49-A51 PolarHBondContact O-N 3.05Å; A51-G117 PolarHBondContact O-N 2.97Å; A51-G117 VanDerWaalsContact O-N 3.15Å; A51-V118 VanDerWaalsContact O-CG2 3.32Å; A51-V118 WeakPolarHBondContact O-CG2 3.43Å; A51-V118 PolarHBondContact O-N 3.02Å
52	T	97.1	Very high	94.1	Very high	85 Å²	85	51.9 Å²	51.9	52%	0.521	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-99.2	119.4	164.3	-64	0	0	0	0	109	V114 I115	T52-V114 HydrophobicContact CG2-CG1 3.39Å; T52-I115 CarbonylContact C-O 3.58Å; T52-I115 WeakPolarHBondContact CA-O 3.5Å
53	A	97.1	Very high	93.7	Very high	4 Å²	4	46.1 Å²	46.1	3%	0.033	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	143.4	177	0	0	0	0	0	111.1	V114 I115 V118 L143	A53-V114 CarbonylContact O-C 3.56Å; A53-V114 WeakPolarHBondContact O-CA 3.42Å; A53-I115 PolarHBondContact N-O 2.84Å; A53-I115 PolarHBondContact O-N 2.99Å; A53-V118 HydrophobicContact CB-CG2 3.75Å; A53-L143 HydrophobicContact CB-CD1 3.73Å
54	T	97.3	Very high	93.4	Very high	48 Å²	48	46.4 Å²	46.4	29%	0.294	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	120.6	172.4	-61.4	0	0	0	0	109.3	L113 V114	T54-L113 CarbonylContact C-O 3.49Å; T54-L113 WeakPolarHBondContact CA-O 3.36Å; T54-V114 HydrophobicContact CG2-CG2 4.41Å
55	L	97.5	Very high	93	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	110.9	174.1	-57	-179.2	0	0	0	108.6	I45 C57 W70 S112 L113 I115 Y126 L141 L143	I45-L55 HydrophobicContact CB-CD2 4.01Å; I45-L55 HydrophobicContact CG1-CD2 3.87Å; I45-L55 HydrophobicContact CG2-CD2 4.39Å; L55-C57 PolarHBondContact O-N 3.44Å; L55-W70 HydrophobicContact CB-CH2 3.54Å; L55-W70 HydrophobicContact CB-CZ2 4.33Å; L55-W70 HydrophobicContact CB-CZ3 3.9Å; L55-W70 HydrophobicContact CD1-CZ3 4.06Å; L55-W70 WeakPolarHBondContact O-CZ2 3.27Å; L55-S112 CarbonylContact O-C 3.59Å; L55-S112 VanDerWaalsContact O-CA 3.26Å; L55-S112 WeakPolarHBondContact O-CA 3.44Å; L55-S112 VanDerWaalsContact O-CB 3.29Å; L55-S112 WeakPolarHBondContact O-CB 3.48Å; L55-L113 HydrophobicContact CB-CB 4.31Å; L55-L113 HydrophobicContact CD1-CD2 4.29Å; L55-L113 PolarHBondContact N-O 3.02Å; L55-L113 PolarHBondContact O-N 2.94Å; L55-I115 HydrophobicContact CD1-CD1 4.11Å; L55-Y126 HydrophobicContact CD1-CD1 3.62Å; L55-Y126 HydrophobicContact CD1-CD2 3.75Å; L55-Y126 HydrophobicContact CD1-CE1 4.13Å; L55-Y126 HydrophobicContact CD1-CE2 4.29Å; L55-Y126 HydrophobicContact CD1-CG 3.4Å; L55-L141 HydrophobicContact CB-CD1 3.98Å; L55-L143 HydrophobicContact CD2-CB 4.29Å; L55-L143 HydrophobicContact CD2-CD1 4.41Å
56	P	96.2	Very high	92.8	Very high	36 Å²	36	48 Å²	48	23%	0.234	30%	0.297	C	S	.	.			trans	-71.3	129.9	-171.6	27.6	-34.3	0	0	0	111.9	I45 S112 L141	I45-P56 HydrophobicContact CD1-CG 4.18Å; P56-S112 WeakPolarHBondContact CA-OG 3.37Å; P56-L141 HydrophobicContact CG-CD1 4.45Å; P56-L141 HydrophobicContact CG-CD2 4.04Å; P56-L141 WeakPolarHBondContact O-CD1 3.38Å
57	C	95.1	Very high	92.7	Very high	2 Å²	2	48 Å²	48	1%	0.014	30%	0.295	C	S	.	.			trans	-143.8	116.2	167	-176	0	0	0	0	108.1	L55 W70 A111 S112 C128	L55-C57 PolarHBondContact O-N 3.44Å; C57-W70 HydrophobicContact CB-CH2 4.09Å; C57-W70 HydrophobicContact CB-CZ2 3.39Å; C57-A111 HydrophobicContact CB-CB 4.46Å; C57-A111 CarbonylContact O-C 3.52Å; C57-A111 VanDerWaalsContact O-C 3.23Å; C57-A111 VanDerWaalsContact O-CA 3.29Å; C57-A111 WeakPolarHBondContact O-CA 3.5Å; C57-A111 PolarHBondContact O-N 3.41Å; C57-S112 PolarHBondContact N-OG 3.38Å; C57-S112 VanDerWaalsContact N-OG 3.12Å; C57-S112 PolarHBondContact O-N 3.13Å; C57-C128 HydrophobicContact CB-CB 3.62Å; C57-C128 WeakPolarHBondContact CB-SG 3.36Å; C57-C128 WeakPolarHBondContact SG-CB 3.05Å; C57-C128 CovalentContact SG-SG 2.04Å; C57-C128 PolarHBondContact SG-SG 2.95Å
58	V	94.3	Very high	92.7	Very high	37 Å²	37	47.6 Å²	47.6	22%	0.224	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-125.5	131.9	-171.8	-176.9	0	0	0	0	109	L38	L38-V58 HydrophobicContact CB-CB 4.48Å; L38-V58 HydrophobicContact CD1-CB 4.26Å; L38-V58 HydrophobicContact CD1-CG1 3.82Å; L38-V58 PolarHBondContact N-O 3.2Å
59	L	92.4	Very high	92.9	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-81.5	128.1	175.9	-71	75.9	0	0	0	109.1	Y36 L37 Y66 L109 A111 L130	Y36-L59 CarbonylContact O-C 3.57Å; Y36-L59 WeakPolarHBondContact O-CA 3.36Å; L37-L59 HydrophobicContact CD2-CG 4.32Å; L59-Y66 HydrophobicContact CD2-CD2 4.14Å; L59-Y66 HydrophobicContact CD2-CE2 3.63Å; L59-L109 HydrophobicContact CB-CB 4.25Å; L59-L109 HydrophobicContact CB-CD2 4.16Å; L59-L109 WeakPolarHBondContact CD1-O 3.24Å; L59-L109 PolarHBondContact N-O 2.97Å; L59-L109 WeakPolarHBondContact O-CB 3.5Å; L59-L109 WeakPolarHBondContact O-CD1 3.37Å; L59-A111 HydrophobicContact CD1-CB 3.46Å; L59-A111 VanDerWaalsContact CD1-CB 3.46Å; L59-L130 HydrophobicContact CD2-CD1 3.73Å; L59-L130 HydrophobicContact CG-CD1 4Å
60	G	90.6	Very high	93	Very high	38 Å²	38	44.2 Å²	44.2	39%	0.392	28%	0.276	S	S	.	.	S	Bend	trans	-74.7	-35.9	170.7	0	0	0	0	0	111.7	Y36	Y36-G60 PolarHBondContact O-N 2.03Å
61	T	87.1	Confident	93.2	Very high	65 Å²	65	41.6 Å²	41.6	40%	0.399	25%	0.249	S	C	.	.	S	Bend	trans	-145.7	152.2	172.1	-174	0	0	0	0	110	P34 Y36 P63	P34-T61 HydrophobicContact CB-CG2 4.36Å; Y36-T61 HydrophobicContact CD1-CG2 3.46Å; Y36-T61 VanDerWaalsContact CD1-CG2 3.46Å; Y36-T61 HydrophobicContact CE1-CG2 3.79Å; Y36-T61 HydrophobicContact CG-CG2 4.4Å; T61-P63 WeakPolarHBondContact O-CD 3.07Å
62	T	86.1	Confident	93.2	Very high	62 Å²	62	41.9 Å²	41.9	38%	0.38	25%	0.247	S	C	.	.			trans	-97.9	116.2	-177.4	-50	0	0	0	0	109.9	Y66 L109	T62-Y66 HydrophobicContact CG2-CD1 3.94Å; T62-Y66 HydrophobicContact CG2-CE1 3.29Å; T62-L109 WeakPolarHBondContact OG1-CD2 3.47Å
63	P	86	Confident	92.8	Very high	6 Å²	6	39.1 Å²	39.1	4%	0.039	23%	0.23	C	C	.	.			trans	-63.5	154.4	171.3	-8.5	18.2	0	0	0	111.5	Y36 T61 S65 Y66 L130 N132	Y36-P63 HydrophobicContact CD1-CB 4.3Å; Y36-P63 HydrophobicContact CD1-CG 3.46Å; Y36-P63 VanDerWaalsContact CD1-CG 3.46Å; Y36-P63 HydrophobicContact CE1-CB 3.89Å; Y36-P63 HydrophobicContact CE1-CG 3.56Å; Y36-P63 HydrophobicContact CG-CG 4.03Å; T61-P63 WeakPolarHBondContact O-CD 3.07Å; P63-S65 PolarHBondContact O-N 3.04Å; P63-Y66 HydrophobicContact CG-CD1 4.42Å; P63-Y66 HydrophobicContact CG-CG 4.23Å; P63-Y66 WeakPolarHBondContact O-CD1 3.41Å; P63-L130 HydrophobicContact CG-CD1 4.28Å; P63-L130 HydrophobicContact CG-CD2 3.96Å; P63-N132 HydrophobicContact CB-CB 4.03Å; P63-N132 HydrophobicContact CG-CB 4.17Å
64	P	84.9	Confident	92	Very high	145 Å²	145	41.8 Å²	41.8	94%	0.942	24%	0.242	S	C	*	.	S	Bend	trans	-57.6	-35.3	178.8	-25.6	34.2	0	0	0	114.1
65	S	88.6	Confident	90.6	Very high	93 Å²	93	43.8 Å²	43.8	65%	0.65	26%	0.256	S	S	*	.	S	Bend	trans	-139.6	125.9	173.7	180	0	0	0	0	108.1	P63 N132	P63-S65 PolarHBondContact O-N 3.04Å; S65-N132 WeakPolarHBondContact O-CB 3.3Å
66	Y	91.7	Very high	88.7	Confident	35 Å²	35	48.1 Å²	48.1	14%	0.137	30%	0.3	C	S	.	.			trans	-152.7	160.9	179.7	72.8	-78.2	0	0	0	111.7	L59 T62 P63 V68 L130 I131	L59-Y66 HydrophobicContact CD2-CD2 4.14Å; L59-Y66 HydrophobicContact CD2-CE2 3.63Å; T62-Y66 HydrophobicContact CG2-CD1 3.94Å; T62-Y66 HydrophobicContact CG2-CE1 3.29Å; P63-Y66 HydrophobicContact CG-CD1 4.42Å; P63-Y66 HydrophobicContact CG-CG 4.23Å; P63-Y66 WeakPolarHBondContact O-CD1 3.41Å; Y66-V68 HydrophobicContact CD2-CG2 3.95Å; Y66-V68 HydrophobicContact CE2-CG2 3.88Å; Y66-L130 HydrophobicContact CD2-CD1 4.14Å; Y66-L130 HydrophobicContact CD2-CG 4.42Å; Y66-I131 CarbonylContact C-O 3.52Å; Y66-I131 VanDerWaalsContact CA-O 3.3Å; Y66-I131 WeakPolarHBondContact CA-O 3.46Å
67	K	94.4	Very high	86.8	Confident	123 Å²	123	52 Å²	52	54%	0.535	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	142.1	165.5	-64.6	177.2	-174.7	171.5	0	108.5	V85 T86 L130 I131	K67-V85 HydrophobicContact CB-CG1 4.41Å; K67-T86 CarbonylContact C-O 3.54Å; K67-T86 VanDerWaalsContact CA-O 3.25Å; K67-T86 WeakPolarHBondContact CA-O 3.3Å; K67-L130 WeakPolarHBondContact O-CA 3.46Å; K67-I131 PolarHBondContact N-O 3.13Å; K67-I131 PolarHBondContact O-N 2.92Å
68	V	95.4	Very high	85.5	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.006	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	129.1	166.6	177.4	0	0	0	0	108.6	Y66 V85 T86 A111 C128 E129	Y66-V68 HydrophobicContact CD2-CG2 3.95Å; Y66-V68 HydrophobicContact CE2-CG2 3.88Å; V68-V85 CarbonylContact O-C 3.51Å; V68-V85 WeakPolarHBondContact O-CA 3.33Å; V68-T86 HydrophobicContact CB-CG2 3.77Å; V68-T86 PolarHBondContact N-O 2.78Å; V68-T86 PolarHBondContact O-N 3.21Å; V68-A111 HydrophobicContact CB-CB 4.4Å; V68-A111 HydrophobicContact CG1-CB 4.11Å; V68-A111 HydrophobicContact CG2-CB 4.01Å; V68-C128 WeakPolarHBondContact CG1-SG 3.46Å; V68-E129 CarbonylContact C-O 3.53Å; V68-E129 VanDerWaalsContact CA-O 3.32Å; V68-E129 WeakPolarHBondContact CA-O 3.26Å
69	R	96.2	Very high	84.9	Confident	77 Å²	77	67.2 Å²	67.2	29%	0.291	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	127.2	177	171.2	175.7	173.6	176.1	1.6	109.2	L82 C128 E129 I131	R69-L82 HydrophobicContact CG-CD1 3.57Å; R69-C128 WeakPolarHBondContact O-CA 3.39Å; R69-E129 HydrophobicContact CB-CB 4.35Å; R69-E129 WeakPolarHBondContact CD-OE2 3.49Å; R69-E129 PolarHBondContact N-O 3.28Å; R69-E129 PolarHBondContact O-N 3.09Å; R69-I131 HydrophobicContact CB-CD1 4.33Å
70	W	97.5	Very high	84.7	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.5	167.9	-83	98.9	0	0	0	110.7	L55 C57 I83 L84 A111 L113 R127 C128 L141	L55-W70 HydrophobicContact CB-CH2 3.54Å; L55-W70 HydrophobicContact CB-CZ2 4.33Å; L55-W70 HydrophobicContact CB-CZ3 3.9Å; L55-W70 HydrophobicContact CD1-CZ3 4.06Å; L55-W70 WeakPolarHBondContact O-CZ2 3.27Å; C57-W70 HydrophobicContact CB-CH2 4.09Å; C57-W70 HydrophobicContact CB-CZ2 3.39Å; W70-I83 HydrophobicContact CB-CB 4.42Å; W70-I83 PolarHBondContact O-N 2.79Å; W70-L84 HydrophobicContact CB-CB 4.33Å; W70-L84 PolarHBondContact N-O 3.08Å; W70-L84 PolarHBondContact O-N 3.25Å; W70-A111 PolarHBondContact NE1-O 3.15Å; W70-L113 HydrophobicContact CB-CD1 4.2Å; W70-L113 HydrophobicContact CB-CD2 4.13Å; W70-L113 HydrophobicContact CD2-CB 3.69Å; W70-L113 HydrophobicContact CD2-CD2 3.98Å; W70-L113 HydrophobicContact CD2-CG 4.28Å; W70-L113 HydrophobicContact CE3-CB 4.16Å; W70-L113 HydrophobicContact CE3-CD2 4Å; W70-L113 HydrophobicContact CG-CB 4.03Å; W70-L113 HydrophobicContact CG-CD1 3.99Å; W70-L113 HydrophobicContact CG-CD2 4.06Å; W70-L113 HydrophobicContact CG-CG 4.26Å; W70-L113 HydrophobicContact CH2-CB 4.22Å; W70-L113 HydrophobicContact CZ2-CB 3.76Å; W70-L113 HydrophobicContact CZ3-CB 4.41Å; W70-R127 WeakPolarHBondContact CA-O 3.44Å; W70-R127 VanDerWaalsContact CE3-O 3.27Å; W70-C128 HydrophobicContact CD2-CB 4.04Å; W70-C128 HydrophobicContact CE3-CB 4.13Å; W70-C128 HydrophobicContact CH2-CB 3.76Å; W70-C128 HydrophobicContact CZ2-CB 3.64Å; W70-C128 HydrophobicContact CZ3-CB 3.99Å; W70-L141 HydrophobicContact CH2-CD1 3.59Å; W70-L141 HydrophobicContact CZ3-CD1 4.06Å
71	S	96.1	Very high	84.8	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	156	175.4	59.1	0	0	0	0	111.6	E80 T81 Y126 R127	S71-E80 WeakPolarHBondContact CB-OE2 3.47Å; S71-E80 PolarHBondContact OG-OE2 3.19Å; S71-T81 CarbonylContact C-O 3.43Å; S71-T81 VanDerWaalsContact CA-O 3.27Å; S71-T81 WeakPolarHBondContact CA-O 3.41Å; S71-Y126 CarbonylContact O-C 3.59Å; S71-Y126 VanDerWaalsContact O-CA 3.3Å; S71-Y126 WeakPolarHBondContact O-CA 3.4Å; S71-R127 PolarHBondContact N-O 3.41Å; S71-R127 PolarHBondContact O-N 3.39Å
72	K	95	Very high	85.2	Confident	21 Å²	21	69 Å²	69	9%	0.091	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	130.9	166.3	-162.1	-180	-175.3	-166.2	0	108.6	E80 T81 I83 L97 E121 D122 E123 Y126	K72-E80 CarbonylContact O-C 3.54Å; K72-E80 VanDerWaalsContact O-CA 3.28Å; K72-E80 WeakPolarHBondContact O-CA 3.41Å; K72-T81 PolarHBondContact N-O 2.96Å; K72-T81 PolarHBondContact O-N 3.22Å; K72-I83 HydrophobicContact CB-CD1 4.08Å; K72-L97 HydrophobicContact CD-CD1 4.26Å; K72-E121 PolarHBondContact NZ-O 2.83Å; K72-D122 WeakPolarHBondContact CE-O 3.36Å; K72-D122 PolarHBondContact NZ-O 3.43Å; K72-E123 WeakPolarHBondContact CE-O 3.5Å; K72-E123 PolarHBondContact NZ-O 3.04Å; K72-Y126 HydrophobicContact CB-CD1 4.31Å; K72-Y126 HydrophobicContact CB-CE1 4.16Å; K72-Y126 HydrophobicContact CD-CE1 4.31Å; K72-Y126 HydrophobicContact CD-CE2 4.48Å; K72-Y126 HydrophobicContact CG-CD1 4.31Å; K72-Y126 HydrophobicContact CG-CE1 4.02Å; K72-Y126 HydrophobicContact CG-CE2 4.3Å
73	V	89.8	Confident	85.7	Confident	27 Å²	27	66 Å²	66	16%	0.164	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	123.1	176	-173	0	0	0	0	108.2	E80 R125 R127	V73-E80 HydrophobicContact CG2-CG 4.29Å; V73-R125 HydrophobicContact CB-CB 4.25Å; V73-R125 HydrophobicContact CG2-CG 4.44Å; V73-R125 PolarHBondContact N-O 2.88Å; V73-R127 HydrophobicContact CG2-CB 4.48Å
74	E	79.8	Confident	86.3	Confident	61 Å²	61	65.9 Å²	65.9	29%	0.285	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-76.2	136.8	-179	-62.9	-58.3	157.2	0	0	111.1	G76 E77 R79 T81	E74-G76 PolarHBondContact O-N 3.48Å; E74-E77 HydrophobicContact CB-CB 4.35Å; E74-E77 PolarHBondContact O-N 3.45Å; E74-R79 PolarHBondContact N-O 3.3Å; E74-T81 WeakPolarHBondContact OE1-CB 3.46Å; E74-T81 PolarHBondContact OE1-OG1 2.9Å
75	P	67.1	Low	86.9	Confident	90 Å²	90	60.6 Å²	60.6	58%	0.584	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	119.8	178.4	-20.7	32	0	0	0	112.2	E77	P75-E77 VanDerWaalsContact C-N 3.3Å; P75-E77 PolarHBondContact O-N 2.85Å
76	G	58.7	Low	87.2	Confident	91 Å²	91	56.6 Å²	56.6	94%	0.938	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	1.1	174	0	0	0	0	0	115.8	E74	E74-G76 PolarHBondContact O-N 3.48Å
77	E	57.2	Low	87.1	Confident	117 Å²	117	58.5 Å²	58.5	55%	0.547	31%	0.31	S	S	.	.	S	Bend	trans	-117.9	145.7	170.5	-66	-176.7	-163.7	0	0	109.5	E74 P75 R79	E74-E77 HydrophobicContact CB-CB 4.35Å; E74-E77 PolarHBondContact O-N 3.45Å; P75-E77 VanDerWaalsContact C-N 3.3Å; P75-E77 PolarHBondContact O-N 2.85Å; E77-R79 HydrophobicContact CB-CB 3.97Å; E77-R79 PolarHBondContact O-N 2.8Å
78	L	65.9	Low	86.5	Confident	193 Å²	193	54.9 Å²	54.9	100%	1.01	31%	0.307	S	S	*	.	S	Bend	trans	-73	19.9	169.1	-69.1	169.6	0	0	0	112.1
79	R	81.7	Confident	85.9	Confident	166 Å²	166	62.1 Å²	62.1	63%	0.626	35%	0.345	S	S	*	.			trans	-99.3	137.5	-171.8	-170.5	175.7	172.9	176.9	-1.8	109.8	E74 E77	E74-R79 PolarHBondContact N-O 3.3Å; E77-R79 HydrophobicContact CB-CB 3.97Å; E77-R79 PolarHBondContact O-N 2.8Å
80	E	89.6	Confident	85.6	Confident	51 Å²	51	65.1 Å²	65.1	24%	0.238	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128.6	176.2	-61.1	-166.1	172.2	0	0	110.5	S71 K72 V73 R127	S71-E80 WeakPolarHBondContact CB-OE2 3.47Å; S71-E80 PolarHBondContact OG-OE2 3.19Å; K72-E80 CarbonylContact O-C 3.54Å; K72-E80 VanDerWaalsContact O-CA 3.28Å; K72-E80 WeakPolarHBondContact O-CA 3.41Å; V73-E80 HydrophobicContact CG2-CG 4.29Å; E80-R127 IonicContact OE1-CZ 3.3Å; E80-R127 IonicContact OE1-NE 2.78Å; E80-R127 PolarHBondContact OE1-NE 3.19Å; E80-R127 IonicContact OE1-NH2 2.87Å; E80-R127 PolarHBondContact OE1-NH2 3.42Å; E80-R127 VanDerWaalsContact OE1-NH2 3.12Å; E80-R127 IonicContact OE2-NE 3.91Å
81	T	92.8	Very high	85.4	Confident	41 Å²	41	67.8 Å²	67.8	25%	0.252	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	116.2	175.4	-62.8	0	0	0	0	108.8	S71 K72 E74	S71-T81 CarbonylContact C-O 3.43Å; S71-T81 VanDerWaalsContact CA-O 3.27Å; S71-T81 WeakPolarHBondContact CA-O 3.41Å; K72-T81 PolarHBondContact N-O 2.96Å; K72-T81 PolarHBondContact O-N 3.22Å; E74-T81 WeakPolarHBondContact OE1-CB 3.46Å; E74-T81 PolarHBondContact OE1-OG1 2.9Å
82	L	95.4	Very high	85.4	Confident	48 Å²	48	76 Å²	76	25%	0.251	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	132.8	179.5	-176.1	66.5	0	0	0	111.3	R69 V85 Y94	R69-L82 HydrophobicContact CG-CD1 3.57Å; L82-V85 HydrophobicContact CD1-CG2 3.77Å; L82-V85 HydrophobicContact CD2-CG2 4.09Å; L82-V85 HydrophobicContact CG-CG2 4.38Å; L82-Y94 HydrophobicContact CD2-CD1 3.85Å; L82-Y94 HydrophobicContact CD2-CD2 3.61Å; L82-Y94 HydrophobicContact CD2-CE1 4.17Å; L82-Y94 HydrophobicContact CD2-CE2 3.97Å; L82-Y94 HydrophobicContact CD2-CG 3.54Å; L82-Y94 HydrophobicContact CG-CD2 3.87Å; L82-Y94 HydrophobicContact CG-CG 3.91Å; L82-Y94 CarbonylContact O-C 3.54Å; L82-Y94 WeakPolarHBondContact O-CB 3.28Å
83	I	97.2	Very high	85.5	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-48.2	-179.8	-57.1	161.4	0	0	0	111.2	W70 K72 G93 Y94 L97 A101 L113 Y126	W70-I83 HydrophobicContact CB-CB 4.42Å; W70-I83 PolarHBondContact O-N 2.79Å; K72-I83 HydrophobicContact CB-CD1 4.08Å; I83-G93 CarbonylContact O-C 3.56Å; I83-G93 WeakPolarHBondContact O-CA 3.21Å; I83-Y94 PolarHBondContact O-N 2.85Å; I83-L97 HydrophobicContact CD1-CD1 4.15Å; I83-L97 HydrophobicContact CG1-CB 4.22Å; I83-L97 HydrophobicContact CG1-CD1 4.16Å; I83-L97 HydrophobicContact CG2-CB 3.83Å; I83-A101 HydrophobicContact CG2-CB 3.51Å; I83-L113 HydrophobicContact CD1-CD2 4.16Å; I83-L113 HydrophobicContact CG2-CD1 4.49Å; I83-L113 HydrophobicContact CG2-CD2 4.18Å; I83-Y126 HydrophobicContact CD1-CD1 3.47Å; I83-Y126 VanDerWaalsContact CD1-CD1 3.47Å; I83-Y126 HydrophobicContact CD1-CE1 3.44Å; I83-Y126 VanDerWaalsContact CD1-CE1 3.44Å
84	L	97.5	Very high	85.8	Confident	3 Å²	3	79.1 Å²	79.1	2%	0.016	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	141.4	-172.9	-174.3	150.8	0	0	0	110.7	W70 T86 A91 R92 M103 L113	W70-L84 HydrophobicContact CB-CB 4.33Å; W70-L84 PolarHBondContact N-O 3.08Å; W70-L84 PolarHBondContact O-N 3.25Å; L84-T86 HydrophobicContact CD2-CG2 4.22Å; L84-A91 HydrophobicContact CD1-CB 4.29Å; L84-A91 HydrophobicContact CD2-CB 4.13Å; L84-A91 HydrophobicContact CG-CB 4.38Å; L84-R92 CarbonylContact C-O 3.49Å; L84-R92 VanDerWaalsContact CA-O 3.27Å; L84-R92 WeakPolarHBondContact CA-O 3.48Å; L84-M103 HydrophobicContact CD1-CG 4.38Å; L84-M103 HydrophobicContact CD1-SD 4.19Å; L84-M103 HydrophobicContact CD2-CG 4.04Å; L84-M103 HydrophobicContact CD2-SD 3.3Å; L84-M103 WeakPolarHBondContact CD2-SD 3.19Å; L84-M103 HydrophobicContact CG-SD 4.41Å; L84-L113 HydrophobicContact CB-CD1 4.1Å; L84-L113 HydrophobicContact CD1-CD1 4.05Å
85	V	97	Very high	86.4	Confident	34 Å²	34	78.7 Å²	78.7	21%	0.206	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135.7	168	-176.8	0	0	0	0	109.2	K67 V68 L82 A91 R92 Y94	K67-V85 HydrophobicContact CB-CG1 4.41Å; V68-V85 CarbonylContact O-C 3.51Å; V68-V85 WeakPolarHBondContact O-CA 3.33Å; L82-V85 HydrophobicContact CD1-CG2 3.77Å; L82-V85 HydrophobicContact CD2-CG2 4.09Å; L82-V85 HydrophobicContact CG-CG2 4.38Å; V85-A91 CarbonylContact O-C 3.39Å; V85-A91 WeakPolarHBondContact O-CA 3.32Å; V85-R92 PolarHBondContact N-O 3.16Å; V85-R92 PolarHBondContact O-N 3.14Å; V85-Y94 HydrophobicContact CB-CE2 4.01Å; V85-Y94 HydrophobicContact CG2-CD2 4.36Å; V85-Y94 HydrophobicContact CG2-CE2 3.8Å
86	T	94.4	Very high	87.5	Confident	9 Å²	9	80 Å²	80	6%	0.055	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	149.8	176.9	-178.9	0	0	0	0	111.8	K67 V68 L84 G88 H90 M103	K67-T86 CarbonylContact C-O 3.54Å; K67-T86 VanDerWaalsContact CA-O 3.25Å; K67-T86 WeakPolarHBondContact CA-O 3.3Å; V68-T86 HydrophobicContact CB-CG2 3.77Å; V68-T86 PolarHBondContact N-O 2.78Å; V68-T86 PolarHBondContact O-N 3.21Å; L84-T86 HydrophobicContact CD2-CG2 4.22Å; T86-G88 PolarHBondContact OG1-N 3.35Å; T86-H90 WeakPolarHBondContact CA-O 3.25Å; T86-H90 PolarHBondContact OG1-O 3.4Å; T86-H90 VanDerWaalsContact OG1-O 3.06Å; T86-M103 HydrophobicContact CG2-CE 3.8Å; T86-M103 HydrophobicContact CG2-CG 4.3Å; T86-M103 HydrophobicContact CG2-SD 3.76Å
87	N	90.1	Very high	89.2	Confident	76 Å²	76	76.3 Å²	76.3	41%	0.406	41%	0.414	S	S	.	.			trans	-107.9	16.7	169.1	69.8	-8.8	0	0	0	112.4	L89 H90	N87-L89 VanDerWaalsContact C-N 3.3Å; N87-L89 PolarHBondContact O-N 2.92Å; N87-L89 PolarHBondContact OD1-N 3.12Å; N87-L89 VanDerWaalsContact OD1-N 3.1Å; N87-H90 PolarHBondContact N-O 3.21Å; N87-H90 PolarHBondContact OD1-N 2.98Å; N87-H90 PolarHBondContact OD1-O 3.47Å
88	G	81.7	Confident	91	Very high	47 Å²	47	71.2 Å²	71.2	49%	0.485	39%	0.394	S	S	.	.	S	Bend	trans	89.7	-26.5	-175.8	0	0	0	0	0	114.5	T86	T86-G88 PolarHBondContact OG1-N 3.35Å
89	L	83.6	Confident	92.4	Very high	153 Å²	153	65.9 Å²	65.9	80%	0.801	39%	0.385	S	S	*	.	S	Bend	trans	-104.3	-43.4	178	-64.7	173.5	0	0	0	112.3	N87	N87-L89 VanDerWaalsContact C-N 3.3Å; N87-L89 PolarHBondContact O-N 2.92Å; N87-L89 PolarHBondContact OD1-N 3.12Å; N87-L89 VanDerWaalsContact OD1-N 3.1Å
90	H	88.8	Confident	93.1	Very high	139 Å²	139	60.1 Å²	60.1	64%	0.644	36%	0.364	S	S	*	.			trans	-122.6	139.3	-178.2	-57.9	-67.3	0	0	0	109.7	T86 N87	T86-H90 WeakPolarHBondContact CA-O 3.25Å; T86-H90 PolarHBondContact OG1-O 3.4Å; T86-H90 VanDerWaalsContact OG1-O 3.06Å; N87-H90 PolarHBondContact N-O 3.21Å; N87-H90 PolarHBondContact OD1-N 2.98Å; N87-H90 PolarHBondContact OD1-O 3.47Å
91	A	93.9	Very high	93.5	Very high	57 Å²	57	58.2 Å²	58.2	47%	0.471	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	138.8	175.2	0	0	0	0	0	109.8	L84 V85 M103	L84-A91 HydrophobicContact CD1-CB 4.29Å; L84-A91 HydrophobicContact CD2-CB 4.13Å; L84-A91 HydrophobicContact CG-CB 4.38Å; V85-A91 CarbonylContact O-C 3.39Å; V85-A91 WeakPolarHBondContact O-CA 3.32Å; A91-M103 HydrophobicContact CB-CG 3.74Å
92	R	96.4	Very high	93.6	Very high	172 Å²	172	62.6 Å²	62.6	65%	0.649	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.7	126.4	175.9	-177.5	169	176.2	-173.9	4.9	109.8	L84 V85 Y94	L84-R92 CarbonylContact C-O 3.49Å; L84-R92 VanDerWaalsContact CA-O 3.27Å; L84-R92 WeakPolarHBondContact CA-O 3.48Å; V85-R92 PolarHBondContact N-O 3.16Å; V85-R92 PolarHBondContact O-N 3.14Å; R92-Y94 HydrophobicContact CB-CE2 3.93Å; R92-Y94 WeakPolarHBondContact CD-OH 3.36Å; R92-Y94 HydrophobicContact CG-CE1 4.41Å; R92-Y94 HydrophobicContact CG-CE2 3.79Å; R92-Y94 VanDerWaalsContact O-CD2 3.24Å; R92-Y94 WeakPolarHBondContact O-CD2 3.34Å; R92-Y94 WeakPolarHBondContact O-CE2 3.44Å
93	G	96.5	Very high	93.6	Very high	36 Å²	36	61.9 Å²	61.9	37%	0.371	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	150.3	174.7	0	0	0	0	0	112.6	I83	I83-G93 CarbonylContact O-C 3.56Å; I83-G93 WeakPolarHBondContact O-CA 3.21Å
94	Y	95.9	Very high	93.5	Very high	77 Å²	77	66.8 Å²	66.8	30%	0.302	38%	0.383	S	S	.	.			trans	-140.7	156.9	-178.1	-61.6	-92.3	0	0	0	110.9	L82 I83 V85 R92 G98	L82-Y94 HydrophobicContact CD2-CD1 3.85Å; L82-Y94 HydrophobicContact CD2-CD2 3.61Å; L82-Y94 HydrophobicContact CD2-CE1 4.17Å; L82-Y94 HydrophobicContact CD2-CE2 3.97Å; L82-Y94 HydrophobicContact CD2-CG 3.54Å; L82-Y94 HydrophobicContact CG-CD2 3.87Å; L82-Y94 HydrophobicContact CG-CG 3.91Å; L82-Y94 CarbonylContact O-C 3.54Å; L82-Y94 WeakPolarHBondContact O-CB 3.28Å; I83-Y94 PolarHBondContact O-N 2.85Å; V85-Y94 HydrophobicContact CB-CE2 4.01Å; V85-Y94 HydrophobicContact CG2-CD2 4.36Å; V85-Y94 HydrophobicContact CG2-CE2 3.8Å; R92-Y94 HydrophobicContact CB-CE2 3.93Å; R92-Y94 WeakPolarHBondContact CD-OH 3.36Å; R92-Y94 HydrophobicContact CG-CE1 4.41Å; R92-Y94 HydrophobicContact CG-CE2 3.79Å; R92-Y94 VanDerWaalsContact O-CD2 3.24Å; R92-Y94 WeakPolarHBondContact O-CD2 3.34Å; R92-Y94 WeakPolarHBondContact O-CE2 3.44Å; Y94-G98 WeakPolarHBondContact O-CA 3.41Å; Y94-G98 PolarHBondContact O-N 2.85Å
95	G	92.7	Very high	93	Very high	53 Å²	53	78.2 Å²	78.2	55%	0.546	43%	0.426	S	S	.	.	H	α-helix	trans	62.7	-169.3	175.5	0	0	0	0	0	114.4	L97 G98	G95-L97 VanDerWaalsContact C-N 3.27Å; G95-L97 PolarHBondContact O-N 2.74Å; G95-G98 PolarHBondContact O-N 2.88Å
96	P	90.6	Very high	92.4	Very high	116 Å²	116	79.1 Å²	79.1	75%	0.753	44%	0.442	S	S	*	.	H	α-helix	trans	-64.1	-28.8	-176.4	-23.4	34.4	0	0	0	114.2
97	L	94.3	Very high	92.2	Very high	14 Å²	14	83.7 Å²	83.7	7%	0.073	46%	0.463	C	S	.	.	H	α-helix	trans	-83.2	-23.4	179.3	-88.4	160.1	0	0	0	113	K72 I83 G95 G99 R100 A101 I115 D122 Y126	K72-L97 HydrophobicContact CD-CD1 4.26Å; I83-L97 HydrophobicContact CD1-CD1 4.15Å; I83-L97 HydrophobicContact CG1-CB 4.22Å; I83-L97 HydrophobicContact CG1-CD1 4.16Å; I83-L97 HydrophobicContact CG2-CB 3.83Å; G95-L97 VanDerWaalsContact C-N 3.27Å; G95-L97 PolarHBondContact O-N 2.74Å; L97-G99 VanDerWaalsContact C-N 3.27Å; L97-G99 PolarHBondContact O-N 2.89Å; L97-G99 VanDerWaalsContact O-N 3.14Å; L97-R100 CarbonylContact O-C 3.54Å; L97-R100 PolarHBondContact O-N 3.38Å; L97-A101 VanDerWaalsContact O-CB 3.29Å; L97-A101 WeakPolarHBondContact O-CB 3.47Å; L97-A101 PolarHBondContact O-N 2.99Å; L97-I115 HydrophobicContact CD2-CD1 4.37Å; L97-I115 HydrophobicContact CD2-CG2 3.88Å; L97-D122 WeakPolarHBondContact CD2-OD1 3.39Å; L97-Y126 HydrophobicContact CD1-CE1 4.1Å
98	G	94.6	Very high	92.1	Very high	11 Å²	11	90.9 Å²	90.9	11%	0.113	48%	0.484	C	S	.	.	H	α-helix	trans	-56.7	-34.6	-171.2	0	0	0	0	0	114.7	Y94 G95 R100	Y94-G98 WeakPolarHBondContact O-CA 3.41Å; Y94-G98 PolarHBondContact O-N 2.85Å; G95-G98 PolarHBondContact O-N 2.88Å; G98-R100 VanDerWaalsContact C-N 3.29Å; G98-R100 PolarHBondContact O-N 2.73Å
99	G	95.6	Very high	92.6	Very high	81 Å²	81	90.6 Å²	90.6	84%	0.835	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-17.3	177.8	0	0	0	0	0	114.7	L97	L97-G99 VanDerWaalsContact C-N 3.27Å; L97-G99 PolarHBondContact O-N 2.89Å; L97-G99 VanDerWaalsContact O-N 3.14Å
100	R	96.8	Very high	93	Very high	45 Å²	45	84 Å²	84	17%	0.17	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-5.2	178.2	-64	-175.2	-64.9	115.4	-4.5	112.8	L97 G98 A116 G117 D122	L97-R100 CarbonylContact O-C 3.54Å; L97-R100 PolarHBondContact O-N 3.38Å; G98-R100 VanDerWaalsContact C-N 3.29Å; G98-R100 PolarHBondContact O-N 2.73Å; R100-A116 PolarHBondContact NH1-O 3.26Å; R100-A116 VanDerWaalsContact NH1-O 3.11Å; R100-A116 PolarHBondContact O-N 2.92Å; R100-G117 PolarHBondContact NH1-O 3.47Å; R100-D122 IonicContact CZ-OD1 3.87Å; R100-D122 IonicContact CZ-OD2 3.84Å; R100-D122 VanDerWaalsContact CZ-OD2 3.31Å; R100-D122 IonicContact NH1-OD1 2.98Å; R100-D122 IonicContact NH1-OD2 3.45Å; R100-D122 PolarHBondContact NH1-OD2 2.79Å; R100-D122 VanDerWaalsContact NH2-CG 3.3Å; R100-D122 IonicContact NH2-OD1 2.85Å; R100-D122 PolarHBondContact NH2-OD1 3.02Å; R100-D122 IonicContact NH2-OD2 3.79Å; R100-D122 PolarHBondContact NH2-OD2 3.32Å
101	A	97.2	Very high	93.3	Very high	11 Å²	11	77.6 Å²	77.6	9%	0.091	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	137.4	-176.1	0	0	0	0	0	111	I83 L97 L113 V114	I83-A101 HydrophobicContact CG2-CB 3.51Å; L97-A101 VanDerWaalsContact O-CB 3.29Å; L97-A101 WeakPolarHBondContact O-CB 3.47Å; L97-A101 PolarHBondContact O-N 2.99Å; A101-L113 HydrophobicContact CB-CD1 4.05Å; A101-V114 CarbonylContact C-O 3.5Å; A101-V114 VanDerWaalsContact CA-O 3.31Å; A101-V114 WeakPolarHBondContact CA-O 3.34Å
102	R	96.1	Very high	93.4	Very high	133 Å²	133	74.9 Å²	74.9	50%	0.502	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	160.3	176	62.8	-177.5	177.6	82.7	-3.8	111.1	V114	R102-V114 HydrophobicContact CG-CB 3.99Å; R102-V114 HydrophobicContact CG-CG1 4.49Å; R102-V114 PolarHBondContact N-O 2.79Å; R102-V114 PolarHBondContact O-N 3.14Å
103	M	95.6	Very high	93.5	Very high	33 Å²	33	66.7 Å²	66.7	16%	0.163	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	140.7	170	-60	-54.7	-62	0	0	110.7	L84 T86 A91 A111	L84-M103 HydrophobicContact CD1-CG 4.38Å; L84-M103 HydrophobicContact CD1-SD 4.19Å; L84-M103 HydrophobicContact CD2-CG 4.04Å; L84-M103 HydrophobicContact CD2-SD 3.3Å; L84-M103 WeakPolarHBondContact CD2-SD 3.19Å; L84-M103 HydrophobicContact CG-SD 4.41Å; T86-M103 HydrophobicContact CG2-CE 3.8Å; T86-M103 HydrophobicContact CG2-CG 4.3Å; T86-M103 HydrophobicContact CG2-SD 3.76Å; A91-M103 HydrophobicContact CB-CG 3.74Å; M103-A111 HydrophobicContact CE-CB 3.93Å; M103-A111 WeakPolarHBondContact CE-O 3.38Å
104	R	94.8	Very high	93.5	Very high	103 Å²	103	65.1 Å²	65.1	39%	0.389	34%	0.338	S	S	.	.			trans	-67.8	135.7	169	-164.1	170.4	76.9	171.4	3.6	109.3	G106 D110 S112 V114	R104-G106 PolarHBondContact O-N 2.78Å; R104-D110 IonicContact CZ-OD2 3.87Å; R104-D110 IonicContact NE-OD1 2.74Å; R104-D110 IonicContact NE-OD2 3.46Å; R104-D110 PolarHBondContact NE-OD2 2.92Å; R104-D110 IonicContact NH2-OD1 3.74Å; R104-D110 IonicContact NH2-OD2 2.78Å; R104-D110 PolarHBondContact NH2-OD2 3.46Å; R104-S112 PolarHBondContact N-O 3.37Å; R104-V114 HydrophobicContact CB-CG2 3.68Å; R104-V114 HydrophobicContact CG-CG2 3.99Å
105	R	86.5	Confident	93.6	Very high	242 Å²	242	61.5 Å²	61.5	91%	0.913	32%	0.324	S	S	*	.			trans	-92.5	75.7	172.7	-64.9	-176	-177	179.4	0.4	108.8
106	G	85.1	Confident	93.8	Very high	53 Å²	53	60.8 Å²	60.8	55%	0.546	31%	0.312	S	S	.	.	S	Bend	trans	-99.5	-91.8	176.4	0	0	0	0	0	111.2	R104	R104-G106 PolarHBondContact O-N 2.78Å
107	H	89.4	Confident	94.1	Very high	106 Å²	106	56.7 Å²	56.7	49%	0.491	29%	0.292	S	S	.	.			trans	-132.5	173.4	176.4	59.9	51.2	0	0	0	110.7	L109 D110	H107-L109 VanDerWaalsContact CE1-C 3.44Å; H107-L109 WeakPolarHBondContact ND1-CA 3.42Å; H107-L109 PolarHBondContact ND1-N 3.29Å; H107-L109 PolarHBondContact O-N 3.26Å; H107-D110 PolarHBondContact CE1-N 2.81Å; H107-D110 PolarHBondContact ND1-N 3.28Å; H107-D110 VanDerWaalsContact ND1-N 3.12Å; H107-D110 WeakPolarHBondContact O-CB 3.31Å; H107-D110 PolarHBondContact O-N 3.2Å
108	R	87.7	Confident	94.1	Very high	226 Å²	226	56.1 Å²	56.1	85%	0.853	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-30.6	-176.8	68.8	-175.7	177.6	179.6	-1.3	115.8	D110	R108-D110 VanDerWaalsContact C-N 3.34Å
109	L	91.7	Very high	94.2	Very high	41 Å²	41	61.3 Å²	61.3	22%	0.215	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	2.5	178.2	-57.2	175.6	0	0	0	113.9	L59 T62 H107 A111	L59-L109 HydrophobicContact CB-CB 4.25Å; L59-L109 HydrophobicContact CB-CD2 4.16Å; L59-L109 WeakPolarHBondContact CD1-O 3.24Å; L59-L109 PolarHBondContact N-O 2.97Å; L59-L109 WeakPolarHBondContact O-CB 3.5Å; L59-L109 WeakPolarHBondContact O-CD1 3.37Å; T62-L109 WeakPolarHBondContact OG1-CD2 3.47Å; H107-L109 VanDerWaalsContact CE1-C 3.44Å; H107-L109 WeakPolarHBondContact ND1-CA 3.42Å; H107-L109 PolarHBondContact ND1-N 3.29Å; H107-L109 PolarHBondContact O-N 3.26Å; L109-A111 PolarHBondContact O-N 3.18Å
110	D	93.2	Very high	94.2	Very high	14 Å²	14	58.1 Å²	58.1	8%	0.075	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-91.7	107.3	-173.4	-169.8	-8.2	0	0	0	109.8	R104 H107 R108 S112	R104-D110 IonicContact CZ-OD2 3.87Å; R104-D110 IonicContact NE-OD1 2.74Å; R104-D110 IonicContact NE-OD2 3.46Å; R104-D110 PolarHBondContact NE-OD2 2.92Å; R104-D110 IonicContact NH2-OD1 3.74Å; R104-D110 IonicContact NH2-OD2 2.78Å; R104-D110 PolarHBondContact NH2-OD2 3.46Å; H107-D110 PolarHBondContact CE1-N 2.81Å; H107-D110 PolarHBondContact ND1-N 3.28Å; H107-D110 VanDerWaalsContact ND1-N 3.12Å; H107-D110 WeakPolarHBondContact O-CB 3.31Å; H107-D110 PolarHBondContact O-N 3.2Å; R108-D110 VanDerWaalsContact C-N 3.34Å; D110-S112 WeakPolarHBondContact OD1-CB 3.26Å; D110-S112 PolarHBondContact OD1-N 2.87Å; D110-S112 PolarHBondContact OD1-OG 3.01Å
111	A	94.8	Very high	94	Very high	5 Å²	5	61 Å²	61	4%	0.041	28%	0.284	C	S	.	.			trans	-106.6	22.3	175.5	0	0	0	0	0	112.6	C57 L59 V68 W70 M103 L109	C57-A111 HydrophobicContact CB-CB 4.46Å; C57-A111 CarbonylContact O-C 3.52Å; C57-A111 VanDerWaalsContact O-C 3.23Å; C57-A111 VanDerWaalsContact O-CA 3.29Å; C57-A111 WeakPolarHBondContact O-CA 3.5Å; C57-A111 PolarHBondContact O-N 3.41Å; L59-A111 HydrophobicContact CD1-CB 3.46Å; L59-A111 VanDerWaalsContact CD1-CB 3.46Å; V68-A111 HydrophobicContact CB-CB 4.4Å; V68-A111 HydrophobicContact CG1-CB 4.11Å; V68-A111 HydrophobicContact CG2-CB 4.01Å; W70-A111 PolarHBondContact NE1-O 3.15Å; M103-A111 HydrophobicContact CE-CB 3.93Å; M103-A111 WeakPolarHBondContact CE-O 3.38Å; L109-A111 PolarHBondContact O-N 3.18Å
112	S	96.5	Very high	93.8	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	28%	0.28	C	S	.	.			trans	-66.6	140.9	-177.5	-53	0	0	0	0	112.2	L55 P56 C57 R104 D110	L55-S112 CarbonylContact O-C 3.59Å; L55-S112 VanDerWaalsContact O-CA 3.26Å; L55-S112 WeakPolarHBondContact O-CA 3.44Å; L55-S112 VanDerWaalsContact O-CB 3.29Å; L55-S112 WeakPolarHBondContact O-CB 3.48Å; P56-S112 WeakPolarHBondContact CA-OG 3.37Å; C57-S112 PolarHBondContact N-OG 3.38Å; C57-S112 VanDerWaalsContact N-OG 3.12Å; C57-S112 PolarHBondContact O-N 3.13Å; R104-S112 PolarHBondContact N-O 3.37Å; D110-S112 WeakPolarHBondContact OD1-CB 3.26Å; D110-S112 PolarHBondContact OD1-N 2.87Å; D110-S112 PolarHBondContact OD1-OG 3.01Å
113	L	97.4	Very high	93.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	128.1	176.3	-169.5	71.2	0	0	0	110.2	T54 L55 W70 I83 L84 A101 I115	T54-L113 CarbonylContact C-O 3.49Å; T54-L113 WeakPolarHBondContact CA-O 3.36Å; L55-L113 HydrophobicContact CB-CB 4.31Å; L55-L113 HydrophobicContact CD1-CD2 4.29Å; L55-L113 PolarHBondContact N-O 3.02Å; L55-L113 PolarHBondContact O-N 2.94Å; W70-L113 HydrophobicContact CB-CD1 4.2Å; W70-L113 HydrophobicContact CB-CD2 4.13Å; W70-L113 HydrophobicContact CD2-CB 3.69Å; W70-L113 HydrophobicContact CD2-CD2 3.98Å; W70-L113 HydrophobicContact CD2-CG 4.28Å; W70-L113 HydrophobicContact CE3-CB 4.16Å; W70-L113 HydrophobicContact CE3-CD2 4Å; W70-L113 HydrophobicContact CG-CB 4.03Å; W70-L113 HydrophobicContact CG-CD1 3.99Å; W70-L113 HydrophobicContact CG-CD2 4.06Å; W70-L113 HydrophobicContact CG-CG 4.26Å; W70-L113 HydrophobicContact CH2-CB 4.22Å; W70-L113 HydrophobicContact CZ2-CB 3.76Å; W70-L113 HydrophobicContact CZ3-CB 4.41Å; I83-L113 HydrophobicContact CD1-CD2 4.16Å; I83-L113 HydrophobicContact CG2-CD1 4.49Å; I83-L113 HydrophobicContact CG2-CD2 4.18Å; L84-L113 HydrophobicContact CB-CD1 4.1Å; L84-L113 HydrophobicContact CD1-CD1 4.05Å; A101-L113 HydrophobicContact CB-CD1 4.05Å; L113-I115 HydrophobicContact CD2-CD1 4.11Å; L113-I115 HydrophobicContact CD2-CG1 4.06Å; L113-I115 HydrophobicContact CG-CG1 4.25Å
114	V	97.7	Very high	93.6	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.024	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.4	171.5	-177.5	0	0	0	0	108.6	T52 A53 T54 A101 R102 R104	T52-V114 HydrophobicContact CG2-CG1 3.39Å; A53-V114 CarbonylContact O-C 3.56Å; A53-V114 WeakPolarHBondContact O-CA 3.42Å; T54-V114 HydrophobicContact CG2-CG2 4.41Å; A101-V114 CarbonylContact C-O 3.5Å; A101-V114 VanDerWaalsContact CA-O 3.31Å; A101-V114 WeakPolarHBondContact CA-O 3.34Å; R102-V114 HydrophobicContact CG-CB 3.99Å; R102-V114 HydrophobicContact CG-CG1 4.49Å; R102-V114 PolarHBondContact N-O 2.79Å; R102-V114 PolarHBondContact O-N 3.14Å; R104-V114 HydrophobicContact CB-CG2 3.68Å; R104-V114 HydrophobicContact CG-CG2 3.99Å
115	I	97.9	Very high	93.6	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	116.1	176.1	-58.5	171.8	0	0	0	107.9	T52 A53 L55 L97 L113 V118 Y126	T52-I115 CarbonylContact C-O 3.58Å; T52-I115 WeakPolarHBondContact CA-O 3.5Å; A53-I115 PolarHBondContact N-O 2.84Å; A53-I115 PolarHBondContact O-N 2.99Å; L55-I115 HydrophobicContact CD1-CD1 4.11Å; L97-I115 HydrophobicContact CD2-CD1 4.37Å; L97-I115 HydrophobicContact CD2-CG2 3.88Å; L113-I115 HydrophobicContact CD2-CD1 4.11Å; L113-I115 HydrophobicContact CD2-CG1 4.06Å; L113-I115 HydrophobicContact CG-CG1 4.25Å; I115-V118 HydrophobicContact CB-CG2 4.47Å; I115-V118 HydrophobicContact CG2-CG2 4.12Å; I115-Y126 HydrophobicContact CD1-CE1 3.82Å
116	A	97.1	Very high	94	Very high	38 Å²	38	43.7 Å²	43.7	31%	0.314	22%	0.221	S	C	.	.	S	Bend	trans	-87.8	146	176.1	0	0	0	0	0	111.7	R100	R100-A116 PolarHBondContact NH1-O 3.26Å; R100-A116 VanDerWaalsContact NH1-O 3.11Å; R100-A116 PolarHBondContact O-N 2.92Å
117	G	95.7	Very high	94.5	Very high	31 Å²	31	43.6 Å²	43.6	32%	0.32	20%	0.204	S	C	.	.	S	Bend	trans	56.8	57.9	174.7	0	0	0	0	0	111.7	A51 R100 R119	A51-G117 PolarHBondContact O-N 2.97Å; A51-G117 VanDerWaalsContact O-N 3.15Å; R100-G117 PolarHBondContact NH1-O 3.47Å; G117-R119 WeakPolarHBondContact O-CG 3.42Å; G117-R119 PolarHBondContact O-N 2.95Å
118	V	96.1	Very high	94.8	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.006	18%	0.181	C	C	.	.			trans	-56.9	132.4	-176.5	174.6	0	0	0	0	110.6	R49 G50 A51 A53 I115 D122 L143 L145	R49-V118 CarbonylContact C-O 3.42Å; R49-V118 WeakPolarHBondContact CA-O 3.41Å; G50-V118 PolarHBondContact N-O 3.47Å; A51-V118 VanDerWaalsContact O-CG2 3.32Å; A51-V118 WeakPolarHBondContact O-CG2 3.43Å; A51-V118 PolarHBondContact O-N 3.02Å; A53-V118 HydrophobicContact CB-CG2 3.75Å; I115-V118 HydrophobicContact CB-CG2 4.47Å; I115-V118 HydrophobicContact CG2-CG2 4.12Å; V118-D122 WeakPolarHBondContact CA-OD2 3.31Å; V118-D122 HydrophobicContact CG1-CB 4.07Å; V118-L143 HydrophobicContact CG1-CD2 4.11Å; V118-L145 HydrophobicContact CG1-CD2 3.6Å
119	R	95.3	Very high	95.2	Very high	121 Å²	121	29.5 Å²	29.5	46%	0.457	15%	0.148	S	C	.	.			trans	-110.4	168.1	-179	-52.7	-179.9	-179.3	176	-3.2	110.9	G117 E121 D122 L145	G117-R119 WeakPolarHBondContact O-CG 3.42Å; G117-R119 PolarHBondContact O-N 2.95Å; R119-E121 VanDerWaalsContact C-N 3.26Å; R119-E121 HydrophobicContact CB-CG 4.33Å; R119-E121 WeakPolarHBondContact CB-OE1 3.32Å; R119-E121 WeakPolarHBondContact CB-OE2 3.18Å; R119-E121 WeakPolarHBondContact CD-OE1 3.43Å; R119-E121 IonicContact NH1-OE1 3.78Å; R119-E121 PolarHBondContact O-N 2.94Å; R119-D122 PolarHBondContact N-OD2 3.22Å; R119-D122 WeakPolarHBondContact O-CB 3.38Å; R119-D122 PolarHBondContact O-N 2.7Å; R119-L145 WeakPolarHBondContact O-CD1 3.34Å
120	L	95.1	Very high	95.3	Very high	14 Å²	14	27.6 Å²	27.6	7%	0.073	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-60.5	-38.8	-179.1	-68.4	-176.8	0	0	0	112.5	R49 D122 E123 L145 R176 F241	R49-L120 VanDerWaalsContact NH2-CG 3.3Å; L120-D122 PolarHBondContact O-N 3.36Å; L120-E123 PolarHBondContact O-N 2.9Å; L120-L145 HydrophobicContact CD2-CD1 4.27Å; L120-R176 HydrophobicContact CB-CG 4.11Å; L120-R176 HydrophobicContact CD1-CB 4.5Å; L120-R176 HydrophobicContact CD1-CG 4.19Å; L120-R176 PolarHBondContact O-NE 2.88Å; L120-F241 HydrophobicContact CD2-CD1 4.12Å; L120-F241 HydrophobicContact CD2-CE1 3.89Å
121	E	92.6	Very high	95.3	Very high	104 Å²	104	29.6 Å²	29.6	49%	0.486	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-70.9	-10.3	178.2	68.4	-87.7	-158.4	0	0	113.4	K72 R119	K72-E121 PolarHBondContact NZ-O 2.83Å; R119-E121 VanDerWaalsContact C-N 3.26Å; R119-E121 HydrophobicContact CB-CG 4.33Å; R119-E121 WeakPolarHBondContact CB-OE1 3.32Å; R119-E121 WeakPolarHBondContact CB-OE2 3.18Å; R119-E121 WeakPolarHBondContact CD-OE1 3.43Å; R119-E121 IonicContact NH1-OE1 3.78Å; R119-E121 PolarHBondContact O-N 2.94Å
122	D	94.6	Very high	94.9	Very high	4 Å²	4	30.5 Å²	30.5	2%	0.021	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-80.2	-21.7	178.2	-62.8	-22.2	0	0	0	111.6	K72 L97 R100 V118 R119 L120 G124 Y126 L143	K72-D122 WeakPolarHBondContact CE-O 3.36Å; K72-D122 PolarHBondContact NZ-O 3.43Å; L97-D122 WeakPolarHBondContact CD2-OD1 3.39Å; R100-D122 IonicContact CZ-OD1 3.87Å; R100-D122 IonicContact CZ-OD2 3.84Å; R100-D122 VanDerWaalsContact CZ-OD2 3.31Å; R100-D122 IonicContact NH1-OD1 2.98Å; R100-D122 IonicContact NH1-OD2 3.45Å; R100-D122 PolarHBondContact NH1-OD2 2.79Å; R100-D122 VanDerWaalsContact NH2-CG 3.3Å; R100-D122 IonicContact NH2-OD1 2.85Å; R100-D122 PolarHBondContact NH2-OD1 3.02Å; R100-D122 IonicContact NH2-OD2 3.79Å; R100-D122 PolarHBondContact NH2-OD2 3.32Å; V118-D122 WeakPolarHBondContact CA-OD2 3.31Å; V118-D122 HydrophobicContact CG1-CB 4.07Å; R119-D122 PolarHBondContact N-OD2 3.22Å; R119-D122 WeakPolarHBondContact O-CB 3.38Å; R119-D122 PolarHBondContact O-N 2.7Å; L120-D122 PolarHBondContact O-N 3.36Å; D122-G124 PolarHBondContact O-N 3.47Å; D122-Y126 WeakPolarHBondContact O-CE2 3.46Å; D122-Y126 PolarHBondContact O-OH 3.3Å; D122-L143 HydrophobicContact CB-CD2 4.23Å
123	E	94.2	Very high	94.1	Very high	25 Å²	25	34.1 Å²	34.1	12%	0.117	19%	0.189	C	C	.	.			trans	-53.8	137.8	174.6	-165.9	-176	83	0	0	111.2	K72 L120 L143 L145 R176 Q182	K72-E123 WeakPolarHBondContact CE-O 3.5Å; K72-E123 PolarHBondContact NZ-O 3.04Å; L120-E123 PolarHBondContact O-N 2.9Å; E123-L143 WeakPolarHBondContact CG-O 3.38Å; E123-L145 HydrophobicContact CB-CD1 3.97Å; E123-L145 HydrophobicContact CB-CG 3.98Å; E123-L145 HydrophobicContact CG-CG 4.3Å; E123-L145 WeakPolarHBondContact OE2-CB 3.21Å; E123-L145 PolarHBondContact OE2-N 3.15Å; E123-R176 IonicContact OE1-CZ 3.99Å; E123-R176 IonicContact OE1-NH2 3.92Å; E123-R176 PolarHBondContact OE1-NH2 2.78Å; E123-R176 IonicContact OE2-NH2 3.98Å; E123-R176 PolarHBondContact OE2-NH2 3.35Å; E123-Q182 PolarHBondContact OE1-NE2 2.92Å; E123-Q182 PolarHBondContact OE2-NE2 2.96Å
124	G	93.2	Very high	92.9	Very high	17 Å²	17	41.2 Å²	41.2	18%	0.175	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.7	-170.3	176.2	0	0	0	0	0	113.5	D122 Y126 T142 L143	D122-G124 PolarHBondContact O-N 3.47Å; G124-Y126 VanDerWaalsContact O-CD2 3.28Å; G124-Y126 WeakPolarHBondContact O-CD2 3.13Å; G124-Y126 WeakPolarHBondContact O-CE2 3.48Å; G124-T142 CarbonylContact O-C 3.43Å; G124-T142 WeakPolarHBondContact O-CA 3.3Å; G124-L143 PolarHBondContact N-O 3.08Å; G124-L143 PolarHBondContact O-N 3.38Å
125	R	93.6	Very high	91.6	Very high	114 Å²	114	45.2 Å²	45.2	43%	0.43	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	136.4	-178	-167.3	172.4	-169.9	-101	7	110.6	V73 L141	V73-R125 HydrophobicContact CB-CB 4.25Å; V73-R125 HydrophobicContact CG2-CG 4.44Å; V73-R125 PolarHBondContact N-O 2.88Å; R125-L141 CarbonylContact C-O 3.57Å; R125-L141 WeakPolarHBondContact CA-O 3.35Å
126	Y	95.8	Very high	90.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	148.8	-177.8	-70.5	-100.2	0	0	0	109.4	L55 S71 K72 I83 L97 I115 D122 G124 A140 L141 L143	L55-Y126 HydrophobicContact CD1-CD1 3.62Å; L55-Y126 HydrophobicContact CD1-CD2 3.75Å; L55-Y126 HydrophobicContact CD1-CE1 4.13Å; L55-Y126 HydrophobicContact CD1-CE2 4.29Å; L55-Y126 HydrophobicContact CD1-CG 3.4Å; S71-Y126 CarbonylContact O-C 3.59Å; S71-Y126 VanDerWaalsContact O-CA 3.3Å; S71-Y126 WeakPolarHBondContact O-CA 3.4Å; K72-Y126 HydrophobicContact CB-CD1 4.31Å; K72-Y126 HydrophobicContact CB-CE1 4.16Å; K72-Y126 HydrophobicContact CD-CE1 4.31Å; K72-Y126 HydrophobicContact CD-CE2 4.48Å; K72-Y126 HydrophobicContact CG-CD1 4.31Å; K72-Y126 HydrophobicContact CG-CE1 4.02Å; K72-Y126 HydrophobicContact CG-CE2 4.3Å; I83-Y126 HydrophobicContact CD1-CD1 3.47Å; I83-Y126 VanDerWaalsContact CD1-CD1 3.47Å; I83-Y126 HydrophobicContact CD1-CE1 3.44Å; I83-Y126 VanDerWaalsContact CD1-CE1 3.44Å; L97-Y126 HydrophobicContact CD1-CE1 4.1Å; I115-Y126 HydrophobicContact CD1-CE1 3.82Å; D122-Y126 WeakPolarHBondContact O-CE2 3.46Å; D122-Y126 PolarHBondContact O-OH 3.3Å; G124-Y126 VanDerWaalsContact O-CD2 3.28Å; G124-Y126 WeakPolarHBondContact O-CD2 3.13Å; G124-Y126 WeakPolarHBondContact O-CE2 3.48Å; Y126-A140 CarbonylContact O-C 3.59Å; Y126-A140 WeakPolarHBondContact O-CA 3.26Å; Y126-L141 PolarHBondContact N-O 3.12Å; Y126-L141 PolarHBondContact O-N 3.08Å; Y126-L143 HydrophobicContact CD2-CB 4.1Å; Y126-L143 HydrophobicContact CE2-CB 3.69Å; Y126-L143 HydrophobicContact CE2-CD2 4.23Å
127	R	95.4	Very high	90.3	Very high	51 Å²	51	49.9 Å²	49.9	19%	0.192	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	132.1	176.4	-172.8	-175.6	-55	-83.9	2.6	110.1	W70 S71 V73 E80 E129 S138 V139	W70-R127 WeakPolarHBondContact CA-O 3.44Å; W70-R127 VanDerWaalsContact CE3-O 3.27Å; S71-R127 PolarHBondContact N-O 3.41Å; S71-R127 PolarHBondContact O-N 3.39Å; V73-R127 HydrophobicContact CG2-CB 4.48Å; E80-R127 IonicContact OE1-CZ 3.3Å; E80-R127 IonicContact OE1-NE 2.78Å; E80-R127 PolarHBondContact OE1-NE 3.19Å; E80-R127 IonicContact OE1-NH2 2.87Å; E80-R127 PolarHBondContact OE1-NH2 3.42Å; E80-R127 VanDerWaalsContact OE1-NH2 3.12Å; E80-R127 IonicContact OE2-NE 3.91Å; R127-E129 HydrophobicContact CG-CB 4.49Å; R127-S138 PolarHBondContact NH1-OG 2.69Å; R127-S138 VanDerWaalsContact NH1-OG 3.12Å; R127-V139 WeakPolarHBondContact CA-O 3.26Å
128	C	95.8	Very high	90.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	117.5	162.8	-175.3	0	0	0	0	107.4	C57 V68 R69 W70 S138 V139	C57-C128 HydrophobicContact CB-CB 3.62Å; C57-C128 WeakPolarHBondContact CB-SG 3.36Å; C57-C128 WeakPolarHBondContact SG-CB 3.05Å; C57-C128 CovalentContact SG-SG 2.04Å; C57-C128 PolarHBondContact SG-SG 2.95Å; V68-C128 WeakPolarHBondContact CG1-SG 3.46Å; R69-C128 WeakPolarHBondContact O-CA 3.39Å; W70-C128 HydrophobicContact CD2-CB 4.04Å; W70-C128 HydrophobicContact CE3-CB 4.13Å; W70-C128 HydrophobicContact CH2-CB 3.76Å; W70-C128 HydrophobicContact CZ2-CB 3.64Å; W70-C128 HydrophobicContact CZ3-CB 3.99Å; C128-S138 CarbonylContact O-C 3.59Å; C128-S138 WeakPolarHBondContact O-CA 3.33Å; C128-S138 WeakPolarHBondContact O-CB 3.34Å; C128-V139 HydrophobicContact CB-CG2 3.75Å; C128-V139 PolarHBondContact N-O 3.23Å; C128-V139 PolarHBondContact O-N 2.94Å
129	E	95	Very high	90	Very high	36 Å²	36	52 Å²	52	17%	0.168	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	126.7	-178.3	-179.3	178.6	-125.9	0	0	109.3	V68 R69 R127 I131 E137	V68-E129 CarbonylContact C-O 3.53Å; V68-E129 VanDerWaalsContact CA-O 3.32Å; V68-E129 WeakPolarHBondContact CA-O 3.26Å; R69-E129 HydrophobicContact CB-CB 4.35Å; R69-E129 WeakPolarHBondContact CD-OE2 3.49Å; R69-E129 PolarHBondContact N-O 3.28Å; R69-E129 PolarHBondContact O-N 3.09Å; R127-E129 HydrophobicContact CG-CB 4.49Å; E129-I131 HydrophobicContact CG-CD1 4.47Å; E129-I131 HydrophobicContact CG-CG1 4.01Å; E129-E137 CarbonylContact C-O 3.55Å; E129-E137 WeakPolarHBondContact CA-O 3.16Å
130	L	94.3	Very high	89.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125	173.7	-179.2	148	0	0	0	108.7	Y36 L37 L59 P63 Y66 K67 N132 D136 E137	Y36-L130 HydrophobicContact CD2-CD2 4.37Å; Y36-L130 HydrophobicContact CG-CD2 4.25Å; L37-L130 HydrophobicContact CD1-CB 4.08Å; L37-L130 HydrophobicContact CD2-CB 4.12Å; L37-L130 HydrophobicContact CD2-CD1 4.13Å; L37-L130 HydrophobicContact CG-CB 4.09Å; L59-L130 HydrophobicContact CD2-CD1 3.73Å; L59-L130 HydrophobicContact CG-CD1 4Å; P63-L130 HydrophobicContact CG-CD1 4.28Å; P63-L130 HydrophobicContact CG-CD2 3.96Å; Y66-L130 HydrophobicContact CD2-CD1 4.14Å; Y66-L130 HydrophobicContact CD2-CG 4.42Å; K67-L130 WeakPolarHBondContact O-CA 3.46Å; L130-N132 HydrophobicContact CD2-CB 4.2Å; L130-D136 WeakPolarHBondContact O-CA 3.24Å; L130-E137 PolarHBondContact N-O 3.06Å; L130-E137 PolarHBondContact O-N 2.59Å
131	I	92.8	Very high	89.9	Confident	56 Å²	56	46.6 Å²	46.6	29%	0.287	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	115.1	-176.4	-56.2	166.5	0	0	0	107.8	Y66 K67 R69 E129 D136	Y66-I131 CarbonylContact C-O 3.52Å; Y66-I131 VanDerWaalsContact CA-O 3.3Å; Y66-I131 WeakPolarHBondContact CA-O 3.46Å; K67-I131 PolarHBondContact N-O 3.13Å; K67-I131 PolarHBondContact O-N 2.92Å; R69-I131 HydrophobicContact CB-CD1 4.33Å; E129-I131 HydrophobicContact CG-CD1 4.47Å; E129-I131 HydrophobicContact CG-CG1 4.01Å; I131-D136 WeakPolarHBondContact CA-OD1 3.22Å
132	N	87.6	Confident	90.1	Very high	25 Å²	25	44.1 Å²	44.1	13%	0.134	25%	0.247	C	C	.	.			trans	-119.9	1.7	179.4	69.2	17	0	0	0	113.8	Y36 P63 S65 L130 I134 E135	Y36-N132 WeakPolarHBondContact CE2-ND2 3.44Å; P63-N132 HydrophobicContact CB-CB 4.03Å; P63-N132 HydrophobicContact CG-CB 4.17Å; S65-N132 WeakPolarHBondContact O-CB 3.3Å; L130-N132 HydrophobicContact CD2-CB 4.2Å; N132-I134 VanDerWaalsContact C-N 3.33Å; N132-I134 PolarHBondContact OD1-N 2.85Å; N132-E135 PolarHBondContact OD1-N 3.49Å; N132-E135 PolarHBondContact OD1-O 2.99Å
133	G	79	Confident	90.2	Very high	75 Å²	75	43.9 Å²	43.9	77%	0.773	25%	0.246	S	C	*	.	S	Bend	trans	83.5	1.6	178.8	0	0	0	0	0	115.2
134	I	71.4	Confident	90.2	Very high	149 Å²	149	44.1 Å²	44.1	76%	0.764	25%	0.251	S	S	*	.	S	Bend	trans	-122.4	-51.9	176.5	-52.1	176.5	0	0	0	109.4	N132	N132-I134 VanDerWaalsContact C-N 3.33Å; N132-I134 PolarHBondContact OD1-N 2.85Å
135	E	71.3	Confident	90.3	Very high	89 Å²	89	43.6 Å²	43.6	42%	0.416	24%	0.244	S	C	.	.			trans	-135.8	133.5	-179.2	-70.6	172.9	177.5	0	0	109.9	N132	N132-E135 PolarHBondContact OD1-N 3.49Å; N132-E135 PolarHBondContact OD1-O 2.99Å
136	D	78.2	Confident	90.4	Very high	105 Å²	105	43.1 Å²	43.1	56%	0.561	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	117.5	172.5	-69.4	-20	0	0	0	109.1	L130 I131	L130-D136 WeakPolarHBondContact O-CA 3.24Å; I131-D136 WeakPolarHBondContact CA-OD1 3.22Å
137	E	89.6	Confident	90.4	Very high	31 Å²	31	43.7 Å²	43.7	15%	0.145	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	141.3	173.2	-73.5	-173.2	-164.5	0	0	110.1	H35 Y36 L37 E129 L130	H35-E137 VanDerWaalsContact CA-OE1 3.28Å; H35-E137 WeakPolarHBondContact CA-OE1 3.31Å; Y36-E137 WeakPolarHBondContact CA-OE2 3.46Å; Y36-E137 VanDerWaalsContact N-CD 3.27Å; Y36-E137 PolarHBondContact N-OE1 3.46Å; Y36-E137 PolarHBondContact N-OE2 3.02Å; L37-E137 HydrophobicContact CD1-CB 4.02Å; L37-E137 WeakPolarHBondContact CD1-O 3.45Å; L37-E137 HydrophobicContact CG-CB 4.22Å; L37-E137 PolarHBondContact N-OE2 2.99Å; E129-E137 CarbonylContact C-O 3.55Å; E129-E137 WeakPolarHBondContact CA-O 3.16Å; L130-E137 PolarHBondContact N-O 3.06Å; L130-E137 PolarHBondContact O-N 2.59Å
138	S	92.3	Very high	90.5	Very high	56 Å²	56	41.8 Å²	41.8	39%	0.392	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	143.9	173.6	73.4	0	0	0	0	113.4	R127 C128	R127-S138 PolarHBondContact NH1-OG 2.69Å; R127-S138 VanDerWaalsContact NH1-OG 3.12Å; C128-S138 CarbonylContact O-C 3.59Å; C128-S138 WeakPolarHBondContact O-CA 3.33Å; C128-S138 WeakPolarHBondContact O-CB 3.34Å
139	V	93.3	Very high	90.6	Very high	20 Å²	20	42.3 Å²	42.3	12%	0.121	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146.9	166.8	-61.4	0	0	0	0	108.7	L37 R127 C128	L37-V139 HydrophobicContact CB-CG1 4.07Å; L37-V139 HydrophobicContact CD1-CG1 4.26Å; L37-V139 HydrophobicContact CD1-CG2 4.44Å; R127-V139 WeakPolarHBondContact CA-O 3.26Å; C128-V139 HydrophobicContact CB-CG2 3.75Å; C128-V139 PolarHBondContact N-O 3.23Å; C128-V139 PolarHBondContact O-N 2.94Å
140	A	93.4	Very high	90.8	Very high	21 Å²	21	40.6 Å²	40.6	17%	0.174	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	140.9	179.1	0	0	0	0	0	110.9	Y126	Y126-A140 CarbonylContact O-C 3.59Å; Y126-A140 WeakPolarHBondContact O-CA 3.26Å
141	L	95.4	Very high	91	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	155.3	-175.6	-60.9	147.5	0	0	0	108.9	P40 H42 E43 L55 P56 W70 R125 Y126	P40-L141 HydrophobicContact CB-CD2 3.59Å; P40-L141 HydrophobicContact CG-CD2 3.87Å; H42-L141 WeakPolarHBondContact O-CD2 3.37Å; E43-L141 CarbonylContact O-C 3.55Å; E43-L141 WeakPolarHBondContact O-CA 3.44Å; L55-L141 HydrophobicContact CB-CD1 3.98Å; P56-L141 HydrophobicContact CG-CD1 4.45Å; P56-L141 HydrophobicContact CG-CD2 4.04Å; P56-L141 WeakPolarHBondContact O-CD1 3.38Å; W70-L141 HydrophobicContact CH2-CD1 3.59Å; W70-L141 HydrophobicContact CZ3-CD1 4.06Å; R125-L141 CarbonylContact C-O 3.57Å; R125-L141 WeakPolarHBondContact CA-O 3.35Å; Y126-L141 PolarHBondContact N-O 3.12Å; Y126-L141 PolarHBondContact O-N 3.08Å
142	T	95.6	Very high	91.2	Very high	51 Å²	51	39 Å²	39	31%	0.313	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	120.8	173.8	-56.4	0	0	0	0	109.3	E43 V44 I45 G124	E43-T142 PolarHBondContact O-N 3.04Å; V44-T142 CarbonylContact C-O 3.46Å; V44-T142 WeakPolarHBondContact CA-O 3.32Å; I45-T142 PolarHBondContact N-O 2.85Å; G124-T142 CarbonylContact O-C 3.43Å; G124-T142 WeakPolarHBondContact O-CA 3.3Å
143	L	96.3	Very high	91.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	117.5	164.3	-177.8	62.7	0	0	0	107.4	I45 A53 L55 V118 D122 E123 G124 Y126	I45-L143 HydrophobicContact CG2-CD1 4.43Å; I45-L143 WeakPolarHBondContact O-CA 3.32Å; A53-L143 HydrophobicContact CB-CD1 3.73Å; L55-L143 HydrophobicContact CD2-CB 4.29Å; L55-L143 HydrophobicContact CD2-CD1 4.41Å; V118-L143 HydrophobicContact CG1-CD2 4.11Å; D122-L143 HydrophobicContact CB-CD2 4.23Å; E123-L143 WeakPolarHBondContact CG-O 3.38Å; G124-L143 PolarHBondContact N-O 3.08Å; G124-L143 PolarHBondContact O-N 3.38Å; Y126-L143 HydrophobicContact CD2-CB 4.1Å; Y126-L143 HydrophobicContact CE2-CB 3.69Å; Y126-L143 HydrophobicContact CE2-CD2 4.23Å
144	S	95.4	Very high	92.3	Very high	30 Å²	30	37.5 Å²	37.5	21%	0.21	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130.6	178.9	-172.3	0	0	0	0	109.8	I45 H46 S47	I45-S144 PolarHBondContact O-N 3.15Å; H46-S144 WeakPolarHBondContact CA-O 3.1Å; S47-S144 PolarHBondContact N-O 2.92Å
145	L	95.4	Very high	93.4	Very high	6 Å²	6	34.3 Å²	34.3	3%	0.031	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.8	178	-64.9	178.8	0	0	0	111.3	S47 V118 R119 L120 E123 G147 F241	S47-L145 WeakPolarHBondContact O-CA 3.24Å; V118-L145 HydrophobicContact CG1-CD2 3.6Å; R119-L145 WeakPolarHBondContact O-CD1 3.34Å; L120-L145 HydrophobicContact CD2-CD1 4.27Å; E123-L145 HydrophobicContact CB-CD1 3.97Å; E123-L145 HydrophobicContact CB-CG 3.98Å; E123-L145 HydrophobicContact CG-CG 4.3Å; E123-L145 WeakPolarHBondContact OE2-CB 3.21Å; E123-L145 PolarHBondContact OE2-N 3.15Å; L145-G147 PolarHBondContact O-N 2.79Å; L145-F241 HydrophobicContact CB-CE1 4.15Å; L145-F241 HydrophobicContact CB-CZ 4Å
146	E	94.9	Very high	94.5	Very high	103 Å²	103	40.3 Å²	40.3	48%	0.481	22%	0.216	S	C	.	.			trans	-65.1	128.2	162.9	-67	-179.3	-173.1	0	0	109.1	S47 S243	S47-E146 PolarHBondContact O-N 3.43Å; E146-S243 WeakPolarHBondContact O-CB 3.49Å; E146-S243 PolarHBondContact O-OG 2.86Å
147	G	96.1	Very high	95.2	Very high	12 Å²	12	36.7 Å²	36.7	12%	0.124	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.2	-170.5	-176.3	0	0	0	0	0	113.7	L145 F241 T242 F284	L145-G147 PolarHBondContact O-N 2.79Å; G147-F241 VanDerWaalsContact CA-CE2 3.42Å; G147-T242 CarbonylContact C-O 3.57Å; G147-T242 WeakPolarHBondContact CA-O 3.03Å; G147-F284 VanDerWaalsContact CA-CZ 3.49Å
148	V	97.8	Very high	95.4	Very high	12 Å²	12	42 Å²	42	7%	0.073	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	134.9	-178.6	59.7	0	0	0	0	109.7	F241 T242 Y279 W282 K283 F284	V148-F241 WeakPolarHBondContact O-CA 3.26Å; V148-T242 HydrophobicContact CG1-CG2 3.64Å; V148-T242 PolarHBondContact N-O 2.91Å; V148-T242 PolarHBondContact O-N 2.82Å; V148-Y279 HydrophobicContact CG2-CD1 4.15Å; V148-W282 HydrophobicContact CG2-CE3 4.35Å; V148-W282 HydrophobicContact CG2-CZ3 3.9Å; V148-K283 HydrophobicContact CB-CB 4.11Å; V148-K283 HydrophobicContact CB-CG 4.11Å; V148-K283 HydrophobicContact CG1-CB 4.28Å; V148-K283 HydrophobicContact CG2-CB 4.38Å; V148-F284 HydrophobicContact CG1-CE2 4.41Å
149	V	98.6	Very high	95.6	Very high	10 Å²	10	42.5 Å²	42.5	6%	0.061	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	136.2	171.8	176.6	0	0	0	0	109.5	A178 Q182 L183 A186 L191 F239 C240 F241	V149-A178 HydrophobicContact CG1-CB 4.07Å; V149-A178 HydrophobicContact CG2-CB 3.85Å; V149-Q182 HydrophobicContact CG2-CB 3.81Å; V149-Q182 WeakPolarHBondContact CG2-O 3.23Å; V149-L183 HydrophobicContact CG1-CD1 4.11Å; V149-A186 HydrophobicContact CB-CB 3.72Å; V149-A186 HydrophobicContact CG1-CB 4.45Å; V149-A186 HydrophobicContact CG2-CB 4.06Å; V149-L191 HydrophobicContact CG1-CD2 4.27Å; V149-F239 HydrophobicContact CG1-CB 4.07Å; V149-F239 HydrophobicContact CG1-CD1 4.05Å; V149-F239 HydrophobicContact CG1-CG 4.49Å; V149-C240 CarbonylContact C-O 3.58Å; V149-C240 VanDerWaalsContact CA-O 3.23Å; V149-C240 WeakPolarHBondContact CA-O 3.4Å; V149-F241 HydrophobicContact CG2-CD2 4.15Å
150	F	98.3	Very high	95.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.5	173.8	62.3	-88.2	0	0	0	112.1	Y152 Q173 C240 T242 V275 Y279	F150-Y152 HydrophobicContact CE2-CD2 4.47Å; F150-Q173 HydrophobicContact CE2-CB 4.41Å; F150-Q173 HydrophobicContact CZ-CB 4.32Å; F150-C240 HydrophobicContact CD1-CB 4.08Å; F150-C240 HydrophobicContact CD2-CB 3.9Å; F150-C240 HydrophobicContact CE1-CB 3.61Å; F150-C240 HydrophobicContact CE2-CB 3.43Å; F150-C240 VanDerWaalsContact CE2-CB 3.43Å; F150-C240 HydrophobicContact CG-CB 4.21Å; F150-C240 HydrophobicContact CZ-CB 3.28Å; F150-C240 PolarHBondContact N-O 3.06Å; F150-C240 PolarHBondContact O-N 2.98Å; F150-T242 HydrophobicContact CD1-CG2 4.25Å; F150-T242 HydrophobicContact CE1-CG2 3.92Å; F150-V275 HydrophobicContact CD2-CG1 3.66Å; F150-V275 HydrophobicContact CE2-CB 4.19Å; F150-V275 HydrophobicContact CE2-CG1 3.64Å; F150-V275 HydrophobicContact CG-CG1 4.49Å; F150-V275 HydrophobicContact CZ-CG1 4.47Å; F150-Y279 HydrophobicContact CB-CD1 3.55Å; F150-Y279 HydrophobicContact CB-CD2 3.54Å; F150-Y279 HydrophobicContact CB-CE1 3.45Å; F150-Y279 VanDerWaalsContact CB-CE1 3.45Å; F150-Y279 HydrophobicContact CB-CE2 3.45Å; F150-Y279 VanDerWaalsContact CB-CE2 3.45Å; F150-Y279 HydrophobicContact CB-CG 3.57Å; F150-Y279 HydrophobicContact CD1-CD2 4.36Å; F150-Y279 HydrophobicContact CD1-CG 4.24Å; F150-Y279 HydrophobicContact CD2-CD2 4.28Å; F150-Y279 HydrophobicContact CD2-CE2 4.32Å; F150-Y279 HydrophobicContact CG-CD1 4.47Å; F150-Y279 AromaticContact CG-CD2 3.85Å; F150-Y279 HydrophobicContact CG-CD2 3.85Å; F150-Y279 HydrophobicContact CG-CE2 4.08Å; F150-Y279 HydrophobicContact CG-CG 4.04Å
151	P	97.8	Very high	96	Very high	7 Å²	7	45.4 Å²	45.4	5%	0.045	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	140.4	170.7	28.8	-32.3	0	0	0	110.6	W193 F239	P151-W193 HydrophobicContact CB-CD2 3.68Å; P151-W193 VanDerWaalsContact CB-CE2 3.4Å; P151-W193 HydrophobicContact CB-CE3 4.27Å; P151-W193 HydrophobicContact CB-CG 3.97Å; P151-W193 HydrophobicContact CB-CH2 4.36Å; P151-W193 HydrophobicContact CB-CZ2 3.79Å; P151-W193 HydrophobicContact CG-CD2 3.62Å; P151-W193 HydrophobicContact CG-CE3 3.68Å; P151-W193 HydrophobicContact CG-CG 4.23Å; P151-W193 HydrophobicContact CG-CH2 3.9Å; P151-W193 HydrophobicContact CG-CZ2 3.85Å; P151-W193 HydrophobicContact CG-CZ3 3.81Å; P151-F239 HydrophobicContact CB-CD1 4.25Å; P151-F239 HydrophobicContact CB-CE1 3.96Å
152	Y	98.2	Very high	96.2	Very high	17 Å²	17	46.4 Å²	46.4	7%	0.067	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	129.2	179.6	-171.9	-103.4	0	0	0	111.8	F150 F161 A169 Q173 D237 A238 V275	F150-Y152 HydrophobicContact CE2-CD2 4.47Å; Y152-F161 AromaticContact CD1-CE2 3.77Å; Y152-F161 HydrophobicContact CD1-CE2 3.77Å; Y152-F161 HydrophobicContact CD1-CZ 4.16Å; Y152-F161 AromaticContact CE1-CE2 3.92Å; Y152-F161 HydrophobicContact CE1-CE2 3.92Å; Y152-F161 AromaticContact CE1-CZ 3.8Å; Y152-F161 HydrophobicContact CE1-CZ 3.8Å; Y152-A169 HydrophobicContact CD1-CB 4.03Å; Y152-A169 HydrophobicContact CE1-CB 3.76Å; Y152-Q173 HydrophobicContact CD2-CG 4.08Å; Y152-Q173 HydrophobicContact CE1-CG 4.32Å; Y152-Q173 HydrophobicContact CE2-CG 3.5Å; Y152-Q173 VanDerWaalsContact CE2-CG 3.5Å; Y152-D237 WeakPolarHBondContact O-CB 3.36Å; Y152-A238 PolarHBondContact N-O 2.9Å; Y152-A238 PolarHBondContact O-N 3.3Å; Y152-V275 HydrophobicContact CD2-CG2 4.44Å; Y152-V275 HydrophobicContact CE2-CG2 4.13Å
153	Q	95.2	Very high	96.3	Very high	50 Å²	50	45 Å²	45	23%	0.234	22%	0.219	C	C	.	.			trans	-134.4	145.6	175.2	67.1	179.6	-7.1	0	0	108.6	R158 F324	Q153-R158 VanDerWaalsContact OE1-CG 3.3Å; Q153-F324 WeakPolarHBondContact O-CZ 3.45Å
154	P	94.1	Very high	96.4	Very high	17 Å²	17	50.6 Å²	50.6	11%	0.11	24%	0.241	C	C	.	.			trans	-79.9	170	178.1	31.2	-29.5	0	0	0	112.3	R156 G157 Q160 F161	P154-R156 PolarHBondContact O-N 3.14Å; P154-R156 VanDerWaalsContact O-N 3.13Å; P154-G157 WeakPolarHBondContact CD-O 3.12Å; P154-G157 PolarHBondContact O-N 3.43Å; P154-G157 VanDerWaalsContact O-N 3.12Å; P154-Q160 HydrophobicContact CG-CB 3.6Å; P154-Q160 HydrophobicContact CG-CG 4.03Å; P154-F161 HydrophobicContact CB-CE1 4Å; P154-F161 HydrophobicContact CB-CE2 4.41Å; P154-F161 HydrophobicContact CB-CZ 3.59Å; P154-F161 VanDerWaalsContact CD-CE2 3.47Å; P154-F161 VanDerWaalsContact CD-CZ 3.5Å; P154-F161 HydrophobicContact CG-CE1 3.82Å; P154-F161 HydrophobicContact CG-CE2 3.99Å; P154-F161 HydrophobicContact CG-CZ 3.51Å
155	S	94.4	Very high	96.5	Very high	82 Å²	82	52.5 Å²	52.5	57%	0.573	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-20.9	177	60.1	0	0	0	0	114.8	G157	S155-G157 PolarHBondContact O-N 3.18Å
156	R	93.7	Very high	96.7	Very high	215 Å²	215	52.2 Å²	52.2	81%	0.811	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	2.6	177.8	-60.7	-172.8	-174	116.6	0.4	113.8	P154 Q160	P154-R156 PolarHBondContact O-N 3.14Å; P154-R156 VanDerWaalsContact O-N 3.13Å; R156-Q160 HydrophobicContact CB-CG 4.38Å
157	G	92.8	Very high	96.8	Very high	30 Å²	30	51.2 Å²	51.2	31%	0.309	24%	0.239	S	C	.	.			trans	100.4	-167.8	178.9	0	0	0	0	0	113.4	P154 S155 Q160	P154-G157 WeakPolarHBondContact CD-O 3.12Å; P154-G157 PolarHBondContact O-N 3.43Å; P154-G157 VanDerWaalsContact O-N 3.12Å; S155-G157 PolarHBondContact O-N 3.18Å; G157-Q160 VanDerWaalsContact O-CG 3.24Å; G157-Q160 WeakPolarHBondContact O-CG 3.37Å
158	R	94.7	Very high	97	Very high	143 Å²	143	55.7 Å²	55.7	54%	0.54	26%	0.257	S	S	.	.	S	Bend	trans	-77.8	152.3	-173	-62.1	-176.2	-64.7	170.4	1	112.5	Q153 Q160 N195 D237	Q153-R158 VanDerWaalsContact OE1-CG 3.3Å; R158-Q160 PolarHBondContact O-OE1 3.33Å; R158-N195 VanDerWaalsContact CD-CG 3.45Å; R158-N195 WeakPolarHBondContact CD-ND2 3.09Å; R158-N195 VanDerWaalsContact CD-OD1 3.3Å; R158-N195 WeakPolarHBondContact CD-OD1 3.35Å; R158-N195 PolarHBondContact NH1-OD1 3.17Å; R158-N195 VanDerWaalsContact NH1-OD1 3.08Å; R158-D237 WeakPolarHBondContact CA-OD1 3.3Å
159	Y	96.2	Very high	97	Very high	66 Å²	66	55.3 Å²	55.3	26%	0.259	26%	0.255	S	S	.	.	S	Bend	trans	62	46.9	169.9	-54.1	-26.1	0	0	0	113.9	N195 A196 R235 Y236 D237	Y159-N195 HydrophobicContact CE1-CB 3.87Å; Y159-N195 WeakPolarHBondContact OH-CA 3.47Å; Y159-A196 HydrophobicContact CE1-CB 4.12Å; Y159-A196 VanDerWaalsContact CE1-O 3.26Å; Y159-A196 WeakPolarHBondContact CE1-O 3.43Å; Y159-A196 PolarHBondContact OH-N 3.27Å; Y159-A196 VanDerWaalsContact OH-N 3.1Å; Y159-R235 WeakPolarHBondContact O-CB 3.29Å; Y159-Y236 HydrophobicContact CD1-CD1 4.24Å; Y159-Y236 HydrophobicContact CE1-CD1 4.42Å; Y159-D237 PolarHBondContact N-OD1 3.25Å
160	Q	97.5	Very high	97	Very high	77 Å²	77	54.9 Å²	54.9	36%	0.36	25%	0.252	S	S	.	.			trans	-106.5	-10.9	-174.1	-64.1	-61.1	101.7	0	0	113.6	P154 R156 G157 R158 R235 Y236	P154-Q160 HydrophobicContact CG-CB 3.6Å; P154-Q160 HydrophobicContact CG-CG 4.03Å; R156-Q160 HydrophobicContact CB-CG 4.38Å; G157-Q160 VanDerWaalsContact O-CG 3.24Å; G157-Q160 WeakPolarHBondContact O-CG 3.37Å; R158-Q160 PolarHBondContact O-OE1 3.33Å; Q160-R235 PolarHBondContact O-NH1 3.08Å; Q160-Y236 PolarHBondContact N-O 3.42Å
161	F	98.3	Very high	97	Very high	24 Å²	24	59.5 Å²	59.5	11%	0.105	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-105.8	131.6	-176.1	-57.7	-51.1	0	0	0	112.5	Y152 P154 E165 A166 A169 W198 R235 Y236	Y152-F161 AromaticContact CD1-CE2 3.77Å; Y152-F161 HydrophobicContact CD1-CE2 3.77Å; Y152-F161 HydrophobicContact CD1-CZ 4.16Å; Y152-F161 AromaticContact CE1-CE2 3.92Å; Y152-F161 HydrophobicContact CE1-CE2 3.92Å; Y152-F161 AromaticContact CE1-CZ 3.8Å; Y152-F161 HydrophobicContact CE1-CZ 3.8Å; P154-F161 HydrophobicContact CB-CE1 4Å; P154-F161 HydrophobicContact CB-CE2 4.41Å; P154-F161 HydrophobicContact CB-CZ 3.59Å; P154-F161 VanDerWaalsContact CD-CE2 3.47Å; P154-F161 VanDerWaalsContact CD-CZ 3.5Å; P154-F161 HydrophobicContact CG-CE1 3.82Å; P154-F161 HydrophobicContact CG-CE2 3.99Å; P154-F161 HydrophobicContact CG-CZ 3.51Å; F161-E165 WeakPolarHBondContact CA-OE2 3.44Å; F161-E165 HydrophobicContact CB-CB 4.08Å; F161-E165 HydrophobicContact CD1-CB 3.96Å; F161-E165 HydrophobicContact CG-CB 4.43Å; F161-A166 HydrophobicContact CB-CB 3.82Å; F161-A166 HydrophobicContact CD2-CB 4.48Å; F161-A166 HydrophobicContact CG-CB 4.42Å; F161-A169 HydrophobicContact CE1-CB 4.1Å; F161-A169 HydrophobicContact CE2-CB 3.99Å; F161-A169 HydrophobicContact CZ-CB 3.75Å; F161-W198 PolarHBondContact O-NE1 3.47Å; F161-R235 CarbonylContact O-C 3.55Å; F161-R235 VanDerWaalsContact O-CA 3.23Å; F161-R235 WeakPolarHBondContact O-CA 3.39Å; F161-Y236 WeakPolarHBondContact CB-O 3.42Å; F161-Y236 PolarHBondContact N-O 2.94Å; F161-Y236 PolarHBondContact O-N 3.28Å
162	N	98.3	Very high	97	Very high	22 Å²	22	63.7 Å²	63.7	12%	0.118	29%	0.293	C	S	.	.			trans	-71.5	176.5	153.8	72.8	33	0	0	0	110.6	Y164 E165 A166 D234	N162-Y164 VanDerWaalsContact C-N 3.34Å; N162-Y164 PolarHBondContact O-N 2.66Å; N162-Y164 PolarHBondContact OD1-N 2.82Å; N162-E165 PolarHBondContact N-OE2 3.14Å; N162-E165 PolarHBondContact O-N 3.05Å; N162-E165 WeakPolarHBondContact OD1-CB 3.37Å; N162-E165 WeakPolarHBondContact OD1-CG 3.04Å; N162-E165 PolarHBondContact OD1-N 2.86Å; N162-A166 VanDerWaalsContact O-CB 3.3Å; N162-A166 WeakPolarHBondContact O-CB 3.23Å; N162-A166 PolarHBondContact O-N 2.89Å; N162-D234 WeakPolarHBondContact CA-O 3.39Å
163	Y	98.3	Very high	97	Very high	23 Å²	23	63.5 Å²	63.5	9%	0.09	29%	0.292	C	S	.	.	H	α-helix	trans	-59.5	-42.6	-175.6	170.9	-100.2	0	0	0	113.1	A166 K167 L177 W198 L199 L200 R231	Y163-A166 PolarHBondContact O-N 3.4Å; Y163-K167 PolarHBondContact O-N 3.06Å; Y163-L177 HydrophobicContact CD2-CD1 4.07Å; Y163-L177 HydrophobicContact CE2-CD1 3.57Å; Y163-W198 HydrophobicContact CD2-CD2 4.28Å; Y163-W198 AromaticContact CD2-CE3 3.91Å; Y163-W198 HydrophobicContact CD2-CE3 3.91Å; Y163-W198 HydrophobicContact CG-CE3 4.43Å; Y163-L199 WeakPolarHBondContact CE2-O 3.46Å; Y163-L200 PolarHBondContact OH-O 3.03Å; Y163-R231 WeakPolarHBondContact CB-O 3.42Å; Y163-R231 HydrophobicContact CD1-CB 4.37Å; Y163-R231 HydrophobicContact CD1-CG 4.39Å; Y163-R231 HydrophobicContact CG-CB 4.23Å; Y163-R231 HydrophobicContact CG-CG 4.11Å; Y163-R231 PolarHBondContact N-O 3.09Å; Y163-R231 VanDerWaalsContact N-O 3.14Å
164	Y	98.3	Very high	97.1	Very high	117 Å²	117	62.8 Å²	62.8	46%	0.459	29%	0.29	S	S	.	.	H	α-helix	trans	-71.5	-40.5	-177	-58.4	-74.7	0	0	0	111.7	N162 A166 K167 Q168 R231 M232	N162-Y164 VanDerWaalsContact C-N 3.34Å; N162-Y164 PolarHBondContact O-N 2.66Å; N162-Y164 PolarHBondContact OD1-N 2.82Å; Y164-A166 VanDerWaalsContact C-N 3.34Å; Y164-K167 PolarHBondContact O-N 2.8Å; Y164-Q168 PolarHBondContact O-N 2.83Å; Y164-R231 HydrophobicContact CE2-CB 4.42Å; Y164-M232 HydrophobicContact CE2-CE 4.44Å; Y164-M232 HydrophobicContact CE2-CG 3.93Å
165	E	98.5	Very high	97.3	Very high	69 Å²	69	62.2 Å²	62.2	32%	0.322	29%	0.288	S	S	.	.	H	α-helix	trans	-63	-40.9	172.8	-68.2	166.3	168.9	0	0	110.9	F161 N162 K167 Q168 A169 R235	F161-E165 WeakPolarHBondContact CA-OE2 3.44Å; F161-E165 HydrophobicContact CB-CB 4.08Å; F161-E165 HydrophobicContact CD1-CB 3.96Å; F161-E165 HydrophobicContact CG-CB 4.43Å; N162-E165 PolarHBondContact N-OE2 3.14Å; N162-E165 PolarHBondContact O-N 3.05Å; N162-E165 WeakPolarHBondContact OD1-CB 3.37Å; N162-E165 WeakPolarHBondContact OD1-CG 3.04Å; N162-E165 PolarHBondContact OD1-N 2.86Å; E165-K167 VanDerWaalsContact C-N 3.35Å; E165-K167 PolarHBondContact O-N 2.88Å; E165-Q168 PolarHBondContact O-N 3.12Å; E165-A169 WeakPolarHBondContact O-CB 3.49Å; E165-A169 PolarHBondContact O-N 2.89Å; E165-R235 IonicContact OE1-NH1 2.71Å; E165-R235 IonicContact OE1-NH2 3.12Å; E165-R235 IonicContact OE2-CZ 3.69Å; E165-R235 IonicContact OE2-NH1 3.75Å; E165-R235 PolarHBondContact OE2-NH1 2.96Å; E165-R235 IonicContact OE2-NH2 3.36Å
166	A	98.6	Very high	97.5	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.6	-39.7	176.9	0	0	0	0	0	111.8	F161 N162 Y163 Y164 A169 C170 L177 W198 A238	F161-A166 HydrophobicContact CB-CB 3.82Å; F161-A166 HydrophobicContact CD2-CB 4.48Å; F161-A166 HydrophobicContact CG-CB 4.42Å; N162-A166 VanDerWaalsContact O-CB 3.3Å; N162-A166 WeakPolarHBondContact O-CB 3.23Å; N162-A166 PolarHBondContact O-N 2.89Å; Y163-A166 PolarHBondContact O-N 3.4Å; Y164-A166 VanDerWaalsContact C-N 3.34Å; A166-A169 PolarHBondContact O-N 2.97Å; A166-C170 PolarHBondContact O-N 3.49Å; A166-C170 VanDerWaalsContact O-N 3.11Å; A166-C170 PolarHBondContact O-SG 2.88Å; A166-L177 HydrophobicContact CB-CD2 4.16Å; A166-W198 HydrophobicContact CB-CB 3.92Å; A166-W198 HydrophobicContact CB-CG 3.98Å; A166-A238 HydrophobicContact CB-CB 3.95Å
167	K	98.3	Very high	97.7	Very high	83 Å²	83	49.1 Å²	49.1	36%	0.361	23%	0.226	S	C	.	.	H	α-helix	trans	-60.6	-52.3	174.3	-169.6	-171.3	176.3	-139.9	0	111.3	Y163 Y164 E165 A169 C170 E171 L177	Y163-K167 PolarHBondContact O-N 3.06Å; Y164-K167 PolarHBondContact O-N 2.8Å; E165-K167 VanDerWaalsContact C-N 3.35Å; E165-K167 PolarHBondContact O-N 2.88Å; K167-A169 VanDerWaalsContact C-N 3.33Å; K167-A169 PolarHBondContact O-N 3.4Å; K167-C170 PolarHBondContact O-N 2.96Å; K167-E171 VanDerWaalsContact CE-OE1 3.24Å; K167-E171 WeakPolarHBondContact CE-OE1 3.17Å; K167-E171 IonicContact NZ-OE1 3.54Å; K167-E171 PolarHBondContact NZ-OE1 3.36Å; K167-E171 WeakPolarHBondContact O-CG 3.5Å; K167-E171 PolarHBondContact O-N 3.46Å; K167-E171 VanDerWaalsContact O-N 3.17Å; K167-L177 HydrophobicContact CB-CD1 3.82Å; K167-L177 HydrophobicContact CB-CG 4.35Å; K167-L177 HydrophobicContact CG-CD1 4.25Å
168	Q	98.4	Very high	97.9	Very high	106 Å²	106	47.7 Å²	47.7	50%	0.495	21%	0.211	S	C	.	.	H	α-helix	trans	-60.9	-42.5	178.3	-178.5	179.6	-13.1	0	0	111.6	Y164 E165 C170 E171 E172	Y164-Q168 PolarHBondContact O-N 2.83Å; E165-Q168 PolarHBondContact O-N 3.12Å; Q168-C170 VanDerWaalsContact C-N 3.31Å; Q168-C170 PolarHBondContact O-N 3.13Å; Q168-E171 WeakPolarHBondContact O-CB 3.49Å; Q168-E171 PolarHBondContact O-N 3.34Å; Q168-E171 VanDerWaalsContact O-N 3.1Å; Q168-E172 HydrophobicContact CG-CG 4.39Å; Q168-E172 WeakPolarHBondContact CG-OE1 2.96Å; Q168-E172 PolarHBondContact NE2-OE1 3.11Å; Q168-E172 WeakPolarHBondContact O-CG 3.06Å; Q168-E172 PolarHBondContact O-N 2.7Å
169	A	98.4	Very high	98	Very high	4 Å²	4	42 Å²	42	3%	0.033	19%	0.192	C	C	.	.	H	α-helix	trans	-58.6	-40.6	178	0	0	0	0	0	112.6	Y152 F161 E165 A166 K167 Q173	Y152-A169 HydrophobicContact CD1-CB 4.03Å; Y152-A169 HydrophobicContact CE1-CB 3.76Å; F161-A169 HydrophobicContact CE1-CB 4.1Å; F161-A169 HydrophobicContact CE2-CB 3.99Å; F161-A169 HydrophobicContact CZ-CB 3.75Å; E165-A169 WeakPolarHBondContact O-CB 3.49Å; E165-A169 PolarHBondContact O-N 2.89Å; A166-A169 PolarHBondContact O-N 2.97Å; K167-A169 VanDerWaalsContact C-N 3.33Å; K167-A169 PolarHBondContact O-N 3.4Å; A169-Q173 WeakPolarHBondContact O-CG 3.38Å; A169-Q173 PolarHBondContact O-N 3.31Å
170	C	98.7	Very high	98	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.2	-42.1	173.7	-67.6	0	0	0	0	112.2	A166 K167 Q168 E172 Q173 D174 G175 C240	A166-C170 PolarHBondContact O-N 3.49Å; A166-C170 VanDerWaalsContact O-N 3.11Å; A166-C170 PolarHBondContact O-SG 2.88Å; K167-C170 PolarHBondContact O-N 2.96Å; Q168-C170 VanDerWaalsContact C-N 3.31Å; Q168-C170 PolarHBondContact O-N 3.13Å; C170-E172 PolarHBondContact O-N 2.98Å; C170-Q173 CarbonylContact O-C 3.59Å; C170-Q173 PolarHBondContact O-N 2.94Å; C170-Q173 VanDerWaalsContact O-N 3.08Å; C170-D174 PolarHBondContact O-N 2.96Å; C170-G175 CarbonylContact C-O 3.5Å; C170-G175 VanDerWaalsContact C-O 3.32Å; C170-G175 CarbonylContact O-C 3.52Å; C170-G175 WeakPolarHBondContact O-CA 3.01Å; C170-G175 PolarHBondContact O-N 2.83Å; C170-C240 WeakPolarHBondContact CA-SG 3.46Å; C170-C240 HydrophobicContact CB-CB 3.74Å; C170-C240 WeakPolarHBondContact CB-SG 3.11Å; C170-C240 WeakPolarHBondContact SG-CA 3.44Å; C170-C240 WeakPolarHBondContact SG-CB 3.29Å; C170-C240 CovalentContact SG-SG 2.04Å; C170-C240 PolarHBondContact SG-SG 3.46Å
171	E	98.3	Very high	97.8	Very high	97 Å²	97	43 Å²	43	45%	0.453	21%	0.205	S	C	.	.	H	α-helix	trans	-60.4	-43.7	177.3	-68.7	170.6	-176.3	0	0	111.5	K167 Q168 Q173 D174 G175	K167-E171 VanDerWaalsContact CE-OE1 3.24Å; K167-E171 WeakPolarHBondContact CE-OE1 3.17Å; K167-E171 IonicContact NZ-OE1 3.54Å; K167-E171 PolarHBondContact NZ-OE1 3.36Å; K167-E171 WeakPolarHBondContact O-CG 3.5Å; K167-E171 PolarHBondContact O-N 3.46Å; K167-E171 VanDerWaalsContact O-N 3.17Å; Q168-E171 WeakPolarHBondContact O-CB 3.49Å; Q168-E171 PolarHBondContact O-N 3.34Å; Q168-E171 VanDerWaalsContact O-N 3.1Å; E171-Q173 PolarHBondContact O-N 3.4Å; E171-D174 PolarHBondContact O-N 3.25Å; E171-D174 VanDerWaalsContact O-N 3.14Å; E171-G175 WeakPolarHBondContact CA-O 3.42Å; E171-G175 PolarHBondContact N-O 3.13Å
172	E	98.2	Very high	97.7	Very high	96 Å²	96	42.4 Å²	42.4	45%	0.449	20%	0.202	S	C	.	.	H	α-helix	trans	-59.3	-29.3	175.1	-73.8	173.9	-173.9	0	0	112.4	Q168 C170 K274	Q168-E172 HydrophobicContact CG-CG 4.39Å; Q168-E172 WeakPolarHBondContact CG-OE1 2.96Å; Q168-E172 PolarHBondContact NE2-OE1 3.11Å; Q168-E172 WeakPolarHBondContact O-CG 3.06Å; Q168-E172 PolarHBondContact O-N 2.7Å; C170-E172 PolarHBondContact O-N 2.98Å; E172-K274 VanDerWaalsContact O-CD 3.24Å; E172-K274 WeakPolarHBondContact O-CD 3.35Å; E172-K274 WeakPolarHBondContact O-CE 3.17Å; E172-K274 PolarHBondContact O-NZ 2.97Å
173	Q	98.4	Very high	97.7	Very high	12 Å²	12	41.3 Å²	41.3	6%	0.056	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	21.4	179.1	-61	-51.1	-48.8	0	0	115	F150 Y152 A169 C170 E171 V275 G276	F150-Q173 HydrophobicContact CE2-CB 4.41Å; F150-Q173 HydrophobicContact CZ-CB 4.32Å; Y152-Q173 HydrophobicContact CD2-CG 4.08Å; Y152-Q173 HydrophobicContact CE1-CG 4.32Å; Y152-Q173 HydrophobicContact CE2-CG 3.5Å; Y152-Q173 VanDerWaalsContact CE2-CG 3.5Å; A169-Q173 WeakPolarHBondContact O-CG 3.38Å; A169-Q173 PolarHBondContact O-N 3.31Å; C170-Q173 CarbonylContact O-C 3.59Å; C170-Q173 PolarHBondContact O-N 2.94Å; C170-Q173 VanDerWaalsContact O-N 3.08Å; E171-Q173 PolarHBondContact O-N 3.4Å; Q173-V275 HydrophobicContact CB-CB 4.3Å; Q173-V275 HydrophobicContact CG-CB 4.38Å; Q173-V275 HydrophobicContact CG-CG2 4.5Å; Q173-V275 VanDerWaalsContact OE1-N 3.11Å; Q173-G276 WeakPolarHBondContact O-CA 3.27Å; Q173-G276 PolarHBondContact O-N 3.28Å
174	D	97.8	Very high	97.7	Very high	35 Å²	35	45.6 Å²	45.6	19%	0.187	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	63	38.2	-178.7	-169.5	62.9	0	0	0	113.5	R49 C170 E171 T242 K274 H277	R49-D174 IonicContact CZ-OD1 2.69Å; R49-D174 IonicContact CZ-OD2 2.73Å; R49-D174 VanDerWaalsContact NH1-CG 3.25Å; R49-D174 IonicContact NH1-OD1 2.79Å; R49-D174 PolarHBondContact NH1-OD1 2.9Å; R49-D174 IonicContact NH1-OD2 2.98Å; R49-D174 PolarHBondContact NH1-OD2 3.25Å; R49-D174 PolarHBondContact NH2-O 2.92Å; R49-D174 VanDerWaalsContact NH2-O 3.14Å; R49-D174 IonicContact NH2-OD1 2.75Å; R49-D174 IonicContact NH2-OD2 3.31Å; R49-D174 PolarHBondContact NH2-OD2 3.22Å; C170-D174 PolarHBondContact O-N 2.96Å; E171-D174 PolarHBondContact O-N 3.25Å; E171-D174 VanDerWaalsContact O-N 3.14Å; D174-T242 WeakPolarHBondContact O-CB 3.43Å; D174-T242 PolarHBondContact O-OG1 2.99Å; D174-K274 HydrophobicContact CB-CD 3.89Å; D174-H277 WeakPolarHBondContact CB-NE2 3.02Å; D174-H277 IonicContact OD1-NE2 4Å; D174-H277 IonicContact OD2-CD2 3.43Å; D174-H277 PolarHBondContact OD2-CD2 2.96Å; D174-H277 IonicContact OD2-NE2 3.76Å
175	G	97.6	Very high	97.6	Very high	6 Å²	6	44.5 Å²	44.5	6%	0.062	21%	0.212	C	C	.	.			trans	-140.5	-173.1	177.3	0	0	0	0	0	112.9	C170 E171 F241	C170-G175 CarbonylContact C-O 3.5Å; C170-G175 VanDerWaalsContact C-O 3.32Å; C170-G175 CarbonylContact O-C 3.52Å; C170-G175 WeakPolarHBondContact O-CA 3.01Å; C170-G175 PolarHBondContact O-N 2.83Å; E171-G175 WeakPolarHBondContact CA-O 3.42Å; E171-G175 PolarHBondContact N-O 3.13Å; G175-F241 CarbonylContact C-O 3.56Å; G175-F241 WeakPolarHBondContact CA-O 3.32Å
176	R	97.6	Very high	97.5	Very high	22 Å²	22	41.8 Å²	41.8	8%	0.083	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	170.4	163.8	60.8	166.4	173.5	72.3	-5.1	108.7	L120 E123 A178 C240 F241	L120-R176 HydrophobicContact CB-CG 4.11Å; L120-R176 HydrophobicContact CD1-CB 4.5Å; L120-R176 HydrophobicContact CD1-CG 4.19Å; L120-R176 PolarHBondContact O-NE 2.88Å; E123-R176 IonicContact OE1-CZ 3.99Å; E123-R176 IonicContact OE1-NH2 3.92Å; E123-R176 PolarHBondContact OE1-NH2 2.78Å; E123-R176 IonicContact OE2-NH2 3.98Å; E123-R176 PolarHBondContact OE2-NH2 3.35Å; R176-A178 PolarHBondContact O-N 2.87Å; R176-C240 CarbonylContact O-C 3.52Å; R176-C240 VanDerWaalsContact O-CA 3.24Å; R176-C240 WeakPolarHBondContact O-CA 3.36Å; R176-F241 HydrophobicContact CG-CD1 4.43Å; R176-F241 PolarHBondContact N-O 2.95Å; R176-F241 PolarHBondContact O-N 3.47Å
177	L	98.1	Very high	97.4	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	137.9	167.8	-70.7	169.1	0	0	0	110.2	Y163 A166 K167 W198 L200 A238	Y163-L177 HydrophobicContact CD2-CD1 4.07Å; Y163-L177 HydrophobicContact CE2-CD1 3.57Å; A166-L177 HydrophobicContact CB-CD2 4.16Å; K167-L177 HydrophobicContact CB-CD1 3.82Å; K167-L177 HydrophobicContact CB-CG 4.35Å; K167-L177 HydrophobicContact CG-CD1 4.25Å; L177-W198 HydrophobicContact CD2-CB 4.18Å; L177-L200 HydrophobicContact CB-CB 4Å; L177-L200 HydrophobicContact CB-CD1 4.07Å; L177-A238 HydrophobicContact CD2-CB 4.03Å
178	A	98.1	Very high	97.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-71.7	147	174.9	0	0	0	0	0	110.1	V149 R176 Q182 L199 L200 F239 F241	V149-A178 HydrophobicContact CG1-CB 4.07Å; V149-A178 HydrophobicContact CG2-CB 3.85Å; R176-A178 PolarHBondContact O-N 2.87Å; A178-Q182 HydrophobicContact CB-CB 4.38Å; A178-L199 HydrophobicContact CB-CD2 4.14Å; A178-L199 CarbonylContact O-C 3.52Å; A178-L199 WeakPolarHBondContact O-CA 3.22Å; A178-L199 WeakPolarHBondContact O-CB 3.35Å; A178-L199 WeakPolarHBondContact O-CD2 3.06Å; A178-L200 PolarHBondContact O-N 2.97Å; A178-F239 HydrophobicContact CB-CB 4.23Å; A178-F239 WeakPolarHBondContact CB-O 3.24Å; A178-F239 PolarHBondContact N-O 2.87Å; A178-F241 HydrophobicContact CB-CB 3.97Å
179	T	95.9	Very high	97	Very high	23 Å²	23	43.3 Å²	43.3	14%	0.141	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-79.2	164.6	167.8	65	0	0	0	0	110.2	S181 Q182 L183 L200	T179-S181 VanDerWaalsContact C-N 3.28Å; T179-S181 PolarHBondContact O-N 3.06Å; T179-S181 PolarHBondContact OG1-OG 3.23Å; T179-Q182 PolarHBondContact O-N 2.94Å; T179-Q182 VanDerWaalsContact OG1-CG 3.23Å; T179-Q182 WeakPolarHBondContact OG1-CG 3.39Å; T179-Q182 PolarHBondContact OG1-N 3.3Å; T179-Q182 PolarHBondContact OG1-OE1 2.8Å; T179-L183 PolarHBondContact O-N 2.98Å; T179-L200 HydrophobicContact CG2-CB 4.31Å; T179-L200 HydrophobicContact CG2-CD2 3.87Å
180	Y	95.6	Very high	96.7	Very high	86 Å²	86	44.8 Å²	44.8	34%	0.337	23%	0.229	S	C	.	.	H	α-helix	trans	-55.5	-41.5	170.1	175.9	-107.6	0	0	0	113.5	Q182 L183 Y184 E201 R205 I223	Y180-Q182 VanDerWaalsContact C-N 3.33Å; Y180-Q182 PolarHBondContact O-N 2.9Å; Y180-L183 PolarHBondContact O-N 2.73Å; Y180-Y184 WeakPolarHBondContact O-CB 2.92Å; Y180-Y184 PolarHBondContact O-N 2.02Å; Y180-E201 PolarHBondContact N-OE2 3.48Å; Y180-R205 VanDerWaalsContact CD2-CZ 3.44Å; Y180-I223 HydrophobicContact CD2-CD1 4.35Å; Y180-I223 HydrophobicContact CD2-CG2 4.47Å; Y180-I223 HydrophobicContact CE2-CB 4.07Å; Y180-I223 HydrophobicContact CE2-CD1 3.75Å; Y180-I223 HydrophobicContact CE2-CG1 4.49Å; Y180-I223 HydrophobicContact CE2-CG2 3.9Å
181	S	94.3	Very high	96.5	Very high	79 Å²	79	46.4 Å²	46.4	55%	0.552	24%	0.238	S	C	*	.	H	α-helix	trans	-63.6	-40.3	-179.8	53.3	0	0	0	0	111.8	T179 Y184 Q185	T179-S181 VanDerWaalsContact C-N 3.28Å; T179-S181 PolarHBondContact O-N 3.06Å; T179-S181 PolarHBondContact OG1-OG 3.23Å; S181-Y184 PolarHBondContact O-N 2.89Å; S181-Q185 PolarHBondContact O-N 2.88Å
182	Q	97.1	Very high	96.3	Very high	10 Å²	10	44.1 Å²	44.1	5%	0.047	23%	0.229	C	C	.	.	H	α-helix	trans	-65.8	-42.1	175	-69	173.2	-27.7	0	0	111.8	E123 V149 A178 T179 Y180 Y184 Q185 A186 F241	E123-Q182 PolarHBondContact OE1-NE2 2.92Å; E123-Q182 PolarHBondContact OE2-NE2 2.96Å; V149-Q182 HydrophobicContact CG2-CB 3.81Å; V149-Q182 WeakPolarHBondContact CG2-O 3.23Å; A178-Q182 HydrophobicContact CB-CB 4.38Å; T179-Q182 PolarHBondContact O-N 2.94Å; T179-Q182 VanDerWaalsContact OG1-CG 3.23Å; T179-Q182 WeakPolarHBondContact OG1-CG 3.39Å; T179-Q182 PolarHBondContact OG1-N 3.3Å; T179-Q182 PolarHBondContact OG1-OE1 2.8Å; Y180-Q182 VanDerWaalsContact C-N 3.33Å; Y180-Q182 PolarHBondContact O-N 2.9Å; Q182-Y184 VanDerWaalsContact C-N 3.32Å; Q182-Y184 PolarHBondContact O-N 2.85Å; Q182-Q185 PolarHBondContact O-N 2.79Å; Q182-A186 WeakPolarHBondContact O-CB 3.11Å; Q182-A186 PolarHBondContact O-N 3.11Å; Q182-F241 HydrophobicContact CB-CD2 4.21Å; Q182-F241 HydrophobicContact CG-CD2 3.99Å; Q182-F241 HydrophobicContact CG-CE2 4.05Å; Q182-F241 VanDerWaalsContact NE2-CD1 3.33Å; Q182-F241 VanDerWaalsContact NE2-CD2 3.31Å
183	L	98	Very high	96.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.6	-40	175	-175.8	67.3	0	0	0	111.5	V149 T179 Y180 A186 W187 L191 L199 R205 P207 I223 F239	V149-L183 HydrophobicContact CG1-CD1 4.11Å; T179-L183 PolarHBondContact O-N 2.98Å; Y180-L183 PolarHBondContact O-N 2.73Å; L183-A186 PolarHBondContact O-N 3.12Å; L183-W187 WeakPolarHBondContact O-CB 3.44Å; L183-W187 PolarHBondContact O-N 2.96Å; L183-L191 HydrophobicContact CD1-CD2 3.98Å; L183-L199 HydrophobicContact CB-CD2 4.21Å; L183-L199 HydrophobicContact CD2-CD1 3.97Å; L183-L199 HydrophobicContact CD2-CD2 4.07Å; L183-R205 HydrophobicContact CD2-CB 4.08Å; L183-P207 HydrophobicContact CD1-CG 3.97Å; L183-I223 HydrophobicContact CB-CD1 4.28Å; L183-I223 HydrophobicContact CD2-CD1 4.03Å; L183-I223 HydrophobicContact CD2-CG2 3.94Å; L183-I223 HydrophobicContact CG-CD1 3.83Å; L183-F239 HydrophobicContact CD1-CB 4.4Å; L183-F239 HydrophobicContact CD1-CD1 3.73Å; L183-F239 HydrophobicContact CD1-CD2 4.25Å; L183-F239 HydrophobicContact CD1-CE1 4.01Å; L183-F239 HydrophobicContact CD1-CG 3.85Å; L183-F239 HydrophobicContact CD1-CZ 4.41Å; L183-F239 HydrophobicContact CD2-CD2 4.46Å
184	Y	96.9	Very high	95.8	Very high	112 Å²	112	44.4 Å²	44.4	44%	0.439	23%	0.23	S	C	.	.	H	α-helix	trans	-60.9	-48	176	-174.5	-90	0	0	0	111.5	Y180 S181 Q182 A186 W187 T188 I223	Y180-Y184 WeakPolarHBondContact O-CB 2.92Å; Y180-Y184 PolarHBondContact O-N 2.02Å; S181-Y184 PolarHBondContact O-N 2.89Å; Q182-Y184 VanDerWaalsContact C-N 3.32Å; Q182-Y184 PolarHBondContact O-N 2.85Å; Y184-A186 PolarHBondContact O-N 3.07Å; Y184-W187 HydrophobicContact CD2-CE3 4.07Å; Y184-W187 HydrophobicContact CD2-CZ3 4.3Å; Y184-W187 AromaticContact CE2-CE3 3.9Å; Y184-W187 HydrophobicContact CE2-CE3 3.9Å; Y184-W187 AromaticContact CE2-CZ3 3.66Å; Y184-W187 HydrophobicContact CE2-CZ3 3.66Å; Y184-W187 AromaticContact CZ-CZ3 3.96Å; Y184-W187 WeakPolarHBondContact O-CB 3.44Å; Y184-W187 PolarHBondContact O-N 3.44Å; Y184-T188 HydrophobicContact CD1-CG2 4.16Å; Y184-T188 HydrophobicContact CE1-CG2 3.74Å; Y184-T188 WeakPolarHBondContact O-CG2 3.17Å; Y184-T188 PolarHBondContact O-N 2.98Å; Y184-T188 PolarHBondContact O-OG1 2.79Å; Y184-I223 VanDerWaalsContact CA-CD1 3.43Å; Y184-I223 HydrophobicContact CD2-CD1 4.15Å
185	Q	96.3	Very high	95.6	Very high	95 Å²	95	43.3 Å²	43.3	44%	0.444	22%	0.224	S	C	.	.	H	α-helix	trans	-57.9	-48.6	174.7	-177.3	179.3	-16.2	0	0	111.3	S181 Q182 W187 T188 E189	S181-Q185 PolarHBondContact O-N 2.88Å; Q182-Q185 PolarHBondContact O-N 2.79Å; Q185-W187 VanDerWaalsContact C-N 3.29Å; Q185-W187 PolarHBondContact O-N 3.49Å; Q185-T188 WeakPolarHBondContact CA-OG1 3.45Å; Q185-T188 PolarHBondContact O-N 3.1Å; Q185-T188 VanDerWaalsContact O-N 3.11Å; Q185-T188 PolarHBondContact O-OG1 3.35Å; Q185-E189 WeakPolarHBondContact CG-OE1 3.19Å; Q185-E189 PolarHBondContact NE2-OE1 3.35Å; Q185-E189 WeakPolarHBondContact O-CG 3.46Å; Q185-E189 PolarHBondContact O-N 2.85Å
186	A	97	Very high	95.6	Very high	12 Å²	12	43 Å²	43	10%	0.099	22%	0.221	C	C	.	.	H	α-helix	trans	-60	-38.7	178.7	0	0	0	0	0	112.8	V149 Q182 L183 Y184 E189 G190 L191	V149-A186 HydrophobicContact CB-CB 3.72Å; V149-A186 HydrophobicContact CG1-CB 4.45Å; V149-A186 HydrophobicContact CG2-CB 4.06Å; Q182-A186 WeakPolarHBondContact O-CB 3.11Å; Q182-A186 PolarHBondContact O-N 3.11Å; L183-A186 PolarHBondContact O-N 3.12Å; Y184-A186 PolarHBondContact O-N 3.07Å; A186-E189 CarbonylContact O-C 3.23Å; A186-E189 PolarHBondContact O-N 2.75Å; A186-G190 PolarHBondContact O-N 2.69Å; A186-L191 HydrophobicContact CB-CB 4.16Å; A186-L191 HydrophobicContact CB-CD2 3.82Å; A186-L191 WeakPolarHBondContact O-CB 3.47Å; A186-L191 PolarHBondContact O-N 3.46Å
187	W	96.2	Very high	95.6	Very high	40 Å²	40	42 Å²	42	15%	0.152	22%	0.217	C	C	.	.	H	α-helix	trans	-63.6	-44.6	173.8	170.5	69.3	0	0	0	112	L183 Y184 Q185 E189 G190 P207 V208 L209 P221 I223	L183-W187 WeakPolarHBondContact O-CB 3.44Å; L183-W187 PolarHBondContact O-N 2.96Å; Y184-W187 HydrophobicContact CD2-CE3 4.07Å; Y184-W187 HydrophobicContact CD2-CZ3 4.3Å; Y184-W187 AromaticContact CE2-CE3 3.9Å; Y184-W187 HydrophobicContact CE2-CE3 3.9Å; Y184-W187 AromaticContact CE2-CZ3 3.66Å; Y184-W187 HydrophobicContact CE2-CZ3 3.66Å; Y184-W187 AromaticContact CZ-CZ3 3.96Å; Y184-W187 WeakPolarHBondContact O-CB 3.44Å; Y184-W187 PolarHBondContact O-N 3.44Å; Q185-W187 VanDerWaalsContact C-N 3.29Å; Q185-W187 PolarHBondContact O-N 3.49Å; W187-E189 PolarHBondContact O-N 3.12Å; W187-G190 PolarHBondContact O-N 2.79Å; W187-G190 VanDerWaalsContact O-N 3.08Å; W187-P207 HydrophobicContact CB-CB 3.8Å; W187-P207 HydrophobicContact CG-CB 3.98Å; W187-V208 PolarHBondContact NE1-O 2.58Å; W187-V208 VanDerWaalsContact NE1-O 3.13Å; W187-L209 HydrophobicContact CG-CD2 4.5Å; W187-L209 HydrophobicContact CZ2-CD2 4.48Å; W187-L209 VanDerWaalsContact NE1-CD2 3.34Å; W187-P221 HydrophobicContact CZ2-CB 4.01Å; W187-I223 HydrophobicContact CB-CD1 4.32Å; W187-I223 HydrophobicContact CB-CG1 4.3Å; W187-I223 HydrophobicContact CD2-CG1 4.49Å; W187-I223 HydrophobicContact CG-CG1 4.28Å
188	T	95.6	Very high	95.6	Very high	83 Å²	83	42 Å²	42	51%	0.509	22%	0.217	S	C	.	.	H	α-helix	trans	-64.2	-22.2	174.9	56.8	0	0	0	0	113.1	Y184 Q185	Y184-T188 HydrophobicContact CD1-CG2 4.16Å; Y184-T188 HydrophobicContact CE1-CG2 3.74Å; Y184-T188 WeakPolarHBondContact O-CG2 3.17Å; Y184-T188 PolarHBondContact O-N 2.98Å; Y184-T188 PolarHBondContact O-OG1 2.79Å; Q185-T188 WeakPolarHBondContact CA-OG1 3.45Å; Q185-T188 PolarHBondContact O-N 3.1Å; Q185-T188 VanDerWaalsContact O-N 3.11Å; Q185-T188 PolarHBondContact O-OG1 3.35Å
189	E	93.3	Very high	95.6	Very high	98 Å²	98	42 Å²	42	46%	0.458	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	3.7	175.9	-69	179.2	-165.3	0	0	113.9	Q185 A186 W187 K283	Q185-E189 WeakPolarHBondContact CG-OE1 3.19Å; Q185-E189 PolarHBondContact NE2-OE1 3.35Å; Q185-E189 WeakPolarHBondContact O-CG 3.46Å; Q185-E189 PolarHBondContact O-N 2.85Å; A186-E189 CarbonylContact O-C 3.23Å; A186-E189 PolarHBondContact O-N 2.75Å; W187-E189 PolarHBondContact O-N 3.12Å; E189-K283 IonicContact OE2-NZ 3.47Å; E189-K283 PolarHBondContact OE2-NZ 3.06Å
190	G	92.6	Very high	95.6	Very high	34 Å²	34	43.2 Å²	43.2	35%	0.351	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	115.4	1	174.2	0	0	0	0	0	115.9	A186 W187 D192 L209	A186-G190 PolarHBondContact O-N 2.69Å; W187-G190 PolarHBondContact O-N 2.79Å; W187-G190 VanDerWaalsContact O-N 3.08Å; G190-D192 PolarHBondContact O-N 3.04Å; G190-D192 VanDerWaalsContact O-N 3.12Å; G190-L209 VanDerWaalsContact C-CD1 3.47Å; G190-L209 VanDerWaalsContact O-CD1 3.3Å; G190-L209 WeakPolarHBondContact O-CD1 3.47Å
191	L	94.1	Very high	95.4	Very high	35 Å²	35	41.9 Å²	41.9	18%	0.183	22%	0.22	C	C	.	.			trans	-69.6	110.5	179.6	-177.1	63.9	0	0	0	111.6	V149 L183 A186 P207 F239	V149-L191 HydrophobicContact CG1-CD2 4.27Å; L183-L191 HydrophobicContact CD1-CD2 3.98Å; A186-L191 HydrophobicContact CB-CB 4.16Å; A186-L191 HydrophobicContact CB-CD2 3.82Å; A186-L191 WeakPolarHBondContact O-CB 3.47Å; A186-L191 PolarHBondContact O-N 3.46Å; L191-P207 HydrophobicContact CD2-CG 3.9Å; L191-P207 HydrophobicContact CG-CG 3.87Å; L191-F239 HydrophobicContact CD2-CD1 4.49Å; L191-F239 HydrophobicContact CD2-CE1 4.28Å
192	D	93.2	Very high	95.4	Very high	48 Å²	48	38.5 Å²	38.5	26%	0.257	20%	0.197	S	C	.	.			trans	-114.4	110.2	169.4	-170	-16.5	0	0	0	110.1	G190 L209 T210 R212	G190-D192 PolarHBondContact O-N 3.04Å; G190-D192 VanDerWaalsContact O-N 3.12Å; D192-L209 HydrophobicContact CB-CB 4.02Å; D192-L209 HydrophobicContact CB-CD1 4.11Å; D192-L209 HydrophobicContact CB-CG 4.13Å; D192-L209 PolarHBondContact OD2-N 3.33Å; D192-T210 PolarHBondContact OD2-N 3.33Å; D192-T210 VanDerWaalsContact OD2-N 3.08Å; D192-R212 VanDerWaalsContact CG-NH1 3.25Å; D192-R212 IonicContact OD1-CZ 3.6Å; D192-R212 VanDerWaalsContact OD1-CZ 3.3Å; D192-R212 IonicContact OD1-NH1 2.69Å; D192-R212 PolarHBondContact OD1-NH1 3.46Å; D192-R212 IonicContact OD1-NH2 3.28Å; D192-R212 PolarHBondContact OD1-NH2 2.94Å; D192-R212 IonicContact OD2-CZ 2.79Å; D192-R212 IonicContact OD2-NH1 3.14Å; D192-R212 PolarHBondContact OD2-NH1 2.85Å; D192-R212 IonicContact OD2-NH2 3.97Å
193	W	94.3	Very high	95.3	Very high	82 Å²	82	39 Å²	39	31%	0.311	20%	0.201	S	C	.	.			trans	-138.5	122.3	-177.3	-160.1	-101.1	0	0	0	112	P151 P207 F239	P151-W193 HydrophobicContact CB-CD2 3.68Å; P151-W193 VanDerWaalsContact CB-CE2 3.4Å; P151-W193 HydrophobicContact CB-CE3 4.27Å; P151-W193 HydrophobicContact CB-CG 3.97Å; P151-W193 HydrophobicContact CB-CH2 4.36Å; P151-W193 HydrophobicContact CB-CZ2 3.79Å; P151-W193 HydrophobicContact CG-CD2 3.62Å; P151-W193 HydrophobicContact CG-CE3 3.68Å; P151-W193 HydrophobicContact CG-CG 4.23Å; P151-W193 HydrophobicContact CG-CH2 3.9Å; P151-W193 HydrophobicContact CG-CZ2 3.85Å; P151-W193 HydrophobicContact CG-CZ3 3.81Å; W193-P207 CarbonylContact C-O 3.51Å; W193-P207 HydrophobicContact CB-CG 4.21Å; W193-P207 PolarHBondContact N-O 2.95Å; W193-F239 HydrophobicContact CB-CE1 4.15Å; W193-F239 HydrophobicContact CB-CZ 4.16Å; W193-F239 AromaticContact CD1-CZ 3.75Å; W193-F239 HydrophobicContact CG-CE1 4.23Å; W193-F239 HydrophobicContact CG-CZ 4.23Å
194	C	92.4	Very high	95.3	Very high	32 Å²	32	39 Å²	39	22%	0.216	20%	0.201	C	C	.	.			trans	-82.8	-19.2	-171.9	-168.5	0	0	0	0	114.3	C215	C194-C215 HydrophobicContact CB-CB 4.02Å; C194-C215 WeakPolarHBondContact CB-SG 3.24Å; C194-C215 WeakPolarHBondContact SG-CA 3.43Å; C194-C215 WeakPolarHBondContact SG-CB 3.47Å; C194-C215 CovalentContact SG-SG 2.02Å; C194-C215 PolarHBondContact SG-SG 3.36Å
195	N	94.5	Very high	95.3	Very high	13 Å²	13	36.4 Å²	36.4	7%	0.07	19%	0.191	C	C	.	.	S	Bend	trans	-86.5	137.1	-178	-57.5	-17.4	0	0	0	110.6	R158 Y159 Y206 D237	R158-N195 VanDerWaalsContact CD-CG 3.45Å; R158-N195 WeakPolarHBondContact CD-ND2 3.09Å; R158-N195 VanDerWaalsContact CD-OD1 3.3Å; R158-N195 WeakPolarHBondContact CD-OD1 3.35Å; R158-N195 PolarHBondContact NH1-OD1 3.17Å; R158-N195 VanDerWaalsContact NH1-OD1 3.08Å; Y159-N195 HydrophobicContact CE1-CB 3.87Å; Y159-N195 WeakPolarHBondContact OH-CA 3.47Å; N195-Y206 VanDerWaalsContact O-CB 3.32Å; N195-Y206 WeakPolarHBondContact O-CB 3.12Å; N195-D237 WeakPolarHBondContact CB-OD2 3.4Å; N195-D237 PolarHBondContact ND2-OD2 3.3Å
196	A	96.5	Very high	95.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.173	C	C	.	.			trans	-69.9	135.2	172.2	0	0	0	0	0	111.8	Y159 V204 Y206 Y226 Y236 D237	Y159-A196 HydrophobicContact CE1-CB 4.12Å; Y159-A196 VanDerWaalsContact CE1-O 3.26Å; Y159-A196 WeakPolarHBondContact CE1-O 3.43Å; Y159-A196 PolarHBondContact OH-N 3.27Å; Y159-A196 VanDerWaalsContact OH-N 3.1Å; A196-V204 HydrophobicContact CB-CG1 3.78Å; A196-Y206 HydrophobicContact CB-CD1 4.4Å; A196-Y226 HydrophobicContact CB-CD2 3.86Å; A196-Y226 HydrophobicContact CB-CE1 4.35Å; A196-Y226 HydrophobicContact CB-CE2 3.47Å; A196-Y226 VanDerWaalsContact CB-CE2 3.47Å; A196-Y226 HydrophobicContact CB-CG 4.44Å; A196-Y236 HydrophobicContact CB-CD1 3.82Å; A196-Y236 HydrophobicContact CB-CE1 4.29Å; A196-D237 WeakPolarHBondContact O-CB 3.19Å; A196-D237 PolarHBondContact O-N 3.11Å
197	G	98.2	Very high	95.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	152.5	178.3	0	0	0	0	0	113	V204 R205 D237	G197-V204 WeakPolarHBondContact O-CA 3.29Å; G197-R205 PolarHBondContact N-O 2.83Å; G197-R205 PolarHBondContact O-N 3.44Å; G197-R205 VanDerWaalsContact O-N 3.07Å; G197-D237 CarbonylContact C-O 3.46Å; G197-D237 WeakPolarHBondContact CA-O 3.2Å
198	W	98.4	Very high	95.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	144.6	172.8	-67.4	104.8	0	0	0	111.6	F161 Y163 A166 L177 G202 V204 R229 R231 D234 Y236 D237 F239	F161-W198 PolarHBondContact O-NE1 3.47Å; Y163-W198 HydrophobicContact CD2-CD2 4.28Å; Y163-W198 AromaticContact CD2-CE3 3.91Å; Y163-W198 HydrophobicContact CD2-CE3 3.91Å; Y163-W198 HydrophobicContact CG-CE3 4.43Å; A166-W198 HydrophobicContact CB-CB 3.92Å; A166-W198 HydrophobicContact CB-CG 3.98Å; L177-W198 HydrophobicContact CD2-CB 4.18Å; W198-G202 WeakPolarHBondContact CZ3-O 3.16Å; W198-V204 HydrophobicContact CD2-CG2 3.63Å; W198-V204 HydrophobicContact CE3-CG2 3.27Å; W198-V204 HydrophobicContact CG-CG2 4.39Å; W198-V204 HydrophobicContact CH2-CG2 3.82Å; W198-V204 HydrophobicContact CZ2-CG2 4.13Å; W198-V204 HydrophobicContact CZ3-CG2 3.38Å; W198-R229 HydrophobicContact CH2-CB 3.71Å; W198-R229 HydrophobicContact CZ3-CB 4.03Å; W198-R231 HydrophobicContact CZ3-CG 4.32Å; W198-D234 HydrophobicContact CH2-CB 4.4Å; W198-D234 HydrophobicContact CZ2-CB 4.2Å; W198-D234 WeakPolarHBondContact CZ2-O 3.32Å; W198-Y236 HydrophobicContact CD2-CD2 4.48Å; W198-Y236 AromaticContact CE2-CD2 3.75Å; W198-Y236 HydrophobicContact CH2-CD2 4.37Å; W198-Y236 AromaticContact CZ2-CD2 3.7Å; W198-Y236 HydrophobicContact CZ2-CD2 3.7Å; W198-Y236 HydrophobicContact CZ2-CE2 4.22Å; W198-Y236 AromaticContact NE1-CD2 3.92Å; W198-D237 PolarHBondContact N-O 2.99Å; W198-F239 PolarHBondContact O-N 2.88Å
199	L	97.8	Very high	95	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.151	C	C	.	.			trans	-116.8	165.8	170.2	-64.8	178.2	0	0	0	110.8	Y163 A178 L183 E201 G202 S203 R205 F239	Y163-L199 WeakPolarHBondContact CE2-O 3.46Å; A178-L199 HydrophobicContact CB-CD2 4.14Å; A178-L199 CarbonylContact O-C 3.52Å; A178-L199 WeakPolarHBondContact O-CA 3.22Å; A178-L199 WeakPolarHBondContact O-CB 3.35Å; A178-L199 WeakPolarHBondContact O-CD2 3.06Å; L183-L199 HydrophobicContact CB-CD2 4.21Å; L183-L199 HydrophobicContact CD2-CD1 3.97Å; L183-L199 HydrophobicContact CD2-CD2 4.07Å; L199-E201 VanDerWaalsContact C-N 3.29Å; L199-E201 WeakPolarHBondContact CD1-OE1 3.41Å; L199-E201 PolarHBondContact O-N 2.87Å; L199-G202 WeakPolarHBondContact O-CA 3.33Å; L199-G202 PolarHBondContact O-N 2.81Å; L199-S203 PolarHBondContact N-O 2.88Å; L199-R205 HydrophobicContact CD1-CB 4.04Å; L199-R205 HydrophobicContact CD1-CG 3.91Å; L199-F239 HydrophobicContact CD2-CB 3.85Å; L199-F239 HydrophobicContact CD2-CD2 4.36Å; L199-F239 HydrophobicContact CD2-CG 4.46Å
200	L	94.9	Very high	94.7	Very high	48 Å²	48	28.8 Å²	28.8	25%	0.251	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-36.9	-173.5	-172.5	66	0	0	0	112.7	Y163 L177 A178 T179 G202	Y163-L200 PolarHBondContact OH-O 3.03Å; L177-L200 HydrophobicContact CB-CB 4Å; L177-L200 HydrophobicContact CB-CD1 4.07Å; A178-L200 PolarHBondContact O-N 2.97Å; T179-L200 HydrophobicContact CG2-CB 4.31Å; T179-L200 HydrophobicContact CG2-CD2 3.87Å; L200-G202 PolarHBondContact O-N 2.89Å; L200-G202 VanDerWaalsContact O-N 3.15Å
201	E	91.6	Very high	94.3	Very high	59 Å²	59	29 Å²	29	28%	0.276	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	2.2	175.4	70.8	-83.4	-179.8	0	0	113.7	Y180 L199 S203 R231	Y180-E201 PolarHBondContact N-OE2 3.48Å; L199-E201 VanDerWaalsContact C-N 3.29Å; L199-E201 WeakPolarHBondContact CD1-OE1 3.41Å; L199-E201 PolarHBondContact O-N 2.87Å; E201-S203 VanDerWaalsContact C-N 3.31Å; E201-S203 PolarHBondContact OE1-OG 3.45Å; E201-R231 PolarHBondContact O-NH2 3.48Å
202	G	93.9	Very high	94.1	Very high	8 Å²	8	31.1 Å²	31.1	8%	0.082	16%	0.16	C	C	.	.	S	Bend	trans	75.9	18.2	-178.2	0	0	0	0	0	113.9	W198 L199 L200	W198-G202 WeakPolarHBondContact CZ3-O 3.16Å; L199-G202 WeakPolarHBondContact O-CA 3.33Å; L199-G202 PolarHBondContact O-N 2.81Å; L200-G202 PolarHBondContact O-N 2.89Å; L200-G202 VanDerWaalsContact O-N 3.15Å
203	S	95.8	Very high	93.7	Very high	19 Å²	19	32.8 Å²	32.8	13%	0.133	18%	0.181	C	C	.	.			trans	-85.6	156.1	169.2	85.8	0	0	0	0	110.6	L199 E201 R205	L199-S203 PolarHBondContact N-O 2.88Å; E201-S203 VanDerWaalsContact C-N 3.31Å; E201-S203 PolarHBondContact OE1-OG 3.45Å; S203-R205 PolarHBondContact OG-NE 2.72Å
204	V	97.8	Very high	93.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	118.6	178.7	176.1	0	0	0	0	109	A196 G197 W198 Y226 R229 Y236	A196-V204 HydrophobicContact CB-CG1 3.78Å; G197-V204 WeakPolarHBondContact O-CA 3.29Å; W198-V204 HydrophobicContact CD2-CG2 3.63Å; W198-V204 HydrophobicContact CE3-CG2 3.27Å; W198-V204 HydrophobicContact CG-CG2 4.39Å; W198-V204 HydrophobicContact CH2-CG2 3.82Å; W198-V204 HydrophobicContact CZ2-CG2 4.13Å; W198-V204 HydrophobicContact CZ3-CG2 3.38Å; V204-Y226 HydrophobicContact CG1-CD2 4.47Å; V204-Y226 HydrophobicContact CG1-CG 4.2Å; V204-Y226 PolarHBondContact O-N 2.78Å; V204-R229 HydrophobicContact CB-CG 4.13Å; V204-R229 HydrophobicContact CG2-CB 4.16Å; V204-R229 HydrophobicContact CG2-CG 3.89Å; V204-Y236 HydrophobicContact CB-CD2 4.2Å; V204-Y236 HydrophobicContact CB-CE2 4.27Å; V204-Y236 HydrophobicContact CG1-CD1 3.78Å; V204-Y236 HydrophobicContact CG1-CD2 3.69Å; V204-Y236 HydrophobicContact CG1-CE1 4.02Å; V204-Y236 HydrophobicContact CG1-CE2 3.91Å; V204-Y236 HydrophobicContact CG1-CG 3.61Å; V204-Y236 HydrophobicContact CG2-CD2 3.52Å; V204-Y236 HydrophobicContact CG2-CE2 3.76Å; V204-Y236 HydrophobicContact CG2-CG 4.21Å
205	R	97.4	Very high	93.1	Very high	58 Å²	58	33 Å²	33	22%	0.219	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	168.8	-171.9	-57	-168.7	-165.9	-149.7	0.9	112	Y180 L183 G197 L199 S203 I223 R224 F239	Y180-R205 VanDerWaalsContact CD2-CZ 3.44Å; L183-R205 HydrophobicContact CD2-CB 4.08Å; G197-R205 PolarHBondContact N-O 2.83Å; G197-R205 PolarHBondContact O-N 3.44Å; G197-R205 VanDerWaalsContact O-N 3.07Å; L199-R205 HydrophobicContact CD1-CB 4.04Å; L199-R205 HydrophobicContact CD1-CG 3.91Å; S203-R205 PolarHBondContact OG-NE 2.72Å; R205-I223 HydrophobicContact CB-CG2 3.7Å; R205-I223 HydrophobicContact CG-CG2 4.25Å; R205-R224 CarbonylContact C-O 3.57Å; R205-R224 WeakPolarHBondContact CA-O 3.49Å; R205-R224 WeakPolarHBondContact CB-O 3.38Å; R205-F239 VanDerWaalsContact O-CE2 3.26Å; R205-F239 WeakPolarHBondContact O-CE2 3.49Å
206	Y	96.7	Very high	92.3	Very high	19 Å²	19	34.6 Å²	34.6	8%	0.075	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	134.2	170.8	61.6	-71.1	0	0	0	111.2	N195 A196 V208 R224 Y226	N195-Y206 VanDerWaalsContact O-CB 3.32Å; N195-Y206 WeakPolarHBondContact O-CB 3.12Å; A196-Y206 HydrophobicContact CB-CD1 4.4Å; Y206-V208 HydrophobicContact CD2-CG2 3.55Å; Y206-V208 HydrophobicContact CE2-CG2 3.63Å; Y206-R224 HydrophobicContact CD1-CB 3.84Å; Y206-R224 HydrophobicContact CD2-CB 4.42Å; Y206-R224 HydrophobicContact CE1-CB 3.31Å; Y206-R224 HydrophobicContact CE1-CG 4.39Å; Y206-R224 HydrophobicContact CE2-CB 4.02Å; Y206-R224 VanDerWaalsContact CE2-CD 3.47Å; Y206-R224 HydrophobicContact CE2-CG 4.32Å; Y206-R224 HydrophobicContact CG-CB 4.35Å; Y206-R224 VanDerWaalsContact CZ-CB 3.45Å; Y206-R224 PolarHBondContact N-O 3.37Å; Y206-R224 PolarHBondContact O-N 2.84Å; Y206-R224 VanDerWaalsContact OH-CD 3.23Å; Y206-R224 WeakPolarHBondContact OH-CD 3.24Å; Y206-Y226 AromaticContact CD1-CD2 3.97Å; Y206-Y226 HydrophobicContact CD1-CD2 3.97Å; Y206-Y226 AromaticContact CD1-CE2 3.6Å; Y206-Y226 HydrophobicContact CD1-CE2 3.6Å; Y206-Y226 AromaticContact CE1-CD2 3.76Å; Y206-Y226 HydrophobicContact CE1-CD2 3.76Å; Y206-Y226 AromaticContact CE1-CE2 3.27Å; Y206-Y226 HydrophobicContact CE1-CE2 3.27Å
207	P	96.1	Very high	91.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	129.2	179.7	34.4	-33.4	0	0	0	111.4	L183 W187 L191 W193 I223 F239	L183-P207 HydrophobicContact CD1-CG 3.97Å; W187-P207 HydrophobicContact CB-CB 3.8Å; W187-P207 HydrophobicContact CG-CB 3.98Å; L191-P207 HydrophobicContact CD2-CG 3.9Å; L191-P207 HydrophobicContact CG-CG 3.87Å; W193-P207 CarbonylContact C-O 3.51Å; W193-P207 HydrophobicContact CB-CG 4.21Å; W193-P207 PolarHBondContact N-O 2.95Å; P207-I223 HydrophobicContact CB-CG1 4.13Å; P207-F239 VanDerWaalsContact CD-CZ 3.46Å; P207-F239 HydrophobicContact CG-CE1 4.35Å; P207-F239 HydrophobicContact CG-CZ 4.29Å
208	V	94.3	Very high	90.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123.1	176.2	180	0	0	0	0	109.5	W187 Y206 T210 C215 P221 G222	W187-V208 PolarHBondContact NE1-O 2.58Å; W187-V208 VanDerWaalsContact NE1-O 3.13Å; Y206-V208 HydrophobicContact CD2-CG2 3.55Å; Y206-V208 HydrophobicContact CE2-CG2 3.63Å; V208-T210 VanDerWaalsContact CG1-O 3.23Å; V208-T210 WeakPolarHBondContact CG1-O 3.49Å; V208-C215 HydrophobicContact CG2-CB 4.3Å; V208-P221 CarbonylContact O-C 3.55Å; V208-P221 WeakPolarHBondContact O-CA 3.23Å; V208-G222 PolarHBondContact N-O 2.04Å; V208-G222 PolarHBondContact O-N 2.99Å
209	L	91.1	Very high	89.7	Confident	55 Å²	55	50.3 Å²	50.3	29%	0.288	30%	0.295	S	S	.	.	S	Bend	trans	-87.9	-49.9	170.7	-70.6	173.9	0	0	0	110.7	W187 G190 D192 P221	W187-L209 HydrophobicContact CG-CD2 4.5Å; W187-L209 HydrophobicContact CZ2-CD2 4.48Å; W187-L209 VanDerWaalsContact NE1-CD2 3.34Å; G190-L209 VanDerWaalsContact C-CD1 3.47Å; G190-L209 VanDerWaalsContact O-CD1 3.3Å; G190-L209 WeakPolarHBondContact O-CD1 3.47Å; D192-L209 HydrophobicContact CB-CB 4.02Å; D192-L209 HydrophobicContact CB-CD1 4.11Å; D192-L209 HydrophobicContact CB-CG 4.13Å; D192-L209 PolarHBondContact OD2-N 3.33Å; L209-P221 VanDerWaalsContact O-CB 3.32Å; L209-P221 WeakPolarHBondContact O-CB 3.47Å; L209-P221 VanDerWaalsContact O-CG 3.22Å; L209-P221 WeakPolarHBondContact O-CG 3.45Å
210	T	87.9	Confident	89.1	Confident	95 Å²	95	60.9 Å²	60.9	58%	0.583	34%	0.335	S	S	*	.	S	Bend	trans	-103.3	110.1	178.8	-56.4	0	0	0	0	110.7	D192 V208 R212	D192-T210 PolarHBondContact OD2-N 3.33Å; D192-T210 VanDerWaalsContact OD2-N 3.08Å; V208-T210 VanDerWaalsContact CG1-O 3.23Å; V208-T210 WeakPolarHBondContact CG1-O 3.49Å; T210-R212 PolarHBondContact O-N 3.45Å; T210-R212 PolarHBondContact O-NH1 3.29Å
211	A	84.1	Confident	88.9	Confident	37 Å²	37	62.2 Å²	62.2	31%	0.306	35%	0.346	S	S	.	.			trans	-60.2	122.9	176.2	0	0	0	0	0	110.5	G219	A211-G219 WeakPolarHBondContact CB-O 3.35Å
212	R	89.1	Confident	89	Confident	80 Å²	80	60.2 Å²	60.2	30%	0.302	34%	0.341	S	S	.	.			trans	-143.9	146	-176	58.5	-168.8	175.2	-85.6	3.9	110.2	D192 T210 P214 C215 G217	D192-R212 VanDerWaalsContact CG-NH1 3.25Å; D192-R212 IonicContact OD1-CZ 3.6Å; D192-R212 VanDerWaalsContact OD1-CZ 3.3Å; D192-R212 IonicContact OD1-NH1 2.69Å; D192-R212 PolarHBondContact OD1-NH1 3.46Å; D192-R212 IonicContact OD1-NH2 3.28Å; D192-R212 PolarHBondContact OD1-NH2 2.94Å; D192-R212 IonicContact OD2-CZ 2.79Å; D192-R212 IonicContact OD2-NH1 3.14Å; D192-R212 PolarHBondContact OD2-NH1 2.85Å; D192-R212 IonicContact OD2-NH2 3.97Å; T210-R212 PolarHBondContact O-N 3.45Å; T210-R212 PolarHBondContact O-NH1 3.29Å; R212-P214 VanDerWaalsContact C-CD 3.49Å; R212-C215 HydrophobicContact CG-CB 3.7Å; R212-C215 VanDerWaalsContact CG-SG 3.56Å; R212-C215 VanDerWaalsContact CZ-SG 3.54Å; R212-C215 PolarHBondContact NE-SG 3.2Å; R212-C215 CarbonylContact O-C 3.59Å; R212-C215 PolarHBondContact O-N 2.98Å; R212-G217 PolarHBondContact O-N 3.19Å
213	A	85.4	Confident	89	Confident	84 Å²	84	61.2 Å²	61.2	69%	0.694	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-52.1	-44.9	-172.2	0	0	0	0	0	114.1	C215 G217	A213-C215 PolarHBondContact O-N 3.27Å; A213-G217 PolarHBondContact O-N 3.03Å; A213-G217 VanDerWaalsContact O-N 3.09Å
214	P	87.6	Confident	88.9	Confident	115 Å²	115	62.5 Å²	62.5	75%	0.747	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-66.8	-16.2	178.8	-21.3	34.7	0	0	0	114.8	R212	R212-P214 VanDerWaalsContact C-CD 3.49Å
215	C	87.1	Confident	88.7	Confident	4 Å²	4	65.8 Å²	65.8	3%	0.027	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-112.3	48.7	-174.7	-52.8	0	0	0	0	110.9	C194 V208 R212 A213 R224	C194-C215 HydrophobicContact CB-CB 4.02Å; C194-C215 WeakPolarHBondContact CB-SG 3.24Å; C194-C215 WeakPolarHBondContact SG-CA 3.43Å; C194-C215 WeakPolarHBondContact SG-CB 3.47Å; C194-C215 CovalentContact SG-SG 2.02Å; C194-C215 PolarHBondContact SG-SG 3.36Å; V208-C215 HydrophobicContact CG2-CB 4.3Å; R212-C215 HydrophobicContact CG-CB 3.7Å; R212-C215 VanDerWaalsContact CG-SG 3.56Å; R212-C215 VanDerWaalsContact CZ-SG 3.54Å; R212-C215 PolarHBondContact NE-SG 3.2Å; R212-C215 CarbonylContact O-C 3.59Å; R212-C215 PolarHBondContact O-N 2.98Å; A213-C215 PolarHBondContact O-N 3.27Å; C215-R224 VanDerWaalsContact O-CZ 3.32Å; C215-R224 PolarHBondContact O-NH1 2.77Å; C215-R224 VanDerWaalsContact O-NH1 3.07Å
216	G	76.5	Confident	88.5	Confident	46 Å²	46	66.7 Å²	66.7	47%	0.474	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	26.8	177.5	0	0	0	0	0	114.8	R224	G216-R224 PolarHBondContact O-NH1 3.34Å
217	G	81.2	Confident	88.2	Confident	24 Å²	24	67.1 Å²	67.1	25%	0.247	38%	0.384	C	S	.	.	S	Bend	trans	79.6	-169.2	169.5	0	0	0	0	0	115.7	R212 A213	R212-G217 PolarHBondContact O-N 3.19Å; A213-G217 PolarHBondContact O-N 3.03Å; A213-G217 VanDerWaalsContact O-N 3.09Å
218	R	77.1	Confident	88	Confident	254 Å²	254	73.5 Å²	73.5	96%	0.958	43%	0.425	S	S	*	.	S	Bend	trans	-63.6	142.3	174.4	-62.9	-177.6	179.3	-176.6	-0.5	109.6
219	G	79.9	Confident	88.1	Confident	51 Å²	51	78 Å²	78	53%	0.526	44%	0.442	S	S	.	.			trans	167.9	-173.7	-179.7	0	0	0	0	0	112.6	A211	A211-G219 WeakPolarHBondContact CB-O 3.35Å
220	R	85.1	Confident	88.4	Confident	222 Å²	222	78.6 Å²	78.6	84%	0.838	45%	0.445	S	S	*	.			trans	-88.1	156.2	174.3	-64.8	-174.2	-178.9	-147	0.4	110.9
221	P	90.8	Very high	88.9	Confident	77 Å²	77	79.1 Å²	79.1	50%	0.5	44%	0.437	S	S	.	.	S	Bend	trans	-54	148.6	165.6	-21.9	32.3	0	0	0	111.1	W187 V208 L209	W187-P221 HydrophobicContact CZ2-CB 4.01Å; V208-P221 CarbonylContact O-C 3.55Å; V208-P221 WeakPolarHBondContact O-CA 3.23Å; L209-P221 VanDerWaalsContact O-CB 3.32Å; L209-P221 WeakPolarHBondContact O-CB 3.47Å; L209-P221 VanDerWaalsContact O-CG 3.22Å; L209-P221 WeakPolarHBondContact O-CG 3.45Å
222	G	93.3	Very high	89.5	Confident	16 Å²	16	83.6 Å²	83.6	17%	0.165	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.1	176.5	175.8	0	0	0	0	0	114	V208	V208-G222 PolarHBondContact N-O 2.04Å; V208-G222 PolarHBondContact O-N 2.99Å
223	I	95.4	Very high	89.9	Confident	30 Å²	30	89.4 Å²	89.4	15%	0.154	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	116.7	171	-61.7	179.6	0	0	0	109	Y180 L183 Y184 W187 R205 P207	Y180-I223 HydrophobicContact CD2-CD1 4.35Å; Y180-I223 HydrophobicContact CD2-CG2 4.47Å; Y180-I223 HydrophobicContact CE2-CB 4.07Å; Y180-I223 HydrophobicContact CE2-CD1 3.75Å; Y180-I223 HydrophobicContact CE2-CG1 4.49Å; Y180-I223 HydrophobicContact CE2-CG2 3.9Å; L183-I223 HydrophobicContact CB-CD1 4.28Å; L183-I223 HydrophobicContact CD2-CD1 4.03Å; L183-I223 HydrophobicContact CD2-CG2 3.94Å; L183-I223 HydrophobicContact CG-CD1 3.83Å; Y184-I223 VanDerWaalsContact CA-CD1 3.43Å; Y184-I223 HydrophobicContact CD2-CD1 4.15Å; W187-I223 HydrophobicContact CB-CD1 4.32Å; W187-I223 HydrophobicContact CB-CG1 4.3Å; W187-I223 HydrophobicContact CD2-CG1 4.49Å; W187-I223 HydrophobicContact CG-CG1 4.28Å; R205-I223 HydrophobicContact CB-CG2 3.7Å; R205-I223 HydrophobicContact CG-CG2 4.25Å; P207-I223 HydrophobicContact CB-CG1 4.13Å
224	R	93.9	Very high	90.5	Very high	45 Å²	45	87.7 Å²	87.7	17%	0.17	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	144.4	-179	-64.3	173.1	178.8	-135.6	6.1	109.6	R205 Y206 C215 G216	R205-R224 CarbonylContact C-O 3.57Å; R205-R224 WeakPolarHBondContact CA-O 3.49Å; R205-R224 WeakPolarHBondContact CB-O 3.38Å; Y206-R224 HydrophobicContact CD1-CB 3.84Å; Y206-R224 HydrophobicContact CD2-CB 4.42Å; Y206-R224 HydrophobicContact CE1-CB 3.31Å; Y206-R224 HydrophobicContact CE1-CG 4.39Å; Y206-R224 HydrophobicContact CE2-CB 4.02Å; Y206-R224 VanDerWaalsContact CE2-CD 3.47Å; Y206-R224 HydrophobicContact CE2-CG 4.32Å; Y206-R224 HydrophobicContact CG-CB 4.35Å; Y206-R224 VanDerWaalsContact CZ-CB 3.45Å; Y206-R224 PolarHBondContact N-O 3.37Å; Y206-R224 PolarHBondContact O-N 2.84Å; Y206-R224 VanDerWaalsContact OH-CD 3.23Å; Y206-R224 WeakPolarHBondContact OH-CD 3.24Å; C215-R224 VanDerWaalsContact O-CZ 3.32Å; C215-R224 PolarHBondContact O-NH1 2.77Å; C215-R224 VanDerWaalsContact O-NH1 3.07Å; G216-R224 PolarHBondContact O-NH1 3.34Å
225	S	93.8	Very high	91	Very high	69 Å²	69	87.6 Å²	87.6	48%	0.483	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	140.8	-177.2	-179.6	0	0	0	0	110.6	G227	S225-G227 VanDerWaalsContact C-N 3.25Å; S225-G227 PolarHBondContact OG-N 2.84Å
226	Y	92.8	Very high	91.5	Very high	77 Å²	77	88.3 Å²	88.3	30%	0.302	44%	0.441	S	S	.	.			trans	-86.6	4.3	169.4	-88.4	-119.3	0	0	0	112.1	A196 V204 Y206 R229 Y236	A196-Y226 HydrophobicContact CB-CD2 3.86Å; A196-Y226 HydrophobicContact CB-CE1 4.35Å; A196-Y226 HydrophobicContact CB-CE2 3.47Å; A196-Y226 VanDerWaalsContact CB-CE2 3.47Å; A196-Y226 HydrophobicContact CB-CG 4.44Å; V204-Y226 HydrophobicContact CG1-CD2 4.47Å; V204-Y226 HydrophobicContact CG1-CG 4.2Å; V204-Y226 PolarHBondContact O-N 2.78Å; Y206-Y226 AromaticContact CD1-CD2 3.97Å; Y206-Y226 HydrophobicContact CD1-CD2 3.97Å; Y206-Y226 AromaticContact CD1-CE2 3.6Å; Y206-Y226 HydrophobicContact CD1-CE2 3.6Å; Y206-Y226 AromaticContact CE1-CD2 3.76Å; Y206-Y226 HydrophobicContact CE1-CD2 3.76Å; Y206-Y226 AromaticContact CE1-CE2 3.27Å; Y206-Y226 HydrophobicContact CE1-CE2 3.27Å; Y226-R229 PolarHBondContact O-NE 3Å; Y226-R229 PolarHBondContact O-NH2 3.08Å; Y226-Y236 AromaticContact CD1-CE1 3.82Å; Y226-Y236 HydrophobicContact CD1-CE1 3.82Å; Y226-Y236 AromaticContact CE1-CE1 3.95Å; Y226-Y236 HydrophobicContact CE1-CE1 3.95Å
227	G	90.6	Very high	92.5	Very high	29 Å²	29	86.3 Å²	86.3	30%	0.299	42%	0.419	S	S	.	.			trans	73.2	-165.8	-176.6	0	0	0	0	0	112.9	S225	S225-G227 VanDerWaalsContact C-N 3.25Å; S225-G227 PolarHBondContact OG-N 2.84Å
228	P	92.1	Very high	93.3	Very high	133 Å²	133	85.2 Å²	85.2	86%	0.864	41%	0.408	S	S	*	.	S	Bend	trans	-59.1	137.2	174.7	-22.8	34.4	0	0	0	111.7
229	R	96.3	Very high	94.4	Very high	95 Å²	95	73.1 Å²	73.1	36%	0.358	36%	0.362	S	S	.	.			trans	-134.1	149.3	-179.2	-65.1	-63	163	175	-1.7	111.8	W198 V204 Y226 R231 D234 Y236	W198-R229 HydrophobicContact CH2-CB 3.71Å; W198-R229 HydrophobicContact CZ3-CB 4.03Å; V204-R229 HydrophobicContact CB-CG 4.13Å; V204-R229 HydrophobicContact CG2-CB 4.16Å; V204-R229 HydrophobicContact CG2-CG 3.89Å; Y226-R229 PolarHBondContact O-NE 3Å; Y226-R229 PolarHBondContact O-NH2 3.08Å; R229-R231 PolarHBondContact O-N 2.72Å; R229-D234 WeakPolarHBondContact CA-OD2 3.39Å; R229-D234 HydrophobicContact CB-CB 4.42Å; R229-D234 WeakPolarHBondContact CB-OD2 3.26Å; R229-D234 WeakPolarHBondContact CD-OD2 3.31Å; R229-Y236 HydrophobicContact CB-CE2 4.42Å; R229-Y236 WeakPolarHBondContact CD-OH 3.2Å; R229-Y236 HydrophobicContact CG-CE2 3.97Å; R229-Y236 PolarHBondContact NE-OH 3.1Å; R229-Y236 PolarHBondContact NH1-OH 3.14Å
230	D	96.9	Very high	95.3	Very high	67 Å²	67	70.7 Å²	70.7	36%	0.358	34%	0.337	S	S	.	.			trans	-77.8	110.9	175.7	-174.2	-45.2	0	0	0	109.1	M232 R233 D234	D230-M232 PolarHBondContact O-N 3.18Å; D230-M232 VanDerWaalsContact O-N 3.16Å; D230-M232 WeakPolarHBondContact OD1-CA 3.3Å; D230-M232 WeakPolarHBondContact OD1-CB 3.38Å; D230-M232 PolarHBondContact OD1-N 2.92Å; D230-R233 HydrophobicContact CB-CB 4.13Å; D230-R233 PolarHBondContact O-N 2.92Å; D230-R233 PolarHBondContact OD1-N 3.07Å; D230-R233 WeakPolarHBondContact OD2-CD 3.45Å; D230-R233 IonicContact OD2-NE 3.54Å; D230-D234 PolarHBondContact N-OD2 2.99Å; D230-D234 WeakPolarHBondContact O-CB 3.26Å; D230-D234 PolarHBondContact O-N 2.9Å
231	R	97	Very high	95.9	Very high	107 Å²	107	60.4 Å²	60.4	40%	0.404	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-21.5	-176.8	-69.2	-175.9	-178.2	175.6	-1.9	113.8	Y163 Y164 W198 E201 R229	Y163-R231 WeakPolarHBondContact CB-O 3.42Å; Y163-R231 HydrophobicContact CD1-CB 4.37Å; Y163-R231 HydrophobicContact CD1-CG 4.39Å; Y163-R231 HydrophobicContact CG-CB 4.23Å; Y163-R231 HydrophobicContact CG-CG 4.11Å; Y163-R231 PolarHBondContact N-O 3.09Å; Y163-R231 VanDerWaalsContact N-O 3.14Å; Y164-R231 HydrophobicContact CE2-CB 4.42Å; W198-R231 HydrophobicContact CZ3-CG 4.32Å; E201-R231 PolarHBondContact O-NH2 3.48Å; R229-R231 PolarHBondContact O-N 2.72Å
232	M	97.4	Very high	96.2	Very high	130 Å²	130	56.7 Å²	56.7	64%	0.64	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-35.1	-179.3	-66.9	-175.9	179	0	0	112.6	Y164 D230	Y164-M232 HydrophobicContact CE2-CE 4.44Å; Y164-M232 HydrophobicContact CE2-CG 3.93Å; D230-M232 PolarHBondContact O-N 3.18Å; D230-M232 VanDerWaalsContact O-N 3.16Å; D230-M232 WeakPolarHBondContact OD1-CA 3.3Å; D230-M232 WeakPolarHBondContact OD1-CB 3.38Å; D230-M232 PolarHBondContact OD1-N 2.92Å
233	R	97.1	Very high	96.4	Very high	203 Å²	203	56 Å²	56	77%	0.766	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-40.4	-169.6	-60.9	-179.1	179	180	-0.2	114.1	D230	D230-R233 HydrophobicContact CB-CB 4.13Å; D230-R233 PolarHBondContact O-N 2.92Å; D230-R233 PolarHBondContact OD1-N 3.07Å; D230-R233 WeakPolarHBondContact OD2-CD 3.45Å; D230-R233 IonicContact OD2-NE 3.54Å
234	D	97.9	Very high	96.3	Very high	48 Å²	48	55.7 Å²	55.7	26%	0.257	27%	0.269	S	S	.	.			trans	-73.7	147.8	-176.8	-68.5	-31.6	0	0	0	110.4	N162 W198 R229 D230 Y236	N162-D234 WeakPolarHBondContact CA-O 3.39Å; W198-D234 HydrophobicContact CH2-CB 4.4Å; W198-D234 HydrophobicContact CZ2-CB 4.2Å; W198-D234 WeakPolarHBondContact CZ2-O 3.32Å; R229-D234 WeakPolarHBondContact CA-OD2 3.39Å; R229-D234 HydrophobicContact CB-CB 4.42Å; R229-D234 WeakPolarHBondContact CB-OD2 3.26Å; R229-D234 WeakPolarHBondContact CD-OD2 3.31Å; D230-D234 PolarHBondContact N-OD2 2.99Å; D230-D234 WeakPolarHBondContact O-CB 3.26Å; D230-D234 PolarHBondContact O-N 2.9Å; D234-Y236 HydrophobicContact CB-CD2 4.37Å; D234-Y236 HydrophobicContact CB-CE2 3.69Å
235	R	98.1	Very high	96.1	Very high	113 Å²	113	55 Å²	55	43%	0.426	27%	0.268	S	S	.	.			trans	-126.7	133.9	-177.4	-62	-173.8	172.2	-85.1	-8.3	112.1	Y159 Q160 F161 E165	Y159-R235 WeakPolarHBondContact O-CB 3.29Å; Q160-R235 PolarHBondContact O-NH1 3.08Å; F161-R235 CarbonylContact O-C 3.55Å; F161-R235 VanDerWaalsContact O-CA 3.23Å; F161-R235 WeakPolarHBondContact O-CA 3.39Å; E165-R235 IonicContact OE1-NH1 2.71Å; E165-R235 IonicContact OE1-NH2 3.12Å; E165-R235 IonicContact OE2-CZ 3.69Å; E165-R235 IonicContact OE2-NH1 3.75Å; E165-R235 PolarHBondContact OE2-NH1 2.96Å; E165-R235 IonicContact OE2-NH2 3.36Å
236	Y	98.1	Very high	95.9	Very high	19 Å²	19	55.4 Å²	55.4	8%	0.075	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-148.6	-177.9	-176.8	-63.3	-71.2	0	0	0	110.9	Y159 Q160 F161 A196 W198 V204 Y226 R229 D234	Y159-Y236 HydrophobicContact CD1-CD1 4.24Å; Y159-Y236 HydrophobicContact CE1-CD1 4.42Å; Q160-Y236 PolarHBondContact N-O 3.42Å; F161-Y236 WeakPolarHBondContact CB-O 3.42Å; F161-Y236 PolarHBondContact N-O 2.94Å; F161-Y236 PolarHBondContact O-N 3.28Å; A196-Y236 HydrophobicContact CB-CD1 3.82Å; A196-Y236 HydrophobicContact CB-CE1 4.29Å; W198-Y236 HydrophobicContact CD2-CD2 4.48Å; W198-Y236 AromaticContact CE2-CD2 3.75Å; W198-Y236 HydrophobicContact CH2-CD2 4.37Å; W198-Y236 AromaticContact CZ2-CD2 3.7Å; W198-Y236 HydrophobicContact CZ2-CD2 3.7Å; W198-Y236 HydrophobicContact CZ2-CE2 4.22Å; W198-Y236 AromaticContact NE1-CD2 3.92Å; V204-Y236 HydrophobicContact CB-CD2 4.2Å; V204-Y236 HydrophobicContact CB-CE2 4.27Å; V204-Y236 HydrophobicContact CG1-CD1 3.78Å; V204-Y236 HydrophobicContact CG1-CD2 3.69Å; V204-Y236 HydrophobicContact CG1-CE1 4.02Å; V204-Y236 HydrophobicContact CG1-CE2 3.91Å; V204-Y236 HydrophobicContact CG1-CG 3.61Å; V204-Y236 HydrophobicContact CG2-CD2 3.52Å; V204-Y236 HydrophobicContact CG2-CE2 3.76Å; V204-Y236 HydrophobicContact CG2-CG 4.21Å; Y226-Y236 AromaticContact CD1-CE1 3.82Å; Y226-Y236 HydrophobicContact CD1-CE1 3.82Å; Y226-Y236 AromaticContact CE1-CE1 3.95Å; Y226-Y236 HydrophobicContact CE1-CE1 3.95Å; R229-Y236 HydrophobicContact CB-CE2 4.42Å; R229-Y236 WeakPolarHBondContact CD-OH 3.2Å; R229-Y236 HydrophobicContact CG-CE2 3.97Å; R229-Y236 PolarHBondContact NE-OH 3.1Å; R229-Y236 PolarHBondContact NH1-OH 3.14Å; D234-Y236 HydrophobicContact CB-CD2 4.37Å; D234-Y236 HydrophobicContact CB-CE2 3.69Å
237	D	98	Very high	96	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.016	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-168.2	168.7	-68.5	-9.1	0	0	0	109.2	Y152 R158 Y159 N195 A196 G197 W198	Y152-D237 WeakPolarHBondContact O-CB 3.36Å; R158-D237 WeakPolarHBondContact CA-OD1 3.3Å; Y159-D237 PolarHBondContact N-OD1 3.25Å; N195-D237 WeakPolarHBondContact CB-OD2 3.4Å; N195-D237 PolarHBondContact ND2-OD2 3.3Å; A196-D237 WeakPolarHBondContact O-CB 3.19Å; A196-D237 PolarHBondContact O-N 3.11Å; G197-D237 CarbonylContact C-O 3.46Å; G197-D237 WeakPolarHBondContact CA-O 3.2Å; W198-D237 PolarHBondContact N-O 2.99Å
238	A	98.6	Very high	96.3	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.008	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	145.3	173.1	0	0	0	0	0	111.1	Y152 A166 L177	Y152-A238 PolarHBondContact N-O 2.9Å; Y152-A238 PolarHBondContact O-N 3.3Å; A166-A238 HydrophobicContact CB-CB 3.95Å; L177-A238 HydrophobicContact CD2-CB 4.03Å
239	F	98.8	Very high	96.6	Very high	1 Å²	1	50.7 Å²	50.7	0%	0.004	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	113.8	159	-72.6	-77.3	0	0	0	107.9	V149 P151 A178 L183 L191 W193 W198 L199 R205 P207	V149-F239 HydrophobicContact CG1-CB 4.07Å; V149-F239 HydrophobicContact CG1-CD1 4.05Å; V149-F239 HydrophobicContact CG1-CG 4.49Å; P151-F239 HydrophobicContact CB-CD1 4.25Å; P151-F239 HydrophobicContact CB-CE1 3.96Å; A178-F239 HydrophobicContact CB-CB 4.23Å; A178-F239 WeakPolarHBondContact CB-O 3.24Å; A178-F239 PolarHBondContact N-O 2.87Å; L183-F239 HydrophobicContact CD1-CB 4.4Å; L183-F239 HydrophobicContact CD1-CD1 3.73Å; L183-F239 HydrophobicContact CD1-CD2 4.25Å; L183-F239 HydrophobicContact CD1-CE1 4.01Å; L183-F239 HydrophobicContact CD1-CG 3.85Å; L183-F239 HydrophobicContact CD1-CZ 4.41Å; L183-F239 HydrophobicContact CD2-CD2 4.46Å; L191-F239 HydrophobicContact CD2-CD1 4.49Å; L191-F239 HydrophobicContact CD2-CE1 4.28Å; W193-F239 HydrophobicContact CB-CE1 4.15Å; W193-F239 HydrophobicContact CB-CZ 4.16Å; W193-F239 AromaticContact CD1-CZ 3.75Å; W193-F239 HydrophobicContact CG-CE1 4.23Å; W193-F239 HydrophobicContact CG-CZ 4.23Å; W198-F239 PolarHBondContact O-N 2.88Å; L199-F239 HydrophobicContact CD2-CB 3.85Å; L199-F239 HydrophobicContact CD2-CD2 4.36Å; L199-F239 HydrophobicContact CD2-CG 4.46Å; R205-F239 VanDerWaalsContact O-CE2 3.26Å; R205-F239 WeakPolarHBondContact O-CE2 3.49Å; P207-F239 VanDerWaalsContact CD-CZ 3.46Å; P207-F239 HydrophobicContact CG-CE1 4.35Å; P207-F239 HydrophobicContact CG-CZ 4.29Å
240	C	98.8	Very high	96.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	151.7	179.5	-55.9	0	0	0	0	110.1	V149 F150 C170 R176	V149-C240 CarbonylContact C-O 3.58Å; V149-C240 VanDerWaalsContact CA-O 3.23Å; V149-C240 WeakPolarHBondContact CA-O 3.4Å; F150-C240 HydrophobicContact CD1-CB 4.08Å; F150-C240 HydrophobicContact CD2-CB 3.9Å; F150-C240 HydrophobicContact CE1-CB 3.61Å; F150-C240 HydrophobicContact CE2-CB 3.43Å; F150-C240 VanDerWaalsContact CE2-CB 3.43Å; F150-C240 HydrophobicContact CG-CB 4.21Å; F150-C240 HydrophobicContact CZ-CB 3.28Å; F150-C240 PolarHBondContact N-O 3.06Å; F150-C240 PolarHBondContact O-N 2.98Å; C170-C240 WeakPolarHBondContact CA-SG 3.46Å; C170-C240 HydrophobicContact CB-CB 3.74Å; C170-C240 WeakPolarHBondContact CB-SG 3.11Å; C170-C240 WeakPolarHBondContact SG-CA 3.44Å; C170-C240 WeakPolarHBondContact SG-CB 3.29Å; C170-C240 CovalentContact SG-SG 2.04Å; C170-C240 PolarHBondContact SG-SG 3.46Å; R176-C240 CarbonylContact O-C 3.52Å; R176-C240 VanDerWaalsContact O-CA 3.24Å; R176-C240 WeakPolarHBondContact O-CA 3.36Å
241	F	98.5	Very high	96.7	Very high	5 Å²	5	47.5 Å²	47.5	2%	0.022	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	135	175.6	172.4	-94.4	0	0	0	109.4	L120 L145 G147 V148 V149 G175 R176 A178 Q182	L120-F241 HydrophobicContact CD2-CD1 4.12Å; L120-F241 HydrophobicContact CD2-CE1 3.89Å; L145-F241 HydrophobicContact CB-CE1 4.15Å; L145-F241 HydrophobicContact CB-CZ 4Å; G147-F241 VanDerWaalsContact CA-CE2 3.42Å; V148-F241 WeakPolarHBondContact O-CA 3.26Å; V149-F241 HydrophobicContact CG2-CD2 4.15Å; G175-F241 CarbonylContact C-O 3.56Å; G175-F241 WeakPolarHBondContact CA-O 3.32Å; R176-F241 HydrophobicContact CG-CD1 4.43Å; R176-F241 PolarHBondContact N-O 2.95Å; R176-F241 PolarHBondContact O-N 3.47Å; A178-F241 HydrophobicContact CB-CB 3.97Å; Q182-F241 HydrophobicContact CB-CD2 4.21Å; Q182-F241 HydrophobicContact CG-CD2 3.99Å; Q182-F241 HydrophobicContact CG-CE2 4.05Å; Q182-F241 VanDerWaalsContact NE2-CD1 3.33Å; Q182-F241 VanDerWaalsContact NE2-CD2 3.31Å
242	T	97.8	Very high	96.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	169.7	171.2	-168.3	0	0	0	0	110.5	R49 G147 V148 F150 D174 A280	R49-T242 PolarHBondContact NH2-OG1 3.17Å; G147-T242 CarbonylContact C-O 3.57Å; G147-T242 WeakPolarHBondContact CA-O 3.03Å; V148-T242 HydrophobicContact CG1-CG2 3.64Å; V148-T242 PolarHBondContact N-O 2.91Å; V148-T242 PolarHBondContact O-N 2.82Å; F150-T242 HydrophobicContact CD1-CG2 4.25Å; F150-T242 HydrophobicContact CE1-CG2 3.92Å; D174-T242 WeakPolarHBondContact O-CB 3.43Å; D174-T242 PolarHBondContact O-OG1 2.99Å; T242-A280 HydrophobicContact CG2-CB 4.08Å
243	S	96.3	Very high	96.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	-177.2	-177.5	-173.1	0	0	0	0	109.7	R49 E146 A280	R49-S243 PolarHBondContact N-OG 3.47Å; E146-S243 WeakPolarHBondContact O-CB 3.49Å; E146-S243 PolarHBondContact O-OG 2.86Å; S243-A280 WeakPolarHBondContact O-CB 3.38Å
244	A	92.9	Very high	96.8	Very high	24 Å²	24	33.5 Å²	33.5	20%	0.198	19%	0.193	C	C	.	.			trans	-52.9	142.8	177.2	0	0	0	0	0	111.8	F284	A244-F284 HydrophobicContact CB-CD2 4.26Å; A244-F284 HydrophobicContact CB-CG 4.26Å
245	L	91.4	Very high	96.8	Very high	30 Å²	30	40.4 Å²	40.4	16%	0.157	22%	0.215	C	C	.	.			trans	-85.1	148.9	-179.6	-57.8	174.4	0	0	0	110.5	G247 V249 H277 A280 A281 Y337	L245-G247 VanDerWaalsContact C-N 3.33Å; L245-V249 HydrophobicContact CD1-CG2 3.75Å; L245-H277 HydrophobicContact CD1-CB 4.11Å; L245-H277 HydrophobicContact CD2-CB 4.49Å; L245-A280 HydrophobicContact CD1-CB 4.04Å; L245-A280 HydrophobicContact CD2-CB 3.82Å; L245-A280 HydrophobicContact CG-CB 3.61Å; L245-A281 HydrophobicContact CD1-CB 4.48Å; L245-Y337 HydrophobicContact CB-CE2 4.16Å; L245-Y337 HydrophobicContact CD1-CD2 4.18Å; L245-Y337 HydrophobicContact CD1-CE2 3.9Å; L245-Y337 HydrophobicContact CD2-CE2 4.49Å; L245-Y337 HydrophobicContact CG-CE2 4.41Å
246	A	89.6	Confident	96.8	Very high	79 Å²	79	36.3 Å²	36.3	65%	0.653	20%	0.202	S	C	*	.	S	Bend	trans	-76.2	-24.5	168.2	0	0	0	0	0	112.2	N340	A246-N340 WeakPolarHBondContact O-CB 3.19Å; A246-N340 VanDerWaalsContact O-CG 3.28Å; A246-N340 PolarHBondContact O-ND2 3.42Å
247	G	93.5	Very high	96.8	Very high	10 Å²	10	36.6 Å²	36.6	10%	0.103	21%	0.206	C	C	.	.	S	Bend	trans	-112.5	-161.7	179.4	0	0	0	0	0	113.9	L245 Y337 A338	L245-G247 VanDerWaalsContact C-N 3.33Å; G247-Y337 PolarHBondContact N-OH 3.49Å; G247-A338 CarbonylContact C-O 3.6Å; G247-A338 VanDerWaalsContact CA-O 3.24Å; G247-A338 WeakPolarHBondContact CA-O 3.4Å
248	Q	96.6	Very high	96.8	Very high	114 Å²	114	37.8 Å²	37.8	53%	0.533	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.4	-176.8	62.1	179	-11.6	0	0	112.9	Y337 A338	Q248-Y337 WeakPolarHBondContact O-CA 3.28Å; Q248-Y337 WeakPolarHBondContact O-CD2 3.43Å; Q248-A338 HydrophobicContact CG-CB 4.45Å; Q248-A338 PolarHBondContact N-O 3.39Å; Q248-A338 PolarHBondContact O-N 3.39Å
249	V	98.4	Very high	96.8	Very high	16 Å²	16	42 Å²	42	10%	0.097	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	129.8	170.8	178.8	0	0	0	0	109.2	L245 A273 H277 L278 A281 L287 Y335 C336 Y337	L245-V249 HydrophobicContact CD1-CG2 3.75Å; V249-A273 HydrophobicContact CG1-CB 4.26Å; V249-H277 HydrophobicContact CG2-CB 3.82Å; V249-L278 HydrophobicContact CG1-CD1 4.49Å; V249-A281 HydrophobicContact CB-CB 3.64Å; V249-A281 HydrophobicContact CG1-CB 4.39Å; V249-A281 HydrophobicContact CG2-CB 3.77Å; V249-L287 HydrophobicContact CB-CD2 4.25Å; V249-L287 HydrophobicContact CG1-CD2 3.82Å; V249-Y335 HydrophobicContact CG1-CD1 4.2Å; V249-C336 CarbonylContact C-O 3.57Å; V249-C336 VanDerWaalsContact CA-O 3.27Å; V249-C336 WeakPolarHBondContact CA-O 3.33Å; V249-Y337 HydrophobicContact CG2-CD2 3.91Å
250	F	98.3	Very high	96.8	Very high	56 Å²	56	46.4 Å²	46.4	25%	0.246	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	152.9	176.9	62.4	-89.5	0	0	0	111.3	V252 R268 A270 Y335 C336 A338	F250-V252 HydrophobicContact CD2-CG2 4.03Å; F250-V252 HydrophobicContact CE2-CG2 3.73Å; F250-R268 HydrophobicContact CZ-CB 4.28Å; F250-A270 HydrophobicContact CE1-CB 3.99Å; F250-A270 HydrophobicContact CZ-CB 3.76Å; F250-Y335 WeakPolarHBondContact O-CA 3.47Å; F250-C336 HydrophobicContact CD1-CB 4.43Å; F250-C336 HydrophobicContact CD2-CB 4.19Å; F250-C336 HydrophobicContact CE1-CB 3.91Å; F250-C336 HydrophobicContact CE2-CB 3.64Å; F250-C336 HydrophobicContact CZ-CB 3.49Å; F250-C336 VanDerWaalsContact CZ-CB 3.49Å; F250-C336 PolarHBondContact N-O 3.07Å; F250-C336 PolarHBondContact O-N 3.09Å; F250-A338 HydrophobicContact CE1-CB 4.12Å
251	F	98.6	Very high	96.8	Very high	39 Å²	39	46.4 Å²	46.4	17%	0.171	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	136.5	-179.9	-178.7	-111.4	0	0	0	111.3	P253 Q289 D291 T334 Y335	F251-P253 HydrophobicContact CD1-CB 4.46Å; F251-P253 HydrophobicContact CE1-CB 3.88Å; F251-Q289 HydrophobicContact CB-CG 4.28Å; F251-Q289 HydrophobicContact CD1-CG 4.1Å; F251-Q289 HydrophobicContact CD2-CG 4.32Å; F251-Q289 HydrophobicContact CG-CG 3.99Å; F251-D291 HydrophobicContact CE1-CB 3.85Å; F251-D291 HydrophobicContact CE2-CB 4.16Å; F251-D291 HydrophobicContact CZ-CB 3.48Å; F251-D291 VanDerWaalsContact CZ-CB 3.48Å; F251-T334 WeakPolarHBondContact CD2-O 3.41Å; F251-Y335 HydrophobicContact CB-CD1 4.15Å; F251-Y335 HydrophobicContact CB-CE1 3.96Å; F251-Y335 HydrophobicContact CD2-CD1 4.06Å; F251-Y335 HydrophobicContact CD2-CD2 4.32Å; F251-Y335 AromaticContact CD2-CE1 3.75Å; F251-Y335 HydrophobicContact CD2-CE1 3.75Å; F251-Y335 AromaticContact CD2-CE2 3.98Å; F251-Y335 HydrophobicContact CD2-CE2 3.98Å; F251-Y335 HydrophobicContact CD2-CG 4.34Å; F251-Y335 AromaticContact CD2-CZ 3.68Å; F251-Y335 HydrophobicContact CE2-CE2 4.27Å; F251-Y335 HydrophobicContact CG-CE1 4.23Å
252	V	98.5	Very high	96.8	Very high	8 Å²	8	49.5 Å²	49.5	5%	0.048	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	112.3	170.4	179.9	0	0	0	0	108.2	F250 A264 G333 T334 C336	F250-V252 HydrophobicContact CD2-CG2 4.03Å; F250-V252 HydrophobicContact CE2-CG2 3.73Å; V252-A264 HydrophobicContact CG1-CB 4.31Å; V252-G333 CarbonylContact O-C 3.59Å; V252-G333 VanDerWaalsContact O-CA 3.31Å; V252-G333 WeakPolarHBondContact O-CA 3.42Å; V252-T334 HydrophobicContact CB-CG2 3.87Å; V252-T334 HydrophobicContact CG2-CG2 4.48Å; V252-T334 PolarHBondContact N-O 2.69Å; V252-T334 PolarHBondContact O-N 3.29Å; V252-C336 VanDerWaalsContact CG2-SG 3.55Å
253	P	97.9	Very high	96.8	Very high	98 Å²	98	50.5 Å²	50.5	64%	0.636	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	154.5	-179.6	30.2	-35.2	0	0	0	111.5	F251	F251-P253 HydrophobicContact CD1-CB 4.46Å; F251-P253 HydrophobicContact CE1-CB 3.88Å
254	G	96.1	Very high	96.9	Very high	39 Å²	39	50.6 Å²	50.6	40%	0.402	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	153.4	177.7	175.8	0	0	0	0	0	112.3	Y332 G333	G254-Y332 CarbonylContact O-C 3.1Å; G254-Y332 VanDerWaalsContact O-O 3.11Å; G254-G333 PolarHBondContact O-N 3.36Å
255	R	97.8	Very high	97.2	Very high	193 Å²	193	49.5 Å²	49.5	73%	0.728	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.3	80.2	169.2	-71.1	-175.7	71	174.8	7.8	107.3	A330	R255-A330 WeakPolarHBondContact CB-O 3.32Å; R255-A330 PolarHBondContact NE-O 2.61Å
256	L	98.2	Very high	97.5	Very high	27 Å²	27	56.2 Å²	56.2	14%	0.141	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	143.2	-170.4	-53.6	175.6	0	0	0	109.7	E260 A261 A264 W294 Y332 T334	L256-E260 HydrophobicContact CB-CB 4.07Å; L256-E260 HydrophobicContact CD2-CB 4.15Å; L256-A261 HydrophobicContact CB-CB 4.5Å; L256-A264 HydrophobicContact CD1-CB 4.03Å; L256-W294 PolarHBondContact O-NE1 2.82Å; L256-Y332 WeakPolarHBondContact CB-O 3.45Å; L256-Y332 PolarHBondContact N-O 2.79Å; L256-T334 HydrophobicContact CD1-CG2 4.02Å
257	T	98.4	Very high	97.9	Very high	26 Å²	26	60.8 Å²	60.8	16%	0.16	30%	0.3	C	S	.	.			trans	-70.5	166.4	156.8	62.2	0	0	0	0	110.3	S259 E260 A261 P327 Q328 A330	T257-S259 VanDerWaalsContact C-N 3.26Å; T257-S259 PolarHBondContact O-N 3.4Å; T257-E260 WeakPolarHBondContact CB-OE2 3.35Å; T257-E260 WeakPolarHBondContact CG2-OE2 3.44Å; T257-E260 PolarHBondContact N-OE2 3.5Å; T257-E260 PolarHBondContact O-N 3.02Å; T257-E260 WeakPolarHBondContact OG1-CB 3.34Å; T257-E260 VanDerWaalsContact OG1-CD 3.3Å; T257-E260 VanDerWaalsContact OG1-CG 3.26Å; T257-E260 WeakPolarHBondContact OG1-CG 3.43Å; T257-E260 PolarHBondContact OG1-N 2.96Å; T257-E260 PolarHBondContact OG1-OE2 3.34Å; T257-A261 PolarHBondContact O-N 3.44Å; T257-P327 WeakPolarHBondContact CB-O 3.21Å; T257-Q328 WeakPolarHBondContact CG2-O 3.09Å; T257-A330 HydrophobicContact CG2-CB 4Å
258	L	98.1	Very high	98.1	Very high	28 Å²	28	66.8 Å²	66.8	15%	0.147	32%	0.32	C	S	.	.	H	α-helix	trans	-60.3	-36.8	177.8	-178.2	59.8	0	0	0	112.1	A261 H262 W294 P327	L258-A261 WeakPolarHBondContact O-CB 3.34Å; L258-A261 PolarHBondContact O-N 2.88Å; L258-H262 PolarHBondContact O-N 2.88Å; L258-H262 PolarHBondContact O-ND1 2.74Å; L258-W294 HydrophobicContact CB-CD2 4.23Å; L258-W294 HydrophobicContact CB-CE3 4.21Å; L258-W294 HydrophobicContact CB-CZ3 4.37Å; L258-W294 HydrophobicContact CD1-CB 4.03Å; L258-W294 HydrophobicContact CD1-CD2 4Å; L258-W294 HydrophobicContact CD1-CE3 3.78Å; L258-W294 HydrophobicContact CD1-CG 4.14Å; L258-W294 HydrophobicContact CG-CE3 4.46Å; L258-P327 HydrophobicContact CB-CB 4.09Å; L258-P327 HydrophobicContact CD2-CB 4.22Å; L258-P327 PolarHBondContact N-O 2.92Å
259	S	98.3	Very high	98.2	Very high	90 Å²	90	64.8 Å²	64.8	63%	0.629	33%	0.33	S	S	*	.	H	α-helix	trans	-67.1	-42.3	177.2	-174.9	0	0	0	0	111.8	T257 A261 H262 A263	T257-S259 VanDerWaalsContact C-N 3.26Å; T257-S259 PolarHBondContact O-N 3.4Å; S259-A261 VanDerWaalsContact C-N 3.33Å; S259-A261 PolarHBondContact O-N 3.39Å; S259-H262 WeakPolarHBondContact O-CB 3.37Å; S259-H262 PolarHBondContact O-N 3.41Å; S259-A263 PolarHBondContact O-N 2.86Å
260	E	98.6	Very high	98.2	Very high	92 Å²	92	64.2 Å²	64.2	43%	0.43	33%	0.327	S	S	.	.	H	α-helix	trans	-67.2	-34.6	176.8	-71	166.5	144.5	0	0	112.2	L256 T257 A263 A264	L256-E260 HydrophobicContact CB-CB 4.07Å; L256-E260 HydrophobicContact CD2-CB 4.15Å; T257-E260 WeakPolarHBondContact CB-OE2 3.35Å; T257-E260 WeakPolarHBondContact CG2-OE2 3.44Å; T257-E260 PolarHBondContact N-OE2 3.5Å; T257-E260 PolarHBondContact O-N 3.02Å; T257-E260 WeakPolarHBondContact OG1-CB 3.34Å; T257-E260 VanDerWaalsContact OG1-CD 3.3Å; T257-E260 VanDerWaalsContact OG1-CG 3.26Å; T257-E260 WeakPolarHBondContact OG1-CG 3.43Å; T257-E260 PolarHBondContact OG1-N 2.96Å; T257-E260 PolarHBondContact OG1-OE2 3.34Å; E260-A263 CarbonylContact O-C 3.51Å; E260-A263 PolarHBondContact O-N 2.88Å; E260-A264 VanDerWaalsContact O-CB 3.3Å; E260-A264 WeakPolarHBondContact O-CB 3.3Å; E260-A264 PolarHBondContact O-N 2.86Å
261	A	98.6	Very high	98.2	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-57.4	-48	171.1	0	0	0	0	0	111.5	L256 T257 L258 S259 A263 A264 C265 W294 T334	L256-A261 HydrophobicContact CB-CB 4.5Å; T257-A261 PolarHBondContact O-N 3.44Å; L258-A261 WeakPolarHBondContact O-CB 3.34Å; L258-A261 PolarHBondContact O-N 2.88Å; S259-A261 VanDerWaalsContact C-N 3.33Å; S259-A261 PolarHBondContact O-N 3.39Å; A261-A263 VanDerWaalsContact C-N 3.33Å; A261-A263 PolarHBondContact O-N 2.88Å; A261-A264 PolarHBondContact O-N 2.75Å; A261-A264 VanDerWaalsContact O-N 3.13Å; A261-C265 PolarHBondContact O-N 2.81Å; A261-W294 HydrophobicContact CB-CB 3.88Å; A261-W294 HydrophobicContact CB-CG 4.09Å; A261-T334 HydrophobicContact CB-CG2 3.99Å
262	H	98.6	Very high	98.2	Very high	70 Å²	70	64.2 Å²	64.2	32%	0.324	33%	0.334	S	S	.	.	H	α-helix	trans	-60.4	-40.8	174.4	-74	82.6	0	0	0	112.5	L258 S259 R266 V272	L258-H262 PolarHBondContact O-N 2.88Å; L258-H262 PolarHBondContact O-ND1 2.74Å; S259-H262 WeakPolarHBondContact O-CB 3.37Å; S259-H262 PolarHBondContact O-N 3.41Å; H262-R266 WeakPolarHBondContact O-CB 3.35Å; H262-R266 VanDerWaalsContact O-CG 3.31Å; H262-R266 WeakPolarHBondContact O-CG 3.41Å; H262-R266 PolarHBondContact O-N 3.28Å; H262-R266 VanDerWaalsContact O-N 3.13Å; H262-R266 PolarHBondContact O-NE 3.4Å; H262-V272 HydrophobicContact CB-CG2 4.15Å
263	A	98.5	Very high	98.2	Very high	22 Å²	22	63.8 Å²	63.8	18%	0.182	33%	0.332	C	S	.	.	H	α-helix	trans	-66.3	-37.7	175.2	0	0	0	0	0	112.1	S259 E260 A261 R266 R267	S259-A263 PolarHBondContact O-N 2.86Å; E260-A263 CarbonylContact O-C 3.51Å; E260-A263 PolarHBondContact O-N 2.88Å; A261-A263 VanDerWaalsContact C-N 3.33Å; A261-A263 PolarHBondContact O-N 2.88Å; A263-R266 PolarHBondContact O-N 2.86Å; A263-R267 WeakPolarHBondContact O-CG 3.37Å; A263-R267 PolarHBondContact O-N 2.87Å
264	A	98.4	Very high	98.2	Very high	2 Å²	2	62.5 Å²	62.5	2%	0.017	32%	0.316	C	S	.	.	H	α-helix	trans	-67.5	-39.7	-178.7	0	0	0	0	0	113.1	V252 L256 E260 A261 R268 T334	V252-A264 HydrophobicContact CG1-CB 4.31Å; L256-A264 HydrophobicContact CD1-CB 4.03Å; E260-A264 VanDerWaalsContact O-CB 3.3Å; E260-A264 WeakPolarHBondContact O-CB 3.3Å; E260-A264 PolarHBondContact O-N 2.86Å; A261-A264 PolarHBondContact O-N 2.75Å; A261-A264 VanDerWaalsContact O-N 3.13Å; A264-R268 PolarHBondContact O-NH1 2.79Å; A264-T334 HydrophobicContact CB-CG2 4.4Å
265	C	98.6	Very high	98.4	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-68.6	-45.9	172.4	-61.7	0	0	0	0	111.4	A261 R267 R268 G269 A270 V272 C336	A261-C265 PolarHBondContact O-N 2.81Å; C265-R267 VanDerWaalsContact C-N 3.32Å; C265-R267 PolarHBondContact O-N 2.85Å; C265-R268 CarbonylContact O-C 3.32Å; C265-R268 WeakPolarHBondContact O-CA 3.41Å; C265-R268 WeakPolarHBondContact O-CB 3.47Å; C265-R268 PolarHBondContact O-N 2.71Å; C265-G269 PolarHBondContact O-N 3.3Å; C265-A270 CarbonylContact C-O 3.39Å; C265-A270 HydrophobicContact CB-CB 4.3Å; C265-A270 PolarHBondContact O-N 2.89Å; C265-A270 VanDerWaalsContact O-O 3.08Å; C265-V272 HydrophobicContact CB-CG2 4.38Å; C265-C336 WeakPolarHBondContact CA-SG 3.46Å; C265-C336 HydrophobicContact CB-CB 3.76Å; C265-C336 WeakPolarHBondContact CB-SG 3.47Å; C265-C336 VanDerWaalsContact SG-CA 3.53Å; C265-C336 WeakPolarHBondContact SG-CB 3.23Å; C265-C336 CovalentContact SG-SG 2.03Å; C265-C336 PolarHBondContact SG-SG 3.23Å
266	R	98.5	Very high	98.4	Very high	172 Å²	172	51.5 Å²	51.5	65%	0.649	26%	0.262	S	S	*	.	H	α-helix	trans	-58.8	-40.4	179.9	-78.4	-173.1	-64.5	157.8	-2.6	113.1	H262 A263 R268 G269 A270	H262-R266 WeakPolarHBondContact O-CB 3.35Å; H262-R266 VanDerWaalsContact O-CG 3.31Å; H262-R266 WeakPolarHBondContact O-CG 3.41Å; H262-R266 PolarHBondContact O-N 3.28Å; H262-R266 VanDerWaalsContact O-N 3.13Å; H262-R266 PolarHBondContact O-NE 3.4Å; A263-R266 PolarHBondContact O-N 2.86Å; R266-R268 PolarHBondContact O-N 3.36Å; R266-G269 PolarHBondContact O-N 2.67Å; R266-A270 WeakPolarHBondContact CA-O 3.48Å; R266-A270 PolarHBondContact N-O 2.98Å
267	R	98.1	Very high	98.4	Very high	175 Å²	175	50.8 Å²	50.8	66%	0.66	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-15.3	175	-76.9	-169.2	-60.8	-91.8	3.4	113.9	A263 C265	A263-R267 WeakPolarHBondContact O-CG 3.37Å; A263-R267 PolarHBondContact O-N 2.87Å; C265-R267 VanDerWaalsContact C-N 3.32Å; C265-R267 PolarHBondContact O-N 2.85Å
268	R	97.9	Very high	98.4	Very high	136 Å²	136	49.5 Å²	49.5	51%	0.513	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	15.8	179.5	-66.7	173.8	171.2	74.6	1.5	112.6	F250 A264 C265 R266 A270	F250-R268 HydrophobicContact CZ-CB 4.28Å; A264-R268 PolarHBondContact O-NH1 2.79Å; C265-R268 CarbonylContact O-C 3.32Å; C265-R268 WeakPolarHBondContact O-CA 3.41Å; C265-R268 WeakPolarHBondContact O-CB 3.47Å; C265-R268 PolarHBondContact O-N 2.71Å; R266-R268 PolarHBondContact O-N 3.36Å; R268-A270 PolarHBondContact O-N 3.07Å
269	G	97.6	Very high	98.4	Very high	72 Å²	72	49.1 Å²	49.1	74%	0.742	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.3	21.6	-177.6	0	0	0	0	0	113.7	C265 R266	C265-G269 PolarHBondContact O-N 3.3Å; R266-G269 PolarHBondContact O-N 2.67Å
270	A	98.4	Very high	98.4	Very high	4 Å²	4	44.9 Å²	44.9	3%	0.033	22%	0.218	C	C	.	.			trans	-121.1	165.1	-176.6	0	0	0	0	0	111.4	F250 C265 R266 R268 C336 Y337 A338	F250-A270 HydrophobicContact CE1-CB 3.99Å; F250-A270 HydrophobicContact CZ-CB 3.76Å; C265-A270 CarbonylContact C-O 3.39Å; C265-A270 HydrophobicContact CB-CB 4.3Å; C265-A270 PolarHBondContact O-N 2.89Å; C265-A270 VanDerWaalsContact O-O 3.08Å; R266-A270 WeakPolarHBondContact CA-O 3.48Å; R266-A270 PolarHBondContact N-O 2.98Å; R268-A270 PolarHBondContact O-N 3.07Å; A270-C336 HydrophobicContact CB-CB 3.86Å; A270-Y337 WeakPolarHBondContact CA-O 3.37Å; A270-Y337 WeakPolarHBondContact CB-O 3.21Å; A270-A338 HydrophobicContact CB-CB 4.2Å
271	V	98.4	Very high	98.4	Very high	86 Å²	86	40.6 Å²	40.6	52%	0.521	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	161	169.3	-63.1	0	0	0	0	109.9	A273 C336 Y337	V271-A273 PolarHBondContact O-N 2.92Å; V271-C336 CarbonylContact O-C 3.04Å; V271-C336 VanDerWaalsContact O-CA 3.26Å; V271-C336 WeakPolarHBondContact O-CA 3.33Å; V271-Y337 HydrophobicContact CG2-CD1 4.29Å; V271-Y337 PolarHBondContact N-O 3.34Å; V271-Y337 PolarHBondContact O-N 2.95Å
272	V	98.6	Very high	98.3	Very high	8 Å²	8	42.7 Å²	42.7	5%	0.048	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	132.7	170.9	-175.4	0	0	0	0	108.3	H262 C265 L295 A296	H262-V272 HydrophobicContact CB-CG2 4.15Å; C265-V272 HydrophobicContact CB-CG2 4.38Å; V272-L295 VanDerWaalsContact CG1-C 3.44Å; V272-A296 HydrophobicContact CB-CB 4.4Å; V272-A296 HydrophobicContact CG1-CB 4.41Å
273	A	98.8	Very high	98.2	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-63.7	141.9	-178.1	0	0	0	0	0	111	V249 V271 H277 L295 A296 Y335	V249-A273 HydrophobicContact CG1-CB 4.26Å; V271-A273 PolarHBondContact O-N 2.92Å; A273-H277 HydrophobicContact CB-CB 4.18Å; A273-L295 HydrophobicContact CB-CD2 4.04Å; A273-L295 WeakPolarHBondContact O-CA 3.23Å; A273-L295 WeakPolarHBondContact O-CB 3.21Å; A273-L295 WeakPolarHBondContact O-CD2 3.38Å; A273-A296 PolarHBondContact O-N 2.83Å; A273-Y335 WeakPolarHBondContact CB-O 3.12Å; A273-Y335 PolarHBondContact N-O 2.93Å
274	K	98.7	Very high	98.1	Very high	71 Å²	71	45.5 Å²	45.5	31%	0.309	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-78.5	166	168.6	-66.5	175.1	171.9	-163.5	0	110	E172 D174 G276 H277 L278 A296	E172-K274 VanDerWaalsContact O-CD 3.24Å; E172-K274 WeakPolarHBondContact O-CD 3.35Å; E172-K274 WeakPolarHBondContact O-CE 3.17Å; E172-K274 PolarHBondContact O-NZ 2.97Å; D174-K274 HydrophobicContact CB-CD 3.89Å; K274-G276 VanDerWaalsContact C-N 3.33Å; K274-G276 PolarHBondContact O-N 3.18Å; K274-H277 PolarHBondContact N-ND1 2.75Å; K274-H277 WeakPolarHBondContact O-CB 3.2Å; K274-H277 PolarHBondContact O-N 3.38Å; K274-L278 PolarHBondContact O-N 2.88Å; K274-L278 VanDerWaalsContact O-N 3.15Å; K274-A296 HydrophobicContact CG-CB 4.31Å
275	V	98.6	Very high	98	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.4	-44.3	175.9	178.4	0	0	0	0	111.6	F150 Y152 Q173 H277 L278 Y279 L295 D297 R301	F150-V275 HydrophobicContact CD2-CG1 3.66Å; F150-V275 HydrophobicContact CE2-CB 4.19Å; F150-V275 HydrophobicContact CE2-CG1 3.64Å; F150-V275 HydrophobicContact CG-CG1 4.49Å; F150-V275 HydrophobicContact CZ-CG1 4.47Å; Y152-V275 HydrophobicContact CD2-CG2 4.44Å; Y152-V275 HydrophobicContact CE2-CG2 4.13Å; Q173-V275 HydrophobicContact CB-CB 4.3Å; Q173-V275 HydrophobicContact CG-CB 4.38Å; Q173-V275 HydrophobicContact CG-CG2 4.5Å; Q173-V275 VanDerWaalsContact OE1-N 3.11Å; V275-H277 VanDerWaalsContact C-N 3.32Å; V275-H277 PolarHBondContact O-N 3.06Å; V275-L278 PolarHBondContact O-N 2.81Å; V275-Y279 HydrophobicContact CG1-CD2 3.82Å; V275-Y279 HydrophobicContact CG1-CE2 3.88Å; V275-Y279 WeakPolarHBondContact O-CD2 3.24Å; V275-Y279 PolarHBondContact O-N 3.06Å; V275-Y279 VanDerWaalsContact O-N 3.09Å; V275-L295 HydrophobicContact CB-CD1 4.46Å; V275-L295 HydrophobicContact CG2-CD1 3.84Å; V275-D297 VanDerWaalsContact CG2-OD2 3.24Å; V275-D297 WeakPolarHBondContact CG2-OD2 3.17Å; V275-R301 VanDerWaalsContact CG1-CZ 3.5Å
276	G	98.3	Very high	97.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.9	-40.9	176.3	0	0	0	0	0	112.5	Q173 K274 L278 Y279 A280	Q173-G276 WeakPolarHBondContact O-CA 3.27Å; Q173-G276 PolarHBondContact O-N 3.28Å; K274-G276 VanDerWaalsContact C-N 3.33Å; K274-G276 PolarHBondContact O-N 3.18Å; G276-L278 VanDerWaalsContact C-N 3.33Å; G276-L278 PolarHBondContact O-N 3.25Å; G276-Y279 PolarHBondContact O-N 2.87Å; G276-A280 WeakPolarHBondContact O-CB 3.44Å; G276-A280 PolarHBondContact O-N 3.1Å
277	H	98.6	Very high	97.8	Very high	12 Å²	12	44.9 Å²	44.9	6%	0.056	24%	0.24	C	C	.	.	H	α-helix	trans	-58.2	-45.3	175.2	-57.8	168.4	0	0	0	111.5	D174 L245 V249 A273 K274 V275 A280 A281 Y337	D174-H277 WeakPolarHBondContact CB-NE2 3.02Å; D174-H277 IonicContact OD1-NE2 4Å; D174-H277 IonicContact OD2-CD2 3.43Å; D174-H277 PolarHBondContact OD2-CD2 2.96Å; D174-H277 IonicContact OD2-NE2 3.76Å; L245-H277 HydrophobicContact CD1-CB 4.11Å; L245-H277 HydrophobicContact CD2-CB 4.49Å; V249-H277 HydrophobicContact CG2-CB 3.82Å; A273-H277 HydrophobicContact CB-CB 4.18Å; K274-H277 PolarHBondContact N-ND1 2.75Å; K274-H277 WeakPolarHBondContact O-CB 3.2Å; K274-H277 PolarHBondContact O-N 3.38Å; V275-H277 VanDerWaalsContact C-N 3.32Å; V275-H277 PolarHBondContact O-N 3.06Å; H277-A280 PolarHBondContact O-N 2.87Å; H277-A281 WeakPolarHBondContact O-CB 3.06Å; H277-A281 PolarHBondContact O-N 2.87Å; H277-Y337 HydrophobicContact CB-CD2 4.43Å; H277-Y337 AromaticContact CE1-CD1 3.37Å; H277-Y337 WeakPolarHBondContact CE1-CD1 3.32Å; H277-Y337 AromaticContact CE1-CE1 3.76Å; H277-Y337 AromaticContact CE1-CG 3.7Å; H277-Y337 WeakPolarHBondContact ND1-CB 3.23Å; H277-Y337 AromaticContact ND1-CD1 3.56Å; H277-Y337 AromaticContact ND1-CD2 3.93Å; H277-Y337 AromaticContact ND1-CG 3.36Å
278	L	98.7	Very high	97.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-44.8	179.8	-172.1	67.7	0	0	0	112.1	V249 K274 V275 G276 A281 W282 L287 L295 R301 P303 V319 Y335	V249-L278 HydrophobicContact CG1-CD1 4.49Å; K274-L278 PolarHBondContact O-N 2.88Å; K274-L278 VanDerWaalsContact O-N 3.15Å; V275-L278 PolarHBondContact O-N 2.81Å; G276-L278 VanDerWaalsContact C-N 3.33Å; G276-L278 PolarHBondContact O-N 3.25Å; L278-A281 PolarHBondContact O-N 2.04Å; L278-W282 WeakPolarHBondContact O-CB 3.33Å; L278-W282 PolarHBondContact O-N 3.02Å; L278-L287 HydrophobicContact CD1-CD2 3.84Å; L278-L295 HydrophobicContact CB-CD1 4.45Å; L278-L295 HydrophobicContact CB-CD2 4.26Å; L278-L295 HydrophobicContact CD2-CD1 3.91Å; L278-L295 HydrophobicContact CD2-CD2 4.21Å; L278-R301 HydrophobicContact CD2-CB 3.64Å; L278-P303 HydrophobicContact CD1-CB 4.44Å; L278-P303 HydrophobicContact CD1-CG 3.92Å; L278-V319 HydrophobicContact CD2-CG1 3.66Å; L278-V319 HydrophobicContact CG-CG1 4.35Å; L278-Y335 HydrophobicContact CD1-CD1 3.72Å; L278-Y335 HydrophobicContact CD1-CD2 4.15Å; L278-Y335 HydrophobicContact CD1-CE1 3.97Å; L278-Y335 HydrophobicContact CD1-CE2 4.41Å; L278-Y335 HydrophobicContact CD1-CG 3.82Å
279	Y	98.4	Very high	97.6	Very high	20 Å²	20	34.9 Å²	34.9	8%	0.078	21%	0.208	C	C	.	.	H	α-helix	trans	-65.7	-40.1	178	-89.8	-91.1	0	0	0	112.4	V148 F150 V275 G276 W282 K283 V319	V148-Y279 HydrophobicContact CG2-CD1 4.15Å; F150-Y279 HydrophobicContact CB-CD1 3.55Å; F150-Y279 HydrophobicContact CB-CD2 3.54Å; F150-Y279 HydrophobicContact CB-CE1 3.45Å; F150-Y279 VanDerWaalsContact CB-CE1 3.45Å; F150-Y279 HydrophobicContact CB-CE2 3.45Å; F150-Y279 VanDerWaalsContact CB-CE2 3.45Å; F150-Y279 HydrophobicContact CB-CG 3.57Å; F150-Y279 HydrophobicContact CD1-CD2 4.36Å; F150-Y279 HydrophobicContact CD1-CG 4.24Å; F150-Y279 HydrophobicContact CD2-CD2 4.28Å; F150-Y279 HydrophobicContact CD2-CE2 4.32Å; F150-Y279 HydrophobicContact CG-CD1 4.47Å; F150-Y279 AromaticContact CG-CD2 3.85Å; F150-Y279 HydrophobicContact CG-CD2 3.85Å; F150-Y279 HydrophobicContact CG-CE2 4.08Å; F150-Y279 HydrophobicContact CG-CG 4.04Å; V275-Y279 HydrophobicContact CG1-CD2 3.82Å; V275-Y279 HydrophobicContact CG1-CE2 3.88Å; V275-Y279 WeakPolarHBondContact O-CD2 3.24Å; V275-Y279 PolarHBondContact O-N 3.06Å; V275-Y279 VanDerWaalsContact O-N 3.09Å; G276-Y279 PolarHBondContact O-N 2.87Å; Y279-W282 HydrophobicContact CD1-CE3 4.34Å; Y279-W282 PolarHBondContact O-N 2.87Å; Y279-K283 WeakPolarHBondContact O-CB 3.28Å; Y279-K283 PolarHBondContact O-N 2.88Å; Y279-V319 HydrophobicContact CD1-CB 4.29Å; Y279-V319 HydrophobicContact CD1-CG2 3.76Å; Y279-V319 HydrophobicContact CD2-CB 4.29Å; Y279-V319 HydrophobicContact CD2-CG1 4.38Å; Y279-V319 HydrophobicContact CD2-CG2 4.06Å; Y279-V319 HydrophobicContact CE1-CB 3.81Å; Y279-V319 HydrophobicContact CE1-CG2 3.79Å; Y279-V319 HydrophobicContact CE2-CB 3.8Å; Y279-V319 HydrophobicContact CE2-CG1 3.89Å; Y279-V319 HydrophobicContact CE2-CG2 4.08Å; Y279-V319 HydrophobicContact CG-CG2 3.92Å
280	A	97.8	Very high	97.5	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.008	19%	0.187	C	C	.	.	H	α-helix	trans	-65.3	-44.6	176.2	0	0	0	0	0	111.6	T242 S243 L245 G276 H277 W282 K283 F284	T242-A280 HydrophobicContact CG2-CB 4.08Å; S243-A280 WeakPolarHBondContact O-CB 3.38Å; L245-A280 HydrophobicContact CD1-CB 4.04Å; L245-A280 HydrophobicContact CD2-CB 3.82Å; L245-A280 HydrophobicContact CG-CB 3.61Å; G276-A280 WeakPolarHBondContact O-CB 3.44Å; G276-A280 PolarHBondContact O-N 3.1Å; H277-A280 PolarHBondContact O-N 2.87Å; A280-W282 PolarHBondContact O-N 2.83Å; A280-K283 PolarHBondContact O-N 2.67Å; A280-F284 HydrophobicContact CB-CD2 4.35Å; A280-F284 WeakPolarHBondContact O-CB 3.3Å; A280-F284 VanDerWaalsContact O-CD2 3.31Å; A280-F284 WeakPolarHBondContact O-CD2 3.49Å; A280-F284 PolarHBondContact O-N 3.35Å
281	A	98.1	Very high	97.3	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-64.4	-38.7	176.6	0	0	0	0	0	112.6	L245 V249 H277 L278 S285 G286 L287	L245-A281 HydrophobicContact CD1-CB 4.48Å; V249-A281 HydrophobicContact CB-CB 3.64Å; V249-A281 HydrophobicContact CG1-CB 4.39Å; V249-A281 HydrophobicContact CG2-CB 3.77Å; H277-A281 WeakPolarHBondContact O-CB 3.06Å; H277-A281 PolarHBondContact O-N 2.87Å; L278-A281 PolarHBondContact O-N 2.04Å; A281-S285 CarbonylContact O-C 3.55Å; A281-S285 WeakPolarHBondContact O-CA 3.18Å; A281-S285 VanDerWaalsContact O-CB 3.3Å; A281-S285 WeakPolarHBondContact O-CB 3.4Å; A281-S285 PolarHBondContact O-N 2.74Å; A281-G286 PolarHBondContact O-N 2.93Å; A281-L287 HydrophobicContact CB-CB 4.09Å; A281-L287 HydrophobicContact CB-CD2 3.84Å; A281-L287 PolarHBondContact O-N 2.9Å; A281-L287 VanDerWaalsContact O-N 3.16Å
282	W	97.4	Very high	97.3	Very high	44 Å²	44	33.5 Å²	33.5	17%	0.167	19%	0.185	C	C	.	.	H	α-helix	trans	-60.4	-46.9	172.3	168.1	73.6	0	0	0	111.9	V148 L278 Y279 A280 P303 I304 I305 P317 G318 V319	V148-W282 HydrophobicContact CG2-CE3 4.35Å; V148-W282 HydrophobicContact CG2-CZ3 3.9Å; L278-W282 WeakPolarHBondContact O-CB 3.33Å; L278-W282 PolarHBondContact O-N 3.02Å; Y279-W282 HydrophobicContact CD1-CE3 4.34Å; Y279-W282 PolarHBondContact O-N 2.87Å; A280-W282 PolarHBondContact O-N 2.83Å; W282-P303 HydrophobicContact CB-CB 3.83Å; W282-P303 HydrophobicContact CG-CB 4.06Å; W282-I304 PolarHBondContact NE1-O 3.04Å; W282-I305 WeakPolarHBondContact O-CD1 3.27Å; W282-P317 HydrophobicContact CZ2-CB 4.1Å; W282-G318 VanDerWaalsContact CZ2-CA 3.5Å; W282-V319 HydrophobicContact CB-CG2 4.05Å; W282-V319 HydrophobicContact CD2-CG2 4.19Å; W282-V319 HydrophobicContact CE3-CG2 4.46Å; W282-V319 HydrophobicContact CG-CG2 4Å
283	K	96.6	Very high	97.3	Very high	78 Å²	78	33.1 Å²	33.1	34%	0.339	18%	0.183	S	C	.	.	H	α-helix	trans	-74.6	-42.4	-176.2	-175.6	71	178.7	-171.8	0	113.3	V148 E189 Y279 A280	V148-K283 HydrophobicContact CB-CB 4.11Å; V148-K283 HydrophobicContact CB-CG 4.11Å; V148-K283 HydrophobicContact CG1-CB 4.28Å; V148-K283 HydrophobicContact CG2-CB 4.38Å; E189-K283 IonicContact OE2-NZ 3.47Å; E189-K283 PolarHBondContact OE2-NZ 3.06Å; Y279-K283 WeakPolarHBondContact O-CB 3.28Å; Y279-K283 PolarHBondContact O-N 2.88Å; A280-K283 PolarHBondContact O-N 2.67Å
284	F	95.6	Very high	97.3	Very high	73 Å²	73	33.1 Å²	33.1	32%	0.32	18%	0.183	S	C	.	.	H	α-helix	trans	-110.9	-22.8	-166.2	-60.2	-67.9	0	0	0	114.4	G147 V148 A244 A280	G147-F284 VanDerWaalsContact CA-CZ 3.49Å; V148-F284 HydrophobicContact CG1-CE2 4.41Å; A244-F284 HydrophobicContact CB-CD2 4.26Å; A244-F284 HydrophobicContact CB-CG 4.26Å; A280-F284 HydrophobicContact CB-CD2 4.35Å; A280-F284 WeakPolarHBondContact O-CB 3.3Å; A280-F284 VanDerWaalsContact O-CD2 3.31Å; A280-F284 WeakPolarHBondContact O-CD2 3.49Å; A280-F284 PolarHBondContact O-N 3.35Å
285	S	95.6	Very high	97.3	Very high	83 Å²	83	29.7 Å²	29.7	58%	0.58	17%	0.168	S	C	*	.	S	Bend	trans	-109.2	0	-177.8	-48.6	0	0	0	0	113.3	A281 L287	A281-S285 CarbonylContact O-C 3.55Å; A281-S285 WeakPolarHBondContact O-CA 3.18Å; A281-S285 VanDerWaalsContact O-CB 3.3Å; A281-S285 WeakPolarHBondContact O-CB 3.4Å; A281-S285 PolarHBondContact O-N 2.74Å; S285-L287 VanDerWaalsContact C-N 3.33Å; S285-L287 PolarHBondContact O-N 2.83Å
286	G	95.9	Very high	97.2	Very high	49 Å²	49	31.8 Å²	31.8	51%	0.505	19%	0.185	S	C	.	.			trans	72.4	24.4	178.9	0	0	0	0	0	113.9	A281 D288 I305	A281-G286 PolarHBondContact O-N 2.93Å; G286-D288 PolarHBondContact O-N 2.81Å; G286-D288 VanDerWaalsContact O-N 3.14Å; G286-I305 WeakPolarHBondContact O-CD1 3.18Å
287	L	97.4	Very high	97.2	Very high	29 Å²	29	33.2 Å²	33.2	15%	0.152	19%	0.193	C	C	.	.			trans	-68.5	111.1	-177.8	-175.1	65.1	0	0	0	111.7	V249 L278 A281 S285 P303 Y335	V249-L287 HydrophobicContact CB-CD2 4.25Å; V249-L287 HydrophobicContact CG1-CD2 3.82Å; L278-L287 HydrophobicContact CD1-CD2 3.84Å; A281-L287 HydrophobicContact CB-CB 4.09Å; A281-L287 HydrophobicContact CB-CD2 3.84Å; A281-L287 PolarHBondContact O-N 2.9Å; A281-L287 VanDerWaalsContact O-N 3.16Å; S285-L287 VanDerWaalsContact C-N 3.33Å; S285-L287 PolarHBondContact O-N 2.83Å; L287-P303 HydrophobicContact CB-CG 4.45Å; L287-P303 HydrophobicContact CD2-CG 3.89Å; L287-P303 HydrophobicContact CG-CG 3.75Å; L287-P303 WeakPolarHBondContact O-CB 3.42Å; L287-Y335 HydrophobicContact CD2-CD1 4.23Å; L287-Y335 HydrophobicContact CD2-CE1 4.24Å
288	D	96.2	Very high	97.2	Very high	48 Å²	48	33.1 Å²	33.1	26%	0.257	20%	0.196	S	C	.	.			trans	-125.1	110.4	176.5	-170.3	-12.9	0	0	0	110.6	G286 I305 T306 R308	G286-D288 PolarHBondContact O-N 2.81Å; G286-D288 VanDerWaalsContact O-N 3.14Å; D288-I305 HydrophobicContact CB-CB 4.13Å; D288-I305 HydrophobicContact CB-CD1 4.49Å; D288-I305 HydrophobicContact CB-CG1 4.23Å; D288-I305 PolarHBondContact OD2-N 2.96Å; D288-T306 PolarHBondContact OD2-N 3.15Å; D288-R308 VanDerWaalsContact CG-NH1 3.33Å; D288-R308 IonicContact OD1-CZ 3.23Å; D288-R308 VanDerWaalsContact OD1-CZ 3.23Å; D288-R308 IonicContact OD1-NH1 2.74Å; D288-R308 PolarHBondContact OD1-NH1 3.41Å; D288-R308 IonicContact OD1-NH2 2.77Å; D288-R308 PolarHBondContact OD1-NH2 3.16Å; D288-R308 IonicContact OD2-NH1 3.14Å; D288-R308 PolarHBondContact OD2-NH1 2.8Å; D288-R308 VanDerWaalsContact OD2-NH1 3.14Å
289	Q	96.4	Very high	97.2	Very high	53 Å²	53	33.1 Å²	33.1	25%	0.248	20%	0.196	C	C	.	.			trans	-141.3	124.9	-176.4	-174.3	68.8	45.9	0	0	110.3	F251 D291 P303 Y335	F251-Q289 HydrophobicContact CB-CG 4.28Å; F251-Q289 HydrophobicContact CD1-CG 4.1Å; F251-Q289 HydrophobicContact CD2-CG 4.32Å; F251-Q289 HydrophobicContact CG-CG 3.99Å; Q289-D291 HydrophobicContact CG-CB 4.22Å; Q289-D291 PolarHBondContact NE2-OD2 2.91Å; Q289-D291 PolarHBondContact O-N 2.73Å; Q289-P303 HydrophobicContact CB-CG 4.4Å; Q289-P303 PolarHBondContact N-O 3.14Å; Q289-P303 VanDerWaalsContact O-O 3.06Å; Q289-Y335 HydrophobicContact CB-CE1 4.18Å; Q289-Y335 WeakPolarHBondContact CB-OH 3.44Å; Q289-Y335 HydrophobicContact CG-CE1 4.25Å; Q289-Y335 VanDerWaalsContact CG-OH 3.24Å; Q289-Y335 WeakPolarHBondContact CG-OH 3.21Å
290	C	94.4	Very high	97.1	Very high	44 Å²	44	32.2 Å²	32.2	30%	0.297	19%	0.192	S	C	.	.			trans	-82	4.2	-179.1	-169.8	0	0	0	0	113.9	C311	C290-C311 HydrophobicContact CB-CB 3.84Å; C290-C311 WeakPolarHBondContact CB-SG 3.46Å; C290-C311 VanDerWaalsContact SG-CA 3.54Å; C290-C311 WeakPolarHBondContact SG-CB 3.32Å; C290-C311 CovalentContact SG-SG 2Å; C290-C311 PolarHBondContact SG-SG 3.37Å
291	D	95.7	Very high	97.1	Very high	80 Å²	80	32.8 Å²	32.8	43%	0.428	19%	0.194	S	C	.	.	S	Bend	trans	-108.9	129.9	-172.3	-63.8	-73.9	0	0	0	110.7	F251 Q289 G293 F302 Y335	F251-D291 HydrophobicContact CE1-CB 3.85Å; F251-D291 HydrophobicContact CE2-CB 4.16Å; F251-D291 HydrophobicContact CZ-CB 3.48Å; F251-D291 VanDerWaalsContact CZ-CB 3.48Å; Q289-D291 HydrophobicContact CG-CB 4.22Å; Q289-D291 PolarHBondContact NE2-OD2 2.91Å; Q289-D291 PolarHBondContact O-N 2.73Å; D291-G293 PolarHBondContact O-N 3.35Å; D291-F302 VanDerWaalsContact O-CB 3.28Å; D291-F302 WeakPolarHBondContact O-CB 3.33Å; D291-Y335 PolarHBondContact O-OH 3Å
292	G	97	Very high	97.1	Very high	9 Å²	9	33.1 Å²	33.1	9%	0.093	20%	0.195	C	C	.	.			trans	-61.2	129.4	172.1	0	0	0	0	0	110.5	Y332 G333	G292-Y332 WeakPolarHBondContact O-CB 3.47Å; G292-G333 PolarHBondContact O-N 2.91Å; G292-G333 VanDerWaalsContact O-N 3.12Å
293	G	98.4	Very high	97.1	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	141.4	176.1	0	0	0	0	0	112	D291 V300 R301 G333	D291-G293 PolarHBondContact O-N 3.35Å; G293-V300 WeakPolarHBondContact O-CA 3.4Å; G293-R301 PolarHBondContact N-O 3.32Å; G293-R301 PolarHBondContact O-N 3.02Å; G293-R301 VanDerWaalsContact O-N 3.14Å; G293-G333 VanDerWaalsContact CA-O 3.32Å; G293-G333 WeakPolarHBondContact CA-O 3.28Å
294	W	98.7	Very high	97	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	137.3	171.5	-68.5	108.5	0	0	0	111.6	L256 L258 A261 G298 V300 P325 Y332 G333 T334 Y335	L256-W294 PolarHBondContact O-NE1 2.82Å; L258-W294 HydrophobicContact CB-CD2 4.23Å; L258-W294 HydrophobicContact CB-CE3 4.21Å; L258-W294 HydrophobicContact CB-CZ3 4.37Å; L258-W294 HydrophobicContact CD1-CB 4.03Å; L258-W294 HydrophobicContact CD1-CD2 4Å; L258-W294 HydrophobicContact CD1-CE3 3.78Å; L258-W294 HydrophobicContact CD1-CG 4.14Å; L258-W294 HydrophobicContact CG-CE3 4.46Å; A261-W294 HydrophobicContact CB-CB 3.88Å; A261-W294 HydrophobicContact CB-CG 4.09Å; W294-G298 WeakPolarHBondContact CZ3-O 3.4Å; W294-V300 HydrophobicContact CD2-CG2 3.68Å; W294-V300 HydrophobicContact CE3-CG2 3.42Å; W294-V300 VanDerWaalsContact CE3-CG2 3.42Å; W294-V300 HydrophobicContact CG-CG2 4.36Å; W294-V300 HydrophobicContact CH2-CG2 4.08Å; W294-V300 HydrophobicContact CZ2-CG2 4.29Å; W294-V300 HydrophobicContact CZ3-CG2 3.64Å; W294-P325 HydrophobicContact CH2-CB 4Å; W294-P325 HydrophobicContact CH2-CG 4.46Å; W294-Y332 HydrophobicContact CZ2-CD2 4.03Å; W294-G333 PolarHBondContact N-O 2.98Å; W294-T334 PolarHBondContact O-OG1 2.98Å; W294-T334 VanDerWaalsContact O-OG1 3.08Å; W294-Y335 PolarHBondContact O-N 2.92Å
295	L	98.8	Very high	96.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	17%	0.171	C	C	.	.			trans	-112.3	166.8	167.4	-61.8	179.7	0	0	0	110.9	V272 A273 V275 L278 D297 G298 S299 R301 Y335	V272-L295 VanDerWaalsContact CG1-C 3.44Å; A273-L295 HydrophobicContact CB-CD2 4.04Å; A273-L295 WeakPolarHBondContact O-CA 3.23Å; A273-L295 WeakPolarHBondContact O-CB 3.21Å; A273-L295 WeakPolarHBondContact O-CD2 3.38Å; V275-L295 HydrophobicContact CB-CD1 4.46Å; V275-L295 HydrophobicContact CG2-CD1 3.84Å; L278-L295 HydrophobicContact CB-CD1 4.45Å; L278-L295 HydrophobicContact CB-CD2 4.26Å; L278-L295 HydrophobicContact CD2-CD1 3.91Å; L278-L295 HydrophobicContact CD2-CD2 4.21Å; L295-D297 PolarHBondContact O-N 3.19Å; L295-G298 PolarHBondContact O-N 2.83Å; L295-S299 PolarHBondContact N-O 2.85Å; L295-R301 HydrophobicContact CD1-CB 3.95Å; L295-R301 HydrophobicContact CD1-CG 3.76Å; L295-Y335 HydrophobicContact CD2-CD2 4.23Å; L295-Y335 HydrophobicContact CD2-CG 4.46Å
296	A	98.2	Very high	96.7	Very high	43 Å²	43	27.2 Å²	27.2	36%	0.355	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-26	-174.4	0	0	0	0	0	113.7	V272 A273 K274 G298	V272-A296 HydrophobicContact CB-CB 4.4Å; V272-A296 HydrophobicContact CG1-CB 4.41Å; A273-A296 PolarHBondContact O-N 2.83Å; K274-A296 HydrophobicContact CG-CB 4.31Å; A296-G298 PolarHBondContact O-N 2.61Å
297	D	97.7	Very high	96.4	Very high	30 Å²	30	26.6 Å²	26.6	16%	0.16	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-2.5	175	71	-17.5	0	0	0	113.3	V275 L295 S299 R301 F324	V275-D297 VanDerWaalsContact CG2-OD2 3.24Å; V275-D297 WeakPolarHBondContact CG2-OD2 3.17Å; L295-D297 PolarHBondContact O-N 3.19Å; D297-S299 VanDerWaalsContact C-N 3.26Å; D297-S299 PolarHBondContact O-N 2.92Å; D297-S299 VanDerWaalsContact OD1-CB 3.22Å; D297-S299 WeakPolarHBondContact OD1-CB 3.42Å; D297-S299 PolarHBondContact OD1-N 2.86Å; D297-S299 PolarHBondContact OD1-OG 3Å; D297-S299 PolarHBondContact OD2-OG 2.81Å; D297-S299 VanDerWaalsContact OD2-OG 3.06Å; D297-R301 IonicContact OD2-NH2 3.84Å; D297-R301 PolarHBondContact OD2-NH2 2.77Å; D297-F324 WeakPolarHBondContact O-CE1 3.39Å
298	G	97.7	Very high	96	Very high	11 Å²	11	28.4 Å²	28.4	11%	0.113	16%	0.162	C	C	.	.	S	Bend	trans	77.4	8.7	-174.3	0	0	0	0	0	113.6	W294 L295 A296	W294-G298 WeakPolarHBondContact CZ3-O 3.4Å; L295-G298 PolarHBondContact O-N 2.83Å; A296-G298 PolarHBondContact O-N 2.61Å
299	S	98.2	Very high	95.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.183	C	C	.	.			trans	-80.1	157.4	167.3	71.2	0	0	0	0	111	L295 D297 R301 G323	L295-S299 PolarHBondContact N-O 2.85Å; D297-S299 VanDerWaalsContact C-N 3.26Å; D297-S299 PolarHBondContact O-N 2.92Å; D297-S299 VanDerWaalsContact OD1-CB 3.22Å; D297-S299 WeakPolarHBondContact OD1-CB 3.42Å; D297-S299 PolarHBondContact OD1-N 2.86Å; D297-S299 PolarHBondContact OD1-OG 3Å; D297-S299 PolarHBondContact OD2-OG 2.81Å; D297-S299 VanDerWaalsContact OD2-OG 3.06Å; S299-R301 PolarHBondContact OG-NE 3.12Å; S299-G323 VanDerWaalsContact CA-O 3.26Å; S299-G323 WeakPolarHBondContact CA-O 3.49Å; S299-G323 WeakPolarHBondContact CB-O 3.39Å
300	V	98.1	Very high	94.8	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	122.3	171.1	179.4	0	0	0	0	108.6	G293 W294 F322 G323 P325 Y332	G293-V300 WeakPolarHBondContact O-CA 3.4Å; W294-V300 HydrophobicContact CD2-CG2 3.68Å; W294-V300 HydrophobicContact CE3-CG2 3.42Å; W294-V300 VanDerWaalsContact CE3-CG2 3.42Å; W294-V300 HydrophobicContact CG-CG2 4.36Å; W294-V300 HydrophobicContact CH2-CG2 4.08Å; W294-V300 HydrophobicContact CZ2-CG2 4.29Å; W294-V300 HydrophobicContact CZ3-CG2 3.64Å; V300-F322 HydrophobicContact CB-CB 4.38Å; V300-F322 HydrophobicContact CG1-CD2 3.84Å; V300-F322 PolarHBondContact O-N 3.23Å; V300-G323 PolarHBondContact N-O 2.71Å; V300-P325 HydrophobicContact CB-CG 4.25Å; V300-P325 HydrophobicContact CG2-CG 3.83Å; V300-Y332 HydrophobicContact CB-CD2 4.42Å; V300-Y332 HydrophobicContact CB-CG 4.44Å; V300-Y332 HydrophobicContact CG1-CD1 3.62Å; V300-Y332 HydrophobicContact CG1-CD2 4.08Å; V300-Y332 HydrophobicContact CG1-CE1 4Å; V300-Y332 HydrophobicContact CG1-CE2 4.44Å; V300-Y332 HydrophobicContact CG1-CG 3.64Å; V300-Y332 HydrophobicContact CG2-CD2 3.69Å; V300-Y332 HydrophobicContact CG2-CE2 4.09Å; V300-Y332 HydrophobicContact CG2-CG 4.02Å
301	R	97.8	Very high	94.4	Very high	13 Å²	13	38.3 Å²	38.3	5%	0.049	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	167.2	-175.4	-55.5	-168.9	-164.7	-153.5	4	111.1	V275 L278 G293 L295 D297 S299 V319 R320 Y335	V275-R301 VanDerWaalsContact CG1-CZ 3.5Å; L278-R301 HydrophobicContact CD2-CB 3.64Å; G293-R301 PolarHBondContact N-O 3.32Å; G293-R301 PolarHBondContact O-N 3.02Å; G293-R301 VanDerWaalsContact O-N 3.14Å; L295-R301 HydrophobicContact CD1-CB 3.95Å; L295-R301 HydrophobicContact CD1-CG 3.76Å; D297-R301 IonicContact OD2-NH2 3.84Å; D297-R301 PolarHBondContact OD2-NH2 2.77Å; S299-R301 PolarHBondContact OG-NE 3.12Å; R301-V319 HydrophobicContact CB-CG1 4.01Å; R301-R320 CarbonylContact C-O 3.6Å; R301-R320 WeakPolarHBondContact CA-O 3.44Å; R301-R320 VanDerWaalsContact CB-O 3.26Å; R301-R320 WeakPolarHBondContact CB-O 3.38Å; R301-Y335 VanDerWaalsContact O-CE2 3.25Å; R301-Y335 WeakPolarHBondContact O-CE2 3.21Å
302	F	97.1	Very high	93.1	Very high	8 Å²	8	36.3 Å²	36.3	4%	0.035	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	133.6	173.6	62.1	-85	0	0	0	111.1	D291 I304 R320 F322	D291-F302 VanDerWaalsContact O-CB 3.28Å; D291-F302 WeakPolarHBondContact O-CB 3.33Å; F302-I304 HydrophobicContact CD2-CD1 3.92Å; F302-I304 HydrophobicContact CD2-CG1 3.81Å; F302-I304 HydrophobicContact CE2-CD1 4.2Å; F302-I304 HydrophobicContact CE2-CG1 3.91Å; F302-R320 HydrophobicContact CD1-CB 3.99Å; F302-R320 HydrophobicContact CD2-CB 4.05Å; F302-R320 HydrophobicContact CD2-CG 4.38Å; F302-R320 HydrophobicContact CE1-CB 3.5Å; F302-R320 VanDerWaalsContact CE1-CB 3.5Å; F302-R320 HydrophobicContact CE2-CB 3.58Å; F302-R320 HydrophobicContact CE2-CG 3.75Å; F302-R320 HydrophobicContact CG-CB 4.25Å; F302-R320 HydrophobicContact CZ-CB 3.29Å; F302-R320 HydrophobicContact CZ-CG 3.84Å; F302-R320 PolarHBondContact N-O 2.99Å; F302-R320 PolarHBondContact O-N 2.85Å; F302-F322 HydrophobicContact CD1-CD2 4.23Å; F302-F322 AromaticContact CD1-CE2 3.67Å; F302-F322 HydrophobicContact CD1-CE2 3.67Å; F302-F322 AromaticContact CD1-CZ 3.93Å; F302-F322 HydrophobicContact CD1-CZ 3.93Å; F302-F322 HydrophobicContact CE1-CD1 4.43Å; F302-F322 HydrophobicContact CE1-CD2 4.23Å; F302-F322 AromaticContact CE1-CE1 3.82Å; F302-F322 HydrophobicContact CE1-CE1 3.82Å; F302-F322 AromaticContact CE1-CE2 3.59Å; F302-F322 HydrophobicContact CE1-CE2 3.59Å; F302-F322 AromaticContact CE1-CZ 3.35Å; F302-F322 HydrophobicContact CE1-CZ 3.35Å; F302-F322 HydrophobicContact CZ-CZ 4.14Å
303	P	96.7	Very high	91.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	136.7	-177.5	36.3	-32.8	0	0	0	112	L278 W282 L287 Q289 V319 Y335	L278-P303 HydrophobicContact CD1-CB 4.44Å; L278-P303 HydrophobicContact CD1-CG 3.92Å; W282-P303 HydrophobicContact CB-CB 3.83Å; W282-P303 HydrophobicContact CG-CB 4.06Å; L287-P303 HydrophobicContact CB-CG 4.45Å; L287-P303 HydrophobicContact CD2-CG 3.89Å; L287-P303 HydrophobicContact CG-CG 3.75Å; L287-P303 WeakPolarHBondContact O-CB 3.42Å; Q289-P303 HydrophobicContact CB-CG 4.4Å; Q289-P303 PolarHBondContact N-O 3.14Å; Q289-P303 VanDerWaalsContact O-O 3.06Å; P303-V319 HydrophobicContact CB-CG2 4.17Å; P303-Y335 WeakPolarHBondContact CD-OH 3.36Å; P303-Y335 HydrophobicContact CG-CE1 4.33Å
304	I	95.3	Very high	90.2	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	122.4	179.6	-58.9	-66.3	0	0	0	109.6	W282 F302 T306 C311 P317 G318	W282-I304 PolarHBondContact NE1-O 3.04Å; F302-I304 HydrophobicContact CD2-CD1 3.92Å; F302-I304 HydrophobicContact CD2-CG1 3.81Å; F302-I304 HydrophobicContact CE2-CD1 4.2Å; F302-I304 HydrophobicContact CE2-CG1 3.91Å; I304-T306 WeakPolarHBondContact CG2-O 3.48Å; I304-C311 HydrophobicContact CD1-CB 3.61Å; I304-C311 HydrophobicContact CG1-CB 4.39Å; I304-P317 CarbonylContact O-C 3.53Å; I304-P317 WeakPolarHBondContact O-CA 3.49Å; I304-G318 PolarHBondContact N-O 3.12Å; I304-G318 PolarHBondContact O-N 2.96Å
305	I	93.7	Very high	89.2	Confident	58 Å²	58	47.1 Å²	47.1	30%	0.297	27%	0.27	S	S	.	.	S	Bend	trans	-100.6	-39.3	175.1	-62.7	-178.3	0	0	0	110.4	W282 G286 D288 P307 P317	W282-I305 WeakPolarHBondContact O-CD1 3.27Å; G286-I305 WeakPolarHBondContact O-CD1 3.18Å; D288-I305 HydrophobicContact CB-CB 4.13Å; D288-I305 HydrophobicContact CB-CD1 4.49Å; D288-I305 HydrophobicContact CB-CG1 4.23Å; D288-I305 PolarHBondContact OD2-N 2.96Å; I305-P307 WeakPolarHBondContact O-CD 3.25Å; I305-P317 WeakPolarHBondContact O-CG 3.45Å
306	T	91.3	Very high	88.6	Confident	95 Å²	95	51.1 Å²	51.1	58%	0.583	29%	0.291	S	S	*	.	S	Bend	trans	-107	100.7	174.1	-54.2	0	0	0	0	109.9	D288 I304 R308	D288-T306 PolarHBondContact OD2-N 3.15Å; I304-T306 WeakPolarHBondContact CG2-O 3.48Å; T306-R308 PolarHBondContact O-N 3.23Å; T306-R308 PolarHBondContact O-NH1 2.83Å
307	P	89.4	Confident	88.3	Confident	35 Å²	35	52.3 Å²	52.3	23%	0.227	30%	0.295	C	S	.	.			trans	-57.8	135.1	-178.4	-28.2	39.9	0	0	0	111.8	I305 L314 P315 P317	I305-P307 WeakPolarHBondContact O-CD 3.25Å; P307-L314 HydrophobicContact CB-CD2 3.85Å; P307-P315 WeakPolarHBondContact CB-O 3.3Å; P307-P315 WeakPolarHBondContact CG-O 3.35Å; P307-P317 HydrophobicContact CG-CB 4.48Å; P307-P317 HydrophobicContact CG-CG 3.94Å
308	R	88.8	Confident	88	Confident	68 Å²	68	51.3 Å²	51.3	26%	0.257	29%	0.292	S	S	.	.			trans	-146.1	146.1	-176.2	56.3	-168.3	173.1	-84.9	4.1	110.8	D288 T306 R310 C311	D288-R308 VanDerWaalsContact CG-NH1 3.33Å; D288-R308 IonicContact OD1-CZ 3.23Å; D288-R308 VanDerWaalsContact OD1-CZ 3.23Å; D288-R308 IonicContact OD1-NH1 2.74Å; D288-R308 PolarHBondContact OD1-NH1 3.41Å; D288-R308 IonicContact OD1-NH2 2.77Å; D288-R308 PolarHBondContact OD1-NH2 3.16Å; D288-R308 IonicContact OD2-NH1 3.14Å; D288-R308 PolarHBondContact OD2-NH1 2.8Å; D288-R308 VanDerWaalsContact OD2-NH1 3.14Å; T306-R308 PolarHBondContact O-N 3.23Å; T306-R308 PolarHBondContact O-NH1 2.83Å; R308-R310 PolarHBondContact O-N 3.34Å; R308-C311 VanDerWaalsContact CD-SG 3.56Å; R308-C311 HydrophobicContact CG-CB 3.49Å; R308-C311 VanDerWaalsContact CG-CB 3.49Å; R308-C311 WeakPolarHBondContact CG-SG 3.49Å; R308-C311 PolarHBondContact NE-SG 3.49Å; R308-C311 PolarHBondContact O-N 2.94Å
309	P	83.6	Confident	87.9	Confident	106 Å²	106	51.5 Å²	51.5	69%	0.688	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-32.8	-167.8	-29.4	32.8	0	0	0	116.1	L314	P309-L314 HydrophobicContact CG-CD1 4.14Å
310	R	85.3	Confident	87.7	Confident	237 Å²	237	55.1 Å²	55.1	89%	0.894	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	6.1	-176	-70.5	-170.3	-85	-169.7	-4.8	114.8	R308	R308-R310 PolarHBondContact O-N 3.34Å
311	C	85.2	Confident	87.5	Confident	10 Å²	10	57.9 Å²	57.9	7%	0.068	32%	0.324	C	S	.	.	S	Bend	trans	-130.3	68.7	-172.5	-52.7	0	0	0	0	111.3	C290 I304 R308	C290-C311 HydrophobicContact CB-CB 3.84Å; C290-C311 WeakPolarHBondContact CB-SG 3.46Å; C290-C311 VanDerWaalsContact SG-CA 3.54Å; C290-C311 WeakPolarHBondContact SG-CB 3.32Å; C290-C311 CovalentContact SG-SG 2Å; C290-C311 PolarHBondContact SG-SG 3.37Å; I304-C311 HydrophobicContact CD1-CB 3.61Å; I304-C311 HydrophobicContact CG1-CB 4.39Å; R308-C311 VanDerWaalsContact CD-SG 3.56Å; R308-C311 HydrophobicContact CG-CB 3.49Å; R308-C311 VanDerWaalsContact CG-CB 3.49Å; R308-C311 WeakPolarHBondContact CG-SG 3.49Å; R308-C311 PolarHBondContact NE-SG 3.49Å; R308-C311 PolarHBondContact O-N 2.94Å
312	G	68.6	Low	87.4	Confident	38 Å²	38	62.5 Å²	62.5	39%	0.392	35%	0.345	S	S	.	.	S	Bend	trans	89.3	13.2	169.9	0	0	0	0	0	116.8
313	G	65.4	Low	87.3	Confident	36 Å²	36	63 Å²	63	37%	0.371	35%	0.352	S	S	.	.			trans	82.3	140	176.5	0	0	0	0	0	113
314	L	68.4	Low	87.3	Confident	107 Å²	107	65.8 Å²	65.8	56%	0.56	36%	0.364	S	S	*	.	S	Bend	trans	-76	153.4	168.8	-64.8	171.4	0	0	0	109.1	P307 P309	P307-L314 HydrophobicContact CB-CD2 3.85Å; P309-L314 HydrophobicContact CG-CD1 4.14Å
315	P	77.9	Confident	87.4	Confident	93 Å²	93	66.7 Å²	66.7	60%	0.604	37%	0.37	S	S	*	.	S	Bend	cis	-113.2	-9.6	14.1	37.3	-28.9	0	0	0	116	P307	P307-P315 WeakPolarHBondContact CB-O 3.3Å; P307-P315 WeakPolarHBondContact CG-O 3.35Å
316	D	85.9	Confident	87.6	Confident	84 Å²	84	73.1 Å²	73.1	45%	0.449	39%	0.391	S	S	.	.			trans	-101	145.6	-163.3	-55.3	-52.5	0	0	0	114	R320	D316-R320 PolarHBondContact O-NH2 2.89Å
317	P	91.5	Very high	87.8	Confident	67 Å²	67	71.6 Å²	71.6	44%	0.435	38%	0.382	S	S	.	.			trans	-61	155.7	166.4	-21.2	33.4	0	0	0	111.8	W282 I304 I305 P307	W282-P317 HydrophobicContact CZ2-CB 4.1Å; I304-P317 CarbonylContact O-C 3.53Å; I304-P317 WeakPolarHBondContact O-CA 3.49Å; I305-P317 WeakPolarHBondContact O-CG 3.45Å; P307-P317 HydrophobicContact CG-CB 4.48Å; P307-P317 HydrophobicContact CG-CG 3.94Å
318	G	92.9	Very high	88.1	Confident	9 Å²	9	76.9 Å²	76.9	9%	0.093	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.6	173.7	174	0	0	0	0	0	114.3	W282 I304	W282-G318 VanDerWaalsContact CZ2-CA 3.5Å; I304-G318 PolarHBondContact N-O 3.12Å; I304-G318 PolarHBondContact O-N 2.96Å
319	V	95.6	Very high	88.4	Confident	16 Å²	16	77.5 Å²	77.5	10%	0.097	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	120.1	170.1	-178.4	0	0	0	0	109.2	L278 Y279 W282 R301 P303	L278-V319 HydrophobicContact CD2-CG1 3.66Å; L278-V319 HydrophobicContact CG-CG1 4.35Å; Y279-V319 HydrophobicContact CD1-CB 4.29Å; Y279-V319 HydrophobicContact CD1-CG2 3.76Å; Y279-V319 HydrophobicContact CD2-CB 4.29Å; Y279-V319 HydrophobicContact CD2-CG1 4.38Å; Y279-V319 HydrophobicContact CD2-CG2 4.06Å; Y279-V319 HydrophobicContact CE1-CB 3.81Å; Y279-V319 HydrophobicContact CE1-CG2 3.79Å; Y279-V319 HydrophobicContact CE2-CB 3.8Å; Y279-V319 HydrophobicContact CE2-CG1 3.89Å; Y279-V319 HydrophobicContact CE2-CG2 4.08Å; Y279-V319 HydrophobicContact CG-CG2 3.92Å; W282-V319 HydrophobicContact CB-CG2 4.05Å; W282-V319 HydrophobicContact CD2-CG2 4.19Å; W282-V319 HydrophobicContact CE3-CG2 4.46Å; W282-V319 HydrophobicContact CG-CG2 4Å; R301-V319 HydrophobicContact CB-CG1 4.01Å; P303-V319 HydrophobicContact CB-CG2 4.17Å
320	R	94.1	Very high	88.9	Confident	76 Å²	76	74.4 Å²	74.4	29%	0.287	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	155.2	179.8	-54.4	-61.1	-178.6	-173.7	-0.3	109.9	R301 F302 D316	R301-R320 CarbonylContact C-O 3.6Å; R301-R320 WeakPolarHBondContact CA-O 3.44Å; R301-R320 VanDerWaalsContact CB-O 3.26Å; R301-R320 WeakPolarHBondContact CB-O 3.38Å; F302-R320 HydrophobicContact CD1-CB 3.99Å; F302-R320 HydrophobicContact CD2-CB 4.05Å; F302-R320 HydrophobicContact CD2-CG 4.38Å; F302-R320 HydrophobicContact CE1-CB 3.5Å; F302-R320 VanDerWaalsContact CE1-CB 3.5Å; F302-R320 HydrophobicContact CE2-CB 3.58Å; F302-R320 HydrophobicContact CE2-CG 3.75Å; F302-R320 HydrophobicContact CG-CB 4.25Å; F302-R320 HydrophobicContact CZ-CB 3.29Å; F302-R320 HydrophobicContact CZ-CG 3.84Å; F302-R320 PolarHBondContact N-O 2.99Å; F302-R320 PolarHBondContact O-N 2.85Å; D316-R320 PolarHBondContact O-NH2 2.89Å
321	S	94.1	Very high	89.3	Confident	58 Å²	58	64.8 Å²	64.8	41%	0.406	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	134.4	-174.6	-177.9	0	0	0	0	111.1	G323	S321-G323 VanDerWaalsContact C-N 3.27Å; S321-G323 PolarHBondContact OG-N 2.94Å
322	F	94.4	Very high	89.9	Confident	110 Å²	110	66.6 Å²	66.6	48%	0.482	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	6.8	166	-63.7	-53.1	0	0	0	112.1	V300 F302 Y332	V300-F322 HydrophobicContact CB-CB 4.38Å; V300-F322 HydrophobicContact CG1-CD2 3.84Å; V300-F322 PolarHBondContact O-N 3.23Å; F302-F322 HydrophobicContact CD1-CD2 4.23Å; F302-F322 AromaticContact CD1-CE2 3.67Å; F302-F322 HydrophobicContact CD1-CE2 3.67Å; F302-F322 AromaticContact CD1-CZ 3.93Å; F302-F322 HydrophobicContact CD1-CZ 3.93Å; F302-F322 HydrophobicContact CE1-CD1 4.43Å; F302-F322 HydrophobicContact CE1-CD2 4.23Å; F302-F322 AromaticContact CE1-CE1 3.82Å; F302-F322 HydrophobicContact CE1-CE1 3.82Å; F302-F322 AromaticContact CE1-CE2 3.59Å; F302-F322 HydrophobicContact CE1-CE2 3.59Å; F302-F322 AromaticContact CE1-CZ 3.35Å; F302-F322 HydrophobicContact CE1-CZ 3.35Å; F302-F322 HydrophobicContact CZ-CZ 4.14Å; F322-Y332 AromaticContact CD2-CE1 3.94Å; F322-Y332 HydrophobicContact CD2-CE1 3.94Å; F322-Y332 HydrophobicContact CE2-CE1 4.33Å
323	G	95.4	Very high	91.3	Very high	19 Å²	19	65 Å²	65	20%	0.196	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	80.3	-139.3	-178	0	0	0	0	0	112	S299 V300 S321 P325	S299-G323 VanDerWaalsContact CA-O 3.26Å; S299-G323 WeakPolarHBondContact CA-O 3.49Å; S299-G323 WeakPolarHBondContact CB-O 3.39Å; V300-G323 PolarHBondContact N-O 2.71Å; S321-G323 VanDerWaalsContact C-N 3.27Å; S321-G323 PolarHBondContact OG-N 2.94Å; G323-P325 WeakPolarHBondContact O-CD 3.48Å
324	F	97.1	Very high	92.9	Very high	57 Å²	57	63.2 Å²	63.2	25%	0.25	34%	0.335	C	S	.	.			trans	-121	83.2	-176.6	-65.4	-94.1	0	0	0	110.1	Q153 D297	Q153-F324 WeakPolarHBondContact O-CZ 3.45Å; D297-F324 WeakPolarHBondContact O-CE1 3.39Å
325	P	96.9	Very high	94.3	Very high	21 Å²	21	58.1 Å²	58.1	14%	0.136	31%	0.309	C	S	.	.			trans	-61.9	168.7	173.8	-20.3	33.5	0	0	0	112.2	W294 V300 G323 Y332	W294-P325 HydrophobicContact CH2-CB 4Å; W294-P325 HydrophobicContact CH2-CG 4.46Å; V300-P325 HydrophobicContact CB-CG 4.25Å; V300-P325 HydrophobicContact CG2-CG 3.83Å; G323-P325 WeakPolarHBondContact O-CD 3.48Å; P325-Y332 HydrophobicContact CB-CE2 3.93Å; P325-Y332 HydrophobicContact CG-CD2 4.47Å; P325-Y332 HydrophobicContact CG-CE2 3.64Å
326	R	97	Very high	95.3	Very high	193 Å²	193	53.7 Å²	53.7	73%	0.728	28%	0.28	S	S	*	.			trans	-65.3	132.9	178.4	-64.3	-177.3	-168.2	164.6	4.6	109.2	Q328 E329	R326-Q328 PolarHBondContact O-N 2.99Å; R326-E329 HydrophobicContact CB-CB 4.46Å; R326-E329 WeakPolarHBondContact O-CB 3.49Å; R326-E329 PolarHBondContact O-N 2.86Å
327	P	95.9	Very high	95.9	Very high	63 Å²	63	50.4 Å²	50.4	41%	0.409	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-23.2	-177.4	-28.6	36	0	0	0	115.2	T257 L258 E329	T257-P327 WeakPolarHBondContact CB-O 3.21Å; L258-P327 HydrophobicContact CB-CB 4.09Å; L258-P327 HydrophobicContact CD2-CB 4.22Å; L258-P327 PolarHBondContact N-O 2.92Å; P327-E329 VanDerWaalsContact C-N 3.33Å
328	Q	96.4	Very high	96.2	Very high	146 Å²	146	48 Å²	48	68%	0.682	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-2.9	177.3	-57.5	76.6	27.2	0	0	113.4	T257 R326 A330	T257-Q328 WeakPolarHBondContact CG2-O 3.09Å; R326-Q328 PolarHBondContact O-N 2.99Å; Q328-A330 PolarHBondContact O-N 2.84Å
329	E	93.8	Very high	96.1	Very high	82 Å²	82	55.2 Å²	55.2	38%	0.383	28%	0.278	S	S	.	.			trans	-77.7	113.2	-179.7	-169.5	174.7	161.1	0	0	110.9	R326 P327 A331	R326-E329 HydrophobicContact CB-CB 4.46Å; R326-E329 WeakPolarHBondContact O-CB 3.49Å; R326-E329 PolarHBondContact O-N 2.86Å; P327-E329 VanDerWaalsContact C-N 3.33Å; E329-A331 HydrophobicContact CG-CB 4Å; E329-A331 PolarHBondContact O-N 2.96Å
330	A	94.3	Very high	95.2	Very high	41 Å²	41	63 Å²	63	34%	0.339	32%	0.32	S	S	.	.			trans	-88.5	76	178	0	0	0	0	0	111	R255 T257 Q328	R255-A330 WeakPolarHBondContact CB-O 3.32Å; R255-A330 PolarHBondContact NE-O 2.61Å; T257-A330 HydrophobicContact CG2-CB 4Å; Q328-A330 PolarHBondContact O-N 2.84Å
331	A	94.3	Very high	95.3	Very high	35 Å²	35	62.4 Å²	62.4	29%	0.289	32%	0.322	S	S	.	.			trans	-130.3	-16.5	-175	0	0	0	0	0	114.8	E329	E329-A331 HydrophobicContact CG-CB 4Å; E329-A331 PolarHBondContact O-N 2.96Å
332	Y	97.3	Very high	95.3	Very high	48 Å²	48	62.6 Å²	62.6	19%	0.188	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	155.6	-167.4	-54.4	-70.5	0	0	0	112.1	G254 L256 G292 W294 V300 F322 P325	G254-Y332 CarbonylContact O-C 3.1Å; G254-Y332 VanDerWaalsContact O-O 3.11Å; L256-Y332 WeakPolarHBondContact CB-O 3.45Å; L256-Y332 PolarHBondContact N-O 2.79Å; G292-Y332 WeakPolarHBondContact O-CB 3.47Å; W294-Y332 HydrophobicContact CZ2-CD2 4.03Å; V300-Y332 HydrophobicContact CB-CD2 4.42Å; V300-Y332 HydrophobicContact CB-CG 4.44Å; V300-Y332 HydrophobicContact CG1-CD1 3.62Å; V300-Y332 HydrophobicContact CG1-CD2 4.08Å; V300-Y332 HydrophobicContact CG1-CE1 4Å; V300-Y332 HydrophobicContact CG1-CE2 4.44Å; V300-Y332 HydrophobicContact CG1-CG 3.64Å; V300-Y332 HydrophobicContact CG2-CD2 3.69Å; V300-Y332 HydrophobicContact CG2-CE2 4.09Å; V300-Y332 HydrophobicContact CG2-CG 4.02Å; F322-Y332 AromaticContact CD2-CE1 3.94Å; F322-Y332 HydrophobicContact CD2-CE1 3.94Å; F322-Y332 HydrophobicContact CE2-CE1 4.33Å; P325-Y332 HydrophobicContact CB-CE2 3.93Å; P325-Y332 HydrophobicContact CG-CD2 4.47Å; P325-Y332 HydrophobicContact CG-CE2 3.64Å
333	G	98.4	Very high	95.4	Very high	3 Å²	3	60 Å²	60	3%	0.031	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	-158.4	167.9	0	0	0	0	0	111	V252 G254 G292 G293 W294	V252-G333 CarbonylContact O-C 3.59Å; V252-G333 VanDerWaalsContact O-CA 3.31Å; V252-G333 WeakPolarHBondContact O-CA 3.42Å; G254-G333 PolarHBondContact O-N 3.36Å; G292-G333 PolarHBondContact O-N 2.91Å; G292-G333 VanDerWaalsContact O-N 3.12Å; G293-G333 VanDerWaalsContact CA-O 3.32Å; G293-G333 WeakPolarHBondContact CA-O 3.28Å; W294-G333 PolarHBondContact N-O 2.98Å
334	T	98.8	Very high	95.4	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	146.6	172.3	-174.4	0	0	0	0	111.8	F251 V252 L256 A261 A264 W294	F251-T334 WeakPolarHBondContact CD2-O 3.41Å; V252-T334 HydrophobicContact CB-CG2 3.87Å; V252-T334 HydrophobicContact CG2-CG2 4.48Å; V252-T334 PolarHBondContact N-O 2.69Å; V252-T334 PolarHBondContact O-N 3.29Å; L256-T334 HydrophobicContact CD1-CG2 4.02Å; A261-T334 HydrophobicContact CB-CG2 3.99Å; A264-T334 HydrophobicContact CB-CG2 4.4Å; W294-T334 PolarHBondContact O-OG1 2.98Å; W294-T334 VanDerWaalsContact O-OG1 3.08Å
335	Y	98.8	Very high	95.3	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	127.6	167.2	-65.9	-86.5	0	0	0	108.5	V249 F250 F251 A273 L278 L287 Q289 D291 W294 L295 R301 P303	V249-Y335 HydrophobicContact CG1-CD1 4.2Å; F250-Y335 WeakPolarHBondContact O-CA 3.47Å; F251-Y335 HydrophobicContact CB-CD1 4.15Å; F251-Y335 HydrophobicContact CB-CE1 3.96Å; F251-Y335 HydrophobicContact CD2-CD1 4.06Å; F251-Y335 HydrophobicContact CD2-CD2 4.32Å; F251-Y335 AromaticContact CD2-CE1 3.75Å; F251-Y335 HydrophobicContact CD2-CE1 3.75Å; F251-Y335 AromaticContact CD2-CE2 3.98Å; F251-Y335 HydrophobicContact CD2-CE2 3.98Å; F251-Y335 HydrophobicContact CD2-CG 4.34Å; F251-Y335 AromaticContact CD2-CZ 3.68Å; F251-Y335 HydrophobicContact CE2-CE2 4.27Å; F251-Y335 HydrophobicContact CG-CE1 4.23Å; A273-Y335 WeakPolarHBondContact CB-O 3.12Å; A273-Y335 PolarHBondContact N-O 2.93Å; L278-Y335 HydrophobicContact CD1-CD1 3.72Å; L278-Y335 HydrophobicContact CD1-CD2 4.15Å; L278-Y335 HydrophobicContact CD1-CE1 3.97Å; L278-Y335 HydrophobicContact CD1-CE2 4.41Å; L278-Y335 HydrophobicContact CD1-CG 3.82Å; L287-Y335 HydrophobicContact CD2-CD1 4.23Å; L287-Y335 HydrophobicContact CD2-CE1 4.24Å; Q289-Y335 HydrophobicContact CB-CE1 4.18Å; Q289-Y335 WeakPolarHBondContact CB-OH 3.44Å; Q289-Y335 HydrophobicContact CG-CE1 4.25Å; Q289-Y335 VanDerWaalsContact CG-OH 3.24Å; Q289-Y335 WeakPolarHBondContact CG-OH 3.21Å; D291-Y335 PolarHBondContact O-OH 3Å; W294-Y335 PolarHBondContact O-N 2.92Å; L295-Y335 HydrophobicContact CD2-CD2 4.23Å; L295-Y335 HydrophobicContact CD2-CG 4.46Å; R301-Y335 VanDerWaalsContact O-CE2 3.25Å; R301-Y335 WeakPolarHBondContact O-CE2 3.21Å; P303-Y335 WeakPolarHBondContact CD-OH 3.36Å; P303-Y335 HydrophobicContact CG-CE1 4.33Å
336	C	98.8	Very high	95.2	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	147.1	176.9	-55.6	0	0	0	0	109.8	V249 F250 V252 C265 A270 V271	V249-C336 CarbonylContact C-O 3.57Å; V249-C336 VanDerWaalsContact CA-O 3.27Å; V249-C336 WeakPolarHBondContact CA-O 3.33Å; F250-C336 HydrophobicContact CD1-CB 4.43Å; F250-C336 HydrophobicContact CD2-CB 4.19Å; F250-C336 HydrophobicContact CE1-CB 3.91Å; F250-C336 HydrophobicContact CE2-CB 3.64Å; F250-C336 HydrophobicContact CZ-CB 3.49Å; F250-C336 VanDerWaalsContact CZ-CB 3.49Å; F250-C336 PolarHBondContact N-O 3.07Å; F250-C336 PolarHBondContact O-N 3.09Å; V252-C336 VanDerWaalsContact CG2-SG 3.55Å; C265-C336 WeakPolarHBondContact CA-SG 3.46Å; C265-C336 HydrophobicContact CB-CB 3.76Å; C265-C336 WeakPolarHBondContact CB-SG 3.47Å; C265-C336 VanDerWaalsContact SG-CA 3.53Å; C265-C336 WeakPolarHBondContact SG-CB 3.23Å; C265-C336 CovalentContact SG-SG 2.03Å; C265-C336 PolarHBondContact SG-SG 3.23Å; A270-C336 HydrophobicContact CB-CB 3.86Å; V271-C336 CarbonylContact O-C 3.04Å; V271-C336 VanDerWaalsContact O-CA 3.26Å; V271-C336 WeakPolarHBondContact O-CA 3.33Å
337	Y	98.6	Very high	95.1	Very high	15 Å²	15	56.4 Å²	56.4	6%	0.059	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.9	173.1	175	-108.6	0	0	0	109.7	L245 G247 Q248 V249 A270 V271 H277 E339	L245-Y337 HydrophobicContact CB-CE2 4.16Å; L245-Y337 HydrophobicContact CD1-CD2 4.18Å; L245-Y337 HydrophobicContact CD1-CE2 3.9Å; L245-Y337 HydrophobicContact CD2-CE2 4.49Å; L245-Y337 HydrophobicContact CG-CE2 4.41Å; G247-Y337 PolarHBondContact N-OH 3.49Å; Q248-Y337 WeakPolarHBondContact O-CA 3.28Å; Q248-Y337 WeakPolarHBondContact O-CD2 3.43Å; V249-Y337 HydrophobicContact CG2-CD2 3.91Å; A270-Y337 WeakPolarHBondContact CA-O 3.37Å; A270-Y337 WeakPolarHBondContact CB-O 3.21Å; V271-Y337 HydrophobicContact CG2-CD1 4.29Å; V271-Y337 PolarHBondContact N-O 3.34Å; V271-Y337 PolarHBondContact O-N 2.95Å; H277-Y337 HydrophobicContact CB-CD2 4.43Å; H277-Y337 AromaticContact CE1-CD1 3.37Å; H277-Y337 WeakPolarHBondContact CE1-CD1 3.32Å; H277-Y337 AromaticContact CE1-CE1 3.76Å; H277-Y337 AromaticContact CE1-CG 3.7Å; H277-Y337 WeakPolarHBondContact ND1-CB 3.23Å; H277-Y337 AromaticContact ND1-CD1 3.56Å; H277-Y337 AromaticContact ND1-CD2 3.93Å; H277-Y337 AromaticContact ND1-CG 3.36Å; Y337-E339 HydrophobicContact CD1-CG 4.4Å; Y337-E339 HydrophobicContact CE1-CG 3.46Å; Y337-E339 VanDerWaalsContact CE1-CG 3.46Å
338	A	97.7	Very high	95	Very high	17 Å²	17	55.9 Å²	55.9	14%	0.14	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.9	171.9	0	0	0	0	0	108.7	G247 Q248 F250 A270	G247-A338 CarbonylContact C-O 3.6Å; G247-A338 VanDerWaalsContact CA-O 3.24Å; G247-A338 WeakPolarHBondContact CA-O 3.4Å; Q248-A338 HydrophobicContact CG-CB 4.45Å; Q248-A338 PolarHBondContact N-O 3.39Å; Q248-A338 PolarHBondContact O-N 3.39Å; F250-A338 HydrophobicContact CE1-CB 4.12Å; A270-A338 HydrophobicContact CB-CB 4.2Å
339	E	90.4	Very high	94.9	Very high	159 Å²	159	48.4 Å²	48.4	74%	0.743	26%	0.262	S	S	*	.			trans	-68.5	147.6	167.5	-67.9	-175.4	172.1	0	0	109.5	Y337	Y337-E339 HydrophobicContact CD1-CG 4.4Å; Y337-E339 HydrophobicContact CE1-CG 3.46Å; Y337-E339 VanDerWaalsContact CE1-CG 3.46Å
340	N	77.3	Confident	95	Very high	181 Å²	181	45.4 Å²	45.4	97%	0.968	25%	0.251	S	S	*	.			trans	-76.7	0	178.4	-80.5	-18.1	0	0	0	112.5	A246	A246-N340 WeakPolarHBondContact O-CB 3.19Å; A246-N340 VanDerWaalsContact O-CG 3.28Å; A246-N340 PolarHBondContact O-ND2 3.42Å

Retrieved 340 of 340 residues in 311.4 ms (Link to these results)

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