A0A087YGV7_POEFO Loading...

Hyaluronan and proteoglycan link protein 1

Stabilizes the aggregates of proteoglycan monomers with hyaluronic acid in the extracellular cartilage matrix.

AlphaFold DB , UniProt , Accession A0A087YGV7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 353 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.5	Very low	37.8	Very low	233 Å²	233	143.2 Å²	143.2	100%	1.148	83%	0.833	S	S	*	*				0	100.3	0	-65.6	-174.7	-67.4	0	0	105.9
2	I	29.1	Very low	37.8	Very low	168 Å²	168	145 Å²	145	86%	0.862	84%	0.835	S	S	*	*				64.2	133	97.2	-63.6	177.3	0	0	0	112.4
3	P	48.3	Very low	37.8	Very low	103 Å²	103	142.9 Å²	142.9	67%	0.669	84%	0.835	S	S	*	*			trans	-115.7	175.7	-149.2	41.3	-27.1	0	0	0	113.7
4	V	35.3	Very low	38.2	Very low	136 Å²	136	142.3 Å²	142.3	82%	0.824	83%	0.833	S	S	*	*			trans	-162.8	117.6	151.3	-175.9	0	0	0	0	105.7
5	L	39.8	Very low	38.4	Very low	139 Å²	139	139 Å²	139	73%	0.728	83%	0.829	S	S	*	*			cis	74.4	91	40.4	-129.5	139.2	0	0	0	114.7
6	I	41.8	Very low	38.7	Very low	168 Å²	168	141 Å²	141	86%	0.862	83%	0.827	S	S	*	*			trans	-136.7	114.8	152.3	-60.9	-176.2	0	0	0	109
7	C	34.4	Very low	39.1	Very low	102 Å²	102	140.5 Å²	140.5	69%	0.689	83%	0.826	S	S	*	*			trans	-76.9	147.1	169.8	-71.4	0	0	0	0	110.6
8	A	38.4	Very low	39.8	Very low	104 Å²	104	138.9 Å²	138.9	86%	0.86	81%	0.814	S	S	*	*			trans	-117.6	122.7	157.9	0	0	0	0	0	108.7
9	L	35.3	Very low	40.1	Very low	171 Å²	171	139.9 Å²	139.9	90%	0.895	81%	0.814	S	S	*	*			trans	-79.6	132.3	-178.2	-70.9	155.6	0	0	0	110.2
10	V	40.3	Very low	40.4	Very low	140 Å²	140	141.1 Å²	141.1	85%	0.848	82%	0.817	S	S	*	*			trans	-117.7	114.1	155.1	178.8	0	0	0	0	106.5
11	S	37.4	Very low	40.9	Very low	111 Å²	111	140.7 Å²	140.7	78%	0.776	81%	0.81	S	S	*	*			trans	-86.4	127.2	174.4	54.8	0	0	0	0	109.1
12	L	37.5	Very low	41.4	Very low	165 Å²	165	135.4 Å²	135.4	86%	0.864	79%	0.786	S	S	*	*			trans	-102.6	117.5	161.8	-83	155.6	0	0	0	106.1
13	S	38	Very low	42.3	Very low	118 Å²	118	136 Å²	136	83%	0.825	78%	0.779	S	S	*	*			trans	-120.2	121.7	162.2	63.2	0	0	0	0	107.9
14	V	44.1	Very low	42	Very low	134 Å²	134	137.1 Å²	137.1	81%	0.812	79%	0.786	S	S	*	*			trans	-92.5	121.9	176.1	-174.9	0	0	0	0	105.8
15	A	40	Very low	42.6	Very low	93 Å²	93	139.6 Å²	139.6	77%	0.769	79%	0.789	S	S	*	*			trans	-109.3	112.4	169.6	0	0	0	0	0	108.2
16	E	44.4	Very low	43	Very low	171 Å²	171	139.6 Å²	139.6	80%	0.799	79%	0.789	S	S	*	*			trans	-67.1	122.8	173.9	-70.5	173.1	154.8	0	0	110.2	N18	E16-N18 PolarHBondContact O-N 3.4Å
17	T	45.6	Very low	43.2	Very low	133 Å²	133	140.1 Å²	140.1	82%	0.816	79%	0.787	S	S	*	*			trans	-84.2	91	173.5	49.1	0	0	0	0	109.9
18	N	50.6	Low	43.9	Very low	112 Å²	112	143.9 Å²	143.9	60%	0.599	80%	0.795	S	S	*	*			trans	-93.8	77.3	164.3	-96.8	-52.8	0	0	0	109.4	E16 I21	E16-N18 PolarHBondContact O-N 3.4Å; N18-I21 WeakPolarHBondContact OD1-CD1 3.45Å
19	L	45.3	Very low	44.3	Very low	158 Å²	158	143.3 Å²	143.3	83%	0.827	78%	0.784	S	S	*	*			trans	-105	-1.1	173.9	-145.1	81.1	0	0	0	113.4
20	D	46.3	Very low	44.8	Very low	163 Å²	163	146 Å²	146	87%	0.872	78%	0.782	S	S	*	*	S	Bend	trans	-91.9	-2.3	-177.4	-71.1	-29.4	0	0	0	114
21	I	51.1	Low	45.2	Very low	132 Å²	132	143.4 Å²	143.4	68%	0.677	77%	0.767	S	S	*	*	S	Bend	trans	-98.9	-10.7	-172.6	-59.4	178.6	0	0	0	113	N18	N18-I21 WeakPolarHBondContact OD1-CD1 3.45Å
22	L	45.8	Very low	46.1	Very low	123 Å²	123	144 Å²	144	64%	0.644	76%	0.76	S	S	*	*	S	Bend	trans	-100.5	-7.8	-164.9	-126.5	119.5	0	0	0	117.2
23	Y	47.7	Very low	46.7	Very low	181 Å²	181	145.3 Å²	145.3	71%	0.71	76%	0.755	S	S	*	*			trans	-148.6	87.7	-178.4	-66.3	-80.5	0	0	0	113.8	E25	Y23-E25 VanDerWaalsContact C-N 3.33Å; Y23-E25 PolarHBondContact O-N 3.04Å
24	P	42.7	Very low	47.4	Very low	125 Å²	125	145.9 Å²	145.9	81%	0.812	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	8.8	-178.9	27	-20.8	0	0	0	115.1
25	E	49.2	Very low	47.9	Very low	188 Å²	188	144.2 Å²	144.2	88%	0.879	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113	15.2	-174.3	-75.7	-169.1	159.2	0	0	115.8	Y23	Y23-E25 VanDerWaalsContact C-N 3.33Å; Y23-E25 PolarHBondContact O-N 3.04Å
26	L	46.6	Very low	48.5	Very low	140 Å²	140	149 Å²	149	73%	0.733	75%	0.75	S	S	*	*			trans	-91.1	9	178	-94.5	153.5	0	0	0	115.1	H28	L26-H28 VanDerWaalsContact C-N 3.29Å; L26-H28 PolarHBondContact O-N 3.29Å
27	E	46	Very low	49	Very low	178 Å²	178	148.3 Å²	148.3	83%	0.832	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	70.1	169.1	-77.1	-160.1	155.8	0	0	111.4
28	H	49.3	Very low	49.4	Very low	182 Å²	182	143.4 Å²	143.4	84%	0.843	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.8	25	149.4	-98.9	90.9	0	0	0	111.7	L26 R30	L26-H28 VanDerWaalsContact C-N 3.29Å; L26-H28 PolarHBondContact O-N 3.29Å; H28-R30 VanDerWaalsContact C-N 3.34Å; H28-R30 PolarHBondContact O-N 3.11Å
29	S	46.8	Very low	49.8	Very low	91 Å²	91	140 Å²	140	64%	0.636	71%	0.712	S	S	*	*			trans	-71.9	91.5	162.7	170.8	0	0	0	0	108.7	T31	S29-T31 PolarHBondContact O-N 3.44Å
30	R	46.4	Very low	51	Low	227 Å²	227	139.2 Å²	139.2	86%	0.857	70%	0.702	S	S	*	*			trans	-67.3	91.4	159.9	-85.7	-175.4	177.3	179.7	0	107.4	H28 I32	H28-R30 VanDerWaalsContact C-N 3.34Å; H28-R30 PolarHBondContact O-N 3.11Å; R30-I32 PolarHBondContact O-N 3.27Å
31	T	49	Very low	52.8	Low	86 Å²	86	132.6 Å²	132.6	53%	0.528	67%	0.665	S	S	.	*			trans	-63.4	106.6	167.1	-53.3	0	0	0	0	107.6	S29 Y33	S29-T31 PolarHBondContact O-N 3.44Å; T31-Y33 HydrophobicContact CG2-CE1 4.21Å; T31-Y33 HydrophobicContact CG2-CE2 4.33Å; T31-Y33 PolarHBondContact O-N 2.92Å
32	I	55.7	Low	54.6	Low	124 Å²	124	128.2 Å²	128.2	64%	0.636	64%	0.643	S	S	*	*			trans	-81.9	107.6	172.6	-59.7	174.7	0	0	0	106.4	R30 V34	R30-I32 PolarHBondContact O-N 3.27Å; I32-V34 HydrophobicContact CG2-CG2 4.25Å; I32-V34 PolarHBondContact O-N 2.84Å
33	Y	51	Low	56.9	Low	193 Å²	193	122.8 Å²	122.8	76%	0.757	62%	0.615	S	S	*	*			trans	-73.4	103.6	169.8	-62.3	-82.6	0	0	0	108.3	T31 T35	T31-Y33 HydrophobicContact CG2-CE1 4.21Å; T31-Y33 HydrophobicContact CG2-CE2 4.33Å; T31-Y33 PolarHBondContact O-N 2.92Å; Y33-T35 PolarHBondContact O-N 3Å
34	V	51.8	Low	59	Low	130 Å²	130	118.1 Å²	118.1	79%	0.788	60%	0.601	S	S	*	*			trans	-81.4	100.3	168.1	-177.4	0	0	0	0	106.7	I32 E36	I32-V34 HydrophobicContact CG2-CG2 4.25Å; I32-V34 PolarHBondContact O-N 2.84Å; V34-E36 PolarHBondContact O-N 2.85Å
35	T	54.8	Low	61.4	Low	98 Å²	98	113.4 Å²	113.4	60%	0.601	57%	0.572	S	S	*	*			trans	-70.6	121.5	170.5	41.2	0	0	0	0	109	Y33 N37 G38	Y33-T35 PolarHBondContact O-N 3Å; T35-N37 PolarHBondContact O-N 2.84Å; T35-G38 PolarHBondContact O-N 3.39Å; T35-G38 VanDerWaalsContact O-N 3.15Å
36	E	52.9	Low	63.2	Low	193 Å²	193	111.5 Å²	111.5	90%	0.902	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-12.9	179.9	-138.5	173.9	-173.6	0	0	113.3	V34	V34-E36 PolarHBondContact O-N 2.85Å
37	N	54.4	Low	65.3	Low	158 Å²	158	110 Å²	110	85%	0.845	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.1	53	174.2	-64.6	-51.8	0	0	0	111	T35	T35-N37 PolarHBondContact O-N 2.84Å
38	G	53.7	Low	67.5	Low	30 Å²	30	104.9 Å²	104.9	31%	0.309	54%	0.54	S	S	.	.			trans	-65.4	162.2	172.6	0	0	0	0	0	112.8	T35	T35-G38 PolarHBondContact O-N 3.39Å; T35-G38 VanDerWaalsContact O-N 3.15Å
39	P	58.7	Low	69.7	Low	40 Å²	40	101 Å²	101	26%	0.26	52%	0.521	S	S	.	.			trans	-57.3	139.5	178.8	24.5	-33.2	0	0	0	111.4	F41 E67 L70	P39-F41 PolarHBondContact O-N 3.26Å; P39-E67 WeakPolarHBondContact CA-OE2 3.5Å; P39-E67 HydrophobicContact CB-CB 4.37Å; P39-L70 HydrophobicContact CB-CD1 3.68Å; P39-L70 HydrophobicContact CB-CD2 4.49Å; P39-L70 HydrophobicContact CB-CG 3.7Å; P39-L70 HydrophobicContact CG-CD1 3.77Å; P39-L70 HydrophobicContact CG-CD2 3.74Å; P39-L70 HydrophobicContact CG-CG 3.49Å; P39-L70 VanDerWaalsContact CG-CG 3.49Å
40	K	72.1	Confident	72	Confident	142 Å²	142	97.1 Å²	97.1	62%	0.617	49%	0.494	S	S	*	.			trans	-75.8	115.5	-178.6	-66	-178.7	-178	174.1	0	111	E67	K40-E67 HydrophobicContact CB-CG 4.13Å; K40-E67 PolarHBondContact N-OE2 3.25Å; K40-E67 PolarHBondContact O-N 3.45Å; K40-E67 VanDerWaalsContact O-N 3.08Å
41	F	83.2	Confident	74.4	Confident	23 Å²	23	89.9 Å²	89.9	10%	0.101	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	119.5	163.1	177.4	-93.3	0	0	0	108.1	P39 V43 I64 M76 V140 D142 E145 D147	P39-F41 PolarHBondContact O-N 3.26Å; F41-V43 HydrophobicContact CE1-CG2 4.22Å; F41-V43 HydrophobicContact CZ-CG2 4.38Å; F41-I64 HydrophobicContact CD2-CG2 4.22Å; F41-I64 HydrophobicContact CE2-CG2 3.56Å; F41-I64 HydrophobicContact CZ-CG2 4.13Å; F41-M76 HydrophobicContact CE2-CE 4.37Å; F41-V140 HydrophobicContact CE1-CB 4.5Å; F41-V140 WeakPolarHBondContact CE1-O 3.35Å; F41-V140 HydrophobicContact CZ-CB 3.98Å; F41-V140 HydrophobicContact CZ-CG1 3.74Å; F41-D142 HydrophobicContact CD2-CB 4.22Å; F41-D142 HydrophobicContact CE2-CB 3.73Å; F41-D142 HydrophobicContact CZ-CB 3.94Å; F41-E145 HydrophobicContact CB-CB 4.27Å; F41-E145 WeakPolarHBondContact CB-OE2 3.5Å; F41-E145 HydrophobicContact CD1-CB 4.18Å; F41-E145 HydrophobicContact CG-CB 4.28Å; F41-D147 HydrophobicContact CD1-CB 4.09Å; F41-D147 HydrophobicContact CE1-CB 4.04Å
42	N	89.7	Confident	76.6	Confident	40 Å²	40	86.6 Å²	86.6	21%	0.214	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	148	178.3	63.2	-48.4	0	0	0	111.7	M44 Q65 D147	N42-M44 PolarHBondContact ND2-SD 3.25Å; N42-M44 VanDerWaalsContact ND2-SD 3.43Å; N42-Q65 PolarHBondContact N-O 2.88Å; N42-Q65 PolarHBondContact ND2-OE1 2.62Å; N42-Q65 PolarHBondContact O-N 2.81Å; N42-Q65 WeakPolarHBondContact OD1-CB 3.05Å; N42-Q65 VanDerWaalsContact OD1-CG 3.25Å; N42-Q65 WeakPolarHBondContact OD1-CG 3.44Å; N42-Q65 PolarHBondContact OD1-O 3.31Å; N42-Q65 VanDerWaalsContact OD1-O 3.09Å; N42-Q65 PolarHBondContact OD1-OE1 3.33Å; N42-D147 WeakPolarHBondContact CA-OD2 3.38Å
43	V	92.1	Very high	78.3	Confident	9 Å²	9	87.7 Å²	87.7	6%	0.055	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128	176.5	178.4	0	0	0	0	108.1	F41 C62 L63 V140 D147 V149	F41-V43 HydrophobicContact CE1-CG2 4.22Å; F41-V43 HydrophobicContact CZ-CG2 4.38Å; V43-C62 WeakPolarHBondContact CG1-SG 3.32Å; V43-L63 WeakPolarHBondContact CA-O 3.27Å; V43-V140 HydrophobicContact CG1-CG2 4.33Å; V43-V140 HydrophobicContact CG2-CB 3.71Å; V43-V140 HydrophobicContact CG2-CG2 3.7Å; V43-D147 HydrophobicContact CB-CB 4.2Å; V43-D147 HydrophobicContact CG2-CB 3.93Å; V43-D147 PolarHBondContact N-OD2 2.53Å; V43-V149 HydrophobicContact CG1-CB 4.06Å; V43-V149 HydrophobicContact CG1-CG1 3.63Å
44	M	93.4	Very high	80.4	Confident	83 Å²	83	82.2 Å²	82.2	41%	0.409	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	150.2	-177.1	-61.3	-173.6	-62.2	0	0	110.9	N42 L63 Q65	N42-M44 PolarHBondContact ND2-SD 3.25Å; N42-M44 VanDerWaalsContact ND2-SD 3.43Å; M44-L63 PolarHBondContact N-O 2.84Å; M44-L63 PolarHBondContact O-N 2.79Å; M44-Q65 HydrophobicContact CE-CB 3.93Å; M44-Q65 HydrophobicContact CE-CG 4.49Å
45	A	91.8	Very high	82.3	Confident	26 Å²	26	76.9 Å²	76.9	22%	0.215	40%	0.4	C	S	.	.			trans	-114.3	121.9	168.1	0	0	0	0	0	107.6	Q47 P61 V149 V151	A45-Q47 PolarHBondContact O-N 2.8Å; A45-P61 HydrophobicContact CB-CG 4.16Å; A45-V149 HydrophobicContact CB-CB 4.5Å; A45-V149 HydrophobicContact CB-CG1 4.17Å; A45-V149 HydrophobicContact CB-CG2 3.54Å; A45-V151 HydrophobicContact CB-CG2 3.82Å
46	E	88.4	Confident	84.2	Confident	149 Å²	149	72.8 Å²	72.8	70%	0.696	38%	0.377	S	S	*	.	S	Bend	trans	-56.6	-32.3	174.1	-64.4	-175.2	165.2	0	0	111.4	L63	E46-L63 HydrophobicContact CG-CD1 3.67Å; E46-L63 WeakPolarHBondContact OE1-CD1 3.49Å
47	Q	90.3	Very high	86.2	Confident	109 Å²	109	68.7 Å²	68.7	51%	0.509	36%	0.362	S	S	.	.			trans	-132.4	116.8	179.7	-63.9	158	22.7	0	0	109.3	A45 K49 V50 P61	A45-Q47 PolarHBondContact O-N 2.8Å; Q47-K49 PolarHBondContact O-N 3.39Å; Q47-V50 HydrophobicContact CB-CG1 4.45Å; Q47-P61 HydrophobicContact CB-CG 4.28Å; Q47-P61 WeakPolarHBondContact O-CG 3.11Å
48	A	92	Very high	88.3	Confident	69 Å²	69	61.9 Å²	61.9	57%	0.57	33%	0.326	S	S	*	.	S	Bend	trans	-72.1	-14.1	176.3	0	0	0	0	0	113.3	S152	A48-S152 PolarHBondContact O-N 3.17Å
49	K	95.3	Very high	90.3	Very high	101 Å²	101	62.9 Å²	62.9	44%	0.439	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	127.1	-178	170.6	176.4	163.4	153.8	0	109.4	Q47 V51 S152 E154	Q47-K49 PolarHBondContact O-N 3.39Å; K49-V51 HydrophobicContact CG-CG2 4.47Å; K49-S152 WeakPolarHBondContact CA-O 3.32Å; K49-E154 HydrophobicContact CD-CG 4.48Å; K49-E154 WeakPolarHBondContact CD-OE1 3.36Å; K49-E154 WeakPolarHBondContact CE-OE1 3.43Å; K49-E154 WeakPolarHBondContact CE-OE2 3.48Å; K49-E154 HydrophobicContact CG-CG 4.37Å; K49-E154 IonicContact NZ-OE1 3.37Å; K49-E154 PolarHBondContact NZ-OE1 3.05Å; K49-E154 IonicContact NZ-OE2 2.77Å; K49-E154 PolarHBondContact NZ-OE2 2.87Å
50	V	96.4	Very high	92.2	Very high	10 Å²	10	61 Å²	61	6%	0.061	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	141.2	173.4	-61.9	0	0	0	0	109.3	Q47 V58 L60 V151 S152 L153 E154	Q47-V50 HydrophobicContact CB-CG1 4.45Å; V50-V58 HydrophobicContact CB-CG2 4.01Å; V50-V58 HydrophobicContact CG2-CG2 3.63Å; V50-L60 HydrophobicContact CG2-CD2 3.62Å; V50-V151 HydrophobicContact CG1-CG1 4.33Å; V50-V151 HydrophobicContact CG2-CG1 4.19Å; V50-S152 PolarHBondContact N-O 3.47Å; V50-L153 HydrophobicContact CG2-CD1 3.9Å; V50-E154 PolarHBondContact O-N 3.07Å
51	V	95.4	Very high	93.4	Very high	74 Å²	74	54.8 Å²	54.8	45%	0.448	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	132.3	-177.3	-176.5	0	0	0	0	108.6	K49 E154 E156	K49-V51 HydrophobicContact CG-CG2 4.47Å; V51-E154 WeakPolarHBondContact CA-O 2.87Å; V51-E154 HydrophobicContact CG2-CB 4.25Å; V51-E156 HydrophobicContact CG1-CG 3.54Å
52	T	95.3	Very high	94	Very high	18 Å²	18	53.7 Å²	53.7	11%	0.11	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	-174	173.1	-165.3	0	0	0	0	110.3	N57 V58 V128 L153 E154 L155 E156	T52-N57 PolarHBondContact OG1-O 3.05Å; T52-V58 HydrophobicContact CG2-CB 4.12Å; T52-V58 HydrophobicContact CG2-CG1 4.43Å; T52-V58 HydrophobicContact CG2-CG2 4.49Å; T52-V128 HydrophobicContact CG2-CB 4.21Å; T52-V128 HydrophobicContact CG2-CG1 3.93Å; T52-V128 HydrophobicContact CG2-CG2 4.14Å; T52-L153 HydrophobicContact CG2-CD1 3.78Å; T52-E154 PolarHBondContact N-O 3.06Å; T52-L155 HydrophobicContact CG2-CD2 3.63Å; T52-L155 CarbonylContact O-C 3.56Å; T52-L155 VanDerWaalsContact O-CA 3.31Å; T52-L155 WeakPolarHBondContact O-CA 3.45Å; T52-E156 PolarHBondContact O-N 3.13Å
53	R	92.7	Very high	94.3	Very high	146 Å²	146	54.3 Å²	54.3	55%	0.551	29%	0.286	S	S	*	.			trans	-122.3	158.1	174.9	63.7	-173.8	-179.6	-165.1	-0.8	110.1	G55 G56 F255	R53-G55 PolarHBondContact O-N 3.27Å; R53-G56 WeakPolarHBondContact O-CA 3.39Å; R53-G56 PolarHBondContact O-N 3.38Å; R53-F255 HydrophobicContact CB-CB 4.33Å; R53-F255 HydrophobicContact CB-CD2 3.73Å; R53-F255 HydrophobicContact CB-CE2 4.48Å; R53-F255 HydrophobicContact CB-CG 4.34Å
54	R	93.6	Very high	94.3	Very high	78 Å²	78	54.4 Å²	54.4	29%	0.294	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	133.1	174.6	-177.7	-178.2	-176.4	178.2	2.2	111.4	G56 V128 D184 S254 F255 H256	R54-G56 PolarHBondContact O-N 3.24Å; R54-V128 CarbonylContact C-O 3.58Å; R54-V128 WeakPolarHBondContact CA-O 3.42Å; R54-D184 IonicContact CZ-OD1 3.47Å; R54-D184 IonicContact NH1-OD1 2.75Å; R54-D184 PolarHBondContact NH1-OD1 3.16Å; R54-D184 IonicContact NH1-OD2 3.34Å; R54-D184 IonicContact NH2-OD1 3.22Å; R54-D184 PolarHBondContact NH2-OD1 3.32Å; R54-S254 PolarHBondContact N-OG 3.49Å; R54-F255 WeakPolarHBondContact CB-O 3.4Å; R54-H256 PolarHBondContact NH1-NE2 3.41Å
55	G	93.1	Very high	94.1	Very high	18 Å²	18	55.2 Å²	55.2	19%	0.186	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	7.8	-176.2	0	0	0	0	0	115	R53 D127 V128 K257	R53-G55 PolarHBondContact O-N 3.27Å; G55-D127 WeakPolarHBondContact CA-OD1 3.5Å; G55-V128 PolarHBondContact N-O 3.18Å; G55-K257 PolarHBondContact O-NZ 3.03Å
56	G	93.4	Very high	93.5	Very high	13 Å²	13	56.2 Å²	56.2	13%	0.134	29%	0.287	C	S	.	.			trans	-81.9	177.8	169.9	0	0	0	0	0	112.2	R53 R54 D127 V128	R53-G56 WeakPolarHBondContact O-CA 3.39Å; R53-G56 PolarHBondContact O-N 3.38Å; R54-G56 PolarHBondContact O-N 3.24Å; G56-D127 PolarHBondContact O-N 2.73Å; G56-V128 WeakPolarHBondContact O-CG2 3.43Å; G56-V128 PolarHBondContact O-N 2.92Å
57	N	96.1	Very high	92.8	Very high	107 Å²	107	53.1 Å²	53.1	57%	0.572	27%	0.273	S	S	*	.			trans	-110.4	151.6	171.5	-60.9	-11.3	0	0	0	108.5	T52 M125 T126 D127	T52-N57 PolarHBondContact OG1-O 3.05Å; N57-M125 CarbonylContact C-O 3.53Å; N57-M125 VanDerWaalsContact CA-O 3.29Å; N57-M125 WeakPolarHBondContact CA-O 3.42Å; N57-T126 VanDerWaalsContact OD1-CA 3.29Å; N57-T126 WeakPolarHBondContact OD1-CA 3.36Å; N57-T126 WeakPolarHBondContact OD1-CB 3.47Å; N57-D127 PolarHBondContact OD1-N 2.82Å
58	V	96.9	Very high	91.5	Very high	14 Å²	14	57.4 Å²	57.4	9%	0.085	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	150.2	179.2	68.2	0	0	0	0	110.1	V50 T52 V124 M125 V128 L153	V50-V58 HydrophobicContact CB-CG2 4.01Å; V50-V58 HydrophobicContact CG2-CG2 3.63Å; T52-V58 HydrophobicContact CG2-CB 4.12Å; T52-V58 HydrophobicContact CG2-CG1 4.43Å; T52-V58 HydrophobicContact CG2-CG2 4.49Å; V58-V124 WeakPolarHBondContact O-CA 3.39Å; V58-M125 HydrophobicContact CG1-CB 4Å; V58-M125 PolarHBondContact N-O 3.43Å; V58-M125 PolarHBondContact O-N 2.75Å; V58-V128 HydrophobicContact CG1-CG2 3.79Å; V58-L153 HydrophobicContact CB-CD1 4.3Å; V58-L153 HydrophobicContact CG1-CD1 3.85Å; V58-L153 HydrophobicContact CG1-CD2 4.22Å; V58-L153 HydrophobicContact CG2-CD1 3.93Å
59	T	97.5	Very high	89.9	Confident	51 Å²	51	62.4 Å²	62.4	31%	0.313	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.7	170.7	-60.6	0	0	0	0	108.3	P61 L123	T59-P61 WeakPolarHBondContact O-CD 3.36Å; T59-L123 CarbonylContact C-O 3.53Å; T59-L123 WeakPolarHBondContact CA-O 3.34Å
60	L	97.9	Very high	88.1	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	108.3	170.7	-57.9	172.4	0	0	0	107.9	V50 W80 S122 L123 Y136 V151 L153	V50-L60 HydrophobicContact CG2-CD2 3.62Å; L60-W80 HydrophobicContact CB-CH2 3.46Å; L60-W80 VanDerWaalsContact CB-CH2 3.46Å; L60-W80 HydrophobicContact CB-CZ2 4.08Å; L60-W80 HydrophobicContact CB-CZ3 3.85Å; L60-W80 HydrophobicContact CD1-CE3 4.34Å; L60-W80 HydrophobicContact CD1-CH2 4.46Å; L60-W80 HydrophobicContact CD1-CZ3 4.03Å; L60-W80 WeakPolarHBondContact O-CZ2 3Å; L60-S122 CarbonylContact O-C 3.55Å; L60-S122 VanDerWaalsContact O-CA 3.23Å; L60-S122 WeakPolarHBondContact O-CA 3.16Å; L60-S122 WeakPolarHBondContact O-CB 3.25Å; L60-L123 HydrophobicContact CB-CB 4.34Å; L60-L123 HydrophobicContact CD1-CD2 4.25Å; L60-L123 PolarHBondContact N-O 3.41Å; L60-L123 PolarHBondContact O-N 2.84Å; L60-Y136 HydrophobicContact CD1-CD1 3.9Å; L60-Y136 HydrophobicContact CD1-CD2 4Å; L60-Y136 HydrophobicContact CD1-CG 3.61Å; L60-V151 HydrophobicContact CB-CG1 4.43Å; L60-V151 HydrophobicContact CD2-CB 4.42Å; L60-V151 HydrophobicContact CD2-CG1 3.81Å; L60-L153 HydrophobicContact CD2-CB 4.15Å
61	P	97.1	Very high	86.4	Confident	13 Å²	13	63.6 Å²	63.6	8%	0.084	32%	0.321	C	S	.	.			trans	-68	134.4	-174.5	26.1	-35.2	0	0	0	111.9	A45 Q47 T59 V151	A45-P61 HydrophobicContact CB-CG 4.16Å; Q47-P61 HydrophobicContact CB-CG 4.28Å; Q47-P61 WeakPolarHBondContact O-CG 3.11Å; T59-P61 WeakPolarHBondContact O-CD 3.36Å; P61-V151 HydrophobicContact CG-CG2 4.36Å; P61-V151 WeakPolarHBondContact O-CG2 3.45Å
62	C	96.3	Very high	84.5	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.332	C	S	.	.			trans	-152.3	99.2	171.4	-177.9	0	0	0	0	108.8	V43 W80 A121 S122 C138 V149	V43-C62 WeakPolarHBondContact CG1-SG 3.32Å; C62-W80 HydrophobicContact CB-CH2 4.01Å; C62-W80 HydrophobicContact CB-CZ2 3.43Å; C62-W80 VanDerWaalsContact CB-CZ2 3.43Å; C62-A121 HydrophobicContact CB-CB 4.16Å; C62-A121 CarbonylContact O-C 3.47Å; C62-A121 WeakPolarHBondContact O-CA 3.47Å; C62-A121 WeakPolarHBondContact O-CB 3.15Å; C62-A121 PolarHBondContact O-N 2.87Å; C62-S122 PolarHBondContact N-OG 2.78Å; C62-S122 PolarHBondContact O-N 3.02Å; C62-C138 HydrophobicContact CB-CB 3.71Å; C62-C138 WeakPolarHBondContact CB-SG 3.47Å; C62-C138 WeakPolarHBondContact SG-CB 3.33Å; C62-C138 CovalentContact SG-SG 2.04Å; C62-C138 PolarHBondContact SG-SG 3.4Å; C62-V149 HydrophobicContact CB-CG1 4.38Å
63	L	94.8	Very high	82.8	Confident	53 Å²	53	66.4 Å²	66.4	28%	0.277	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133.6	-178.3	-61.9	-177.8	0	0	0	110	V43 M44 E46 D120	V43-L63 WeakPolarHBondContact CA-O 3.27Å; M44-L63 PolarHBondContact N-O 2.84Å; M44-L63 PolarHBondContact O-N 2.79Å; E46-L63 HydrophobicContact CG-CD1 3.67Å; E46-L63 WeakPolarHBondContact OE1-CD1 3.49Å; L63-D120 HydrophobicContact CD2-CB 4.42Å
64	I	91.9	Very high	81.3	Confident	11 Å²	11	71 Å²	71	6%	0.056	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	125.1	179.1	-56.4	160.5	0	0	0	107.6	F41 M76 M119 A121 V140	F41-I64 HydrophobicContact CD2-CG2 4.22Å; F41-I64 HydrophobicContact CE2-CG2 3.56Å; F41-I64 HydrophobicContact CZ-CG2 4.13Å; I64-M76 HydrophobicContact CD1-CE 4.37Å; I64-M76 HydrophobicContact CD1-SD 3.76Å; I64-M76 HydrophobicContact CG2-CE 4.06Å; I64-M119 HydrophobicContact CB-CB 4.35Å; I64-M119 HydrophobicContact CB-SD 4.27Å; I64-M119 HydrophobicContact CG2-SD 4.12Å; I64-M119 PolarHBondContact N-O 3.34Å; I64-M119 WeakPolarHBondContact O-CB 3.32Å; I64-A121 HydrophobicContact CD1-CB 4.02Å; I64-A121 HydrophobicContact CG1-CB 4.29Å; I64-V140 HydrophobicContact CD1-CG1 3.76Å; I64-V140 HydrophobicContact CD1-CG2 4.27Å; I64-V140 HydrophobicContact CG1-CG1 4.13Å; I64-V140 HydrophobicContact CG1-CG2 4.1Å
65	Q	89.3	Confident	80.4	Confident	100 Å²	100	74.3 Å²	74.3	47%	0.467	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	125.3	171.6	174	-179	18.4	0	0	108.4	N42 M44	N42-Q65 PolarHBondContact N-O 2.88Å; N42-Q65 PolarHBondContact ND2-OE1 2.62Å; N42-Q65 PolarHBondContact O-N 2.81Å; N42-Q65 WeakPolarHBondContact OD1-CB 3.05Å; N42-Q65 VanDerWaalsContact OD1-CG 3.25Å; N42-Q65 WeakPolarHBondContact OD1-CG 3.44Å; N42-Q65 PolarHBondContact OD1-O 3.31Å; N42-Q65 VanDerWaalsContact OD1-O 3.09Å; N42-Q65 PolarHBondContact OD1-OE1 3.33Å; M44-Q65 HydrophobicContact CE-CB 3.93Å; M44-Q65 HydrophobicContact CE-CG 4.49Å
66	R	79.8	Confident	80.2	Confident	47 Å²	47	74.6 Å²	74.6	18%	0.177	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	130.6	-174.9	-171.4	-164	-94.4	162.3	-11.5	109.3	L70 M119 D142	R66-L70 HydrophobicContact CG-CB 4.06Å; R66-L70 HydrophobicContact CG-CD1 3.59Å; R66-L70 HydrophobicContact CG-CG 4.47Å; R66-M119 HydrophobicContact CB-SD 4.46Å; R66-D142 IonicContact CZ-OD2 2.65Å; R66-D142 IonicContact NE-OD2 3.14Å; R66-D142 PolarHBondContact NE-OD2 3.38Å; R66-D142 VanDerWaalsContact NH2-CG 3.27Å; R66-D142 IonicContact NH2-OD1 3.16Å; R66-D142 PolarHBondContact NH2-OD1 3.31Å; R66-D142 IonicContact NH2-OD2 2.96Å; R66-D142 PolarHBondContact NH2-OD2 3.14Å
67	E	73.1	Confident	80.2	Confident	83 Å²	83	79 Å²	79	39%	0.388	39%	0.385	S	S	.	.			trans	-70	140.6	170.1	-83.7	174.6	174.9	0	0	111.9	P39 K40 Q69 L70	P39-E67 WeakPolarHBondContact CA-OE2 3.5Å; P39-E67 HydrophobicContact CB-CB 4.37Å; K40-E67 HydrophobicContact CB-CG 4.13Å; K40-E67 PolarHBondContact N-OE2 3.25Å; K40-E67 PolarHBondContact O-N 3.45Å; K40-E67 VanDerWaalsContact O-N 3.08Å; E67-Q69 PolarHBondContact O-N 2.95Å; E67-L70 PolarHBondContact O-N 2.86Å
68	Q	63.3	Low	80.2	Confident	200 Å²	200	74.7 Å²	74.7	94%	0.935	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-9.6	-171.4	-72.2	179.3	-23	0	0	115.1
69	Q	58.6	Low	80.2	Confident	173 Å²	173	76.1 Å²	76.1	81%	0.808	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-12.8	-179.2	-66.2	-171.9	-18	0	0	113.6	E67	E67-Q69 PolarHBondContact O-N 2.95Å
70	L	58.3	Low	80.3	Confident	32 Å²	32	73.7 Å²	73.7	17%	0.168	35%	0.352	C	S	.	.	S	Bend	trans	-76.9	125.6	173.6	-83.1	153.6	0	0	0	110.4	P39 R66 E67	P39-L70 HydrophobicContact CB-CD1 3.68Å; P39-L70 HydrophobicContact CB-CD2 4.49Å; P39-L70 HydrophobicContact CB-CG 3.7Å; P39-L70 HydrophobicContact CG-CD1 3.77Å; P39-L70 HydrophobicContact CG-CD2 3.74Å; P39-L70 HydrophobicContact CG-CG 3.49Å; P39-L70 VanDerWaalsContact CG-CG 3.49Å; R66-L70 HydrophobicContact CG-CB 4.06Å; R66-L70 HydrophobicContact CG-CD1 3.59Å; R66-L70 HydrophobicContact CG-CG 4.47Å; E67-L70 PolarHBondContact O-N 2.86Å
71	P	59.1	Low	80.3	Confident	105 Å²	105	73.8 Å²	73.8	68%	0.682	35%	0.353	S	S	*	.			trans	-53.9	133.9	167.3	-19	29.2	0	0	0	108.7	S73	P71-S73 PolarHBondContact O-N 2.75Å
72	P	56.8	Low	80.3	Confident	105 Å²	105	74.9 Å²	74.9	68%	0.682	36%	0.356	S	S	*	.			trans	-61.4	103.3	178.6	21.6	-30	0	0	0	109.3	R74	P72-R74 PolarHBondContact O-N 3.13Å
73	S	58.8	Low	80.2	Confident	46 Å²	46	76.3 Å²	76.3	32%	0.322	36%	0.363	S	S	.	.			trans	-63.9	124.6	171.2	133.5	0	0	0	0	107.9	P71 K75 D142	P71-S73 PolarHBondContact O-N 2.75Å; S73-K75 PolarHBondContact O-N 3.17Å; S73-K75 PolarHBondContact OG-N 3.31Å; S73-D142 WeakPolarHBondContact CB-OD1 3.23Å; S73-D142 PolarHBondContact OG-OD1 3.09Å
74	R	60.9	Low	79.9	Confident	242 Å²	242	75.5 Å²	75.5	91%	0.913	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	2.3	-177.9	-76.9	-179.4	170.2	163.6	-2.6	112.9	P72	P72-R74 PolarHBondContact O-N 3.13Å
75	K	75.6	Confident	79.3	Confident	147 Å²	147	78 Å²	78	64%	0.639	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.9	50.2	-169.7	-61.9	-172.9	-177.8	179.8	0	113.4	S73 R77 M97	S73-K75 PolarHBondContact O-N 3.17Å; S73-K75 PolarHBondContact OG-N 3.31Å; K75-R77 PolarHBondContact O-N 3.23Å; K75-M97 HydrophobicContact CB-CE 4.08Å; K75-M97 HydrophobicContact CD-CE 4.35Å
76	M	88.8	Confident	78.7	Confident	24 Å²	24	77.2 Å²	77.2	12%	0.118	38%	0.378	C	S	.	.			trans	-54	135.5	163.9	-67.7	174.2	172.4	0	0	109.7	F41 I64 M119 I141 D142	F41-M76 HydrophobicContact CE2-CE 4.37Å; I64-M76 HydrophobicContact CD1-CE 4.37Å; I64-M76 HydrophobicContact CD1-SD 3.76Å; I64-M76 HydrophobicContact CG2-CE 4.06Å; M76-M119 HydrophobicContact CE-CE 3.75Å; M76-M119 HydrophobicContact CE-SD 4.07Å; M76-I141 WeakPolarHBondContact CA-O 3.47Å; M76-D142 HydrophobicContact CG-CB 4.35Å
77	R	93.6	Very high	78.6	Confident	105 Å²	105	80.2 Å²	80.2	40%	0.396	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	121.4	171.5	176.2	177.9	174	158.5	-1.3	108.4	K75 A96 M97 V140 I141	K75-R77 PolarHBondContact O-N 3.23Å; R77-A96 CarbonylContact C-O 3.56Å; R77-A96 WeakPolarHBondContact CA-O 3.45Å; R77-M97 HydrophobicContact CB-CG 4.39Å; R77-V140 WeakPolarHBondContact O-CA 3.34Å; R77-I141 HydrophobicContact CB-CB 4.36Å; R77-I141 PolarHBondContact N-O 2.82Å; R77-I141 PolarHBondContact O-N 3.19Å
78	I	95.8	Very high	79	Confident	18 Å²	18	83 Å²	83	9%	0.092	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	126.8	176.2	-61.1	160	0	0	0	107.4	V95 A96 L113 A121 V140	I78-V95 CarbonylContact O-C 3.51Å; I78-V95 WeakPolarHBondContact O-CA 3.29Å; I78-A96 PolarHBondContact N-O 3.09Å; I78-A96 PolarHBondContact O-N 2.04Å; I78-L113 HydrophobicContact CD1-CD1 3.77Å; I78-L113 HydrophobicContact CG2-CD2 4.16Å; I78-A121 HydrophobicContact CD1-CB 3.68Å; I78-A121 HydrophobicContact CG1-CB 3.94Å; I78-A121 HydrophobicContact CG2-CB 3.93Å; I78-V140 HydrophobicContact CG1-CG1 4.24Å; I78-V140 HydrophobicContact CG1-CG2 4.36Å
79	K	97.8	Very high	80.3	Confident	44 Å²	44	80.3 Å²	80.3	19%	0.191	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	125.8	175.8	179.8	177	-172.5	-153.4	0	109.4	T81 D92 V95 E139	K79-T81 HydrophobicContact CD-CG2 4.2Å; K79-T81 VanDerWaalsContact CE-CG2 3.45Å; K79-T81 HydrophobicContact CG-CG2 4.07Å; K79-D92 WeakPolarHBondContact CE-OD1 3.49Å; K79-D92 IonicContact NZ-OD1 3.08Å; K79-D92 PolarHBondContact NZ-OD1 2.84Å; K79-V95 HydrophobicContact CB-CG2 4.42Å; K79-V95 HydrophobicContact CG-CG2 4.03Å; K79-E139 HydrophobicContact CB-CB 4.32Å; K79-E139 PolarHBondContact N-O 2.98Å; K79-E139 PolarHBondContact O-N 3.33Å
80	W	98.3	Very high	82	Confident	0 Å²	0	76 Å²	76	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	127	169.6	-80.2	93.6	0	0	0	109.3	L60 C62 V93 F94 A121 L123 K137 C138 V151	L60-W80 HydrophobicContact CB-CH2 3.46Å; L60-W80 VanDerWaalsContact CB-CH2 3.46Å; L60-W80 HydrophobicContact CB-CZ2 4.08Å; L60-W80 HydrophobicContact CB-CZ3 3.85Å; L60-W80 HydrophobicContact CD1-CE3 4.34Å; L60-W80 HydrophobicContact CD1-CH2 4.46Å; L60-W80 HydrophobicContact CD1-CZ3 4.03Å; L60-W80 WeakPolarHBondContact O-CZ2 3Å; C62-W80 HydrophobicContact CB-CH2 4.01Å; C62-W80 HydrophobicContact CB-CZ2 3.43Å; C62-W80 VanDerWaalsContact CB-CZ2 3.43Å; W80-V93 HydrophobicContact CB-CB 4.26Å; W80-V93 WeakPolarHBondContact O-CB 3.47Å; W80-V93 PolarHBondContact O-N 2.82Å; W80-F94 HydrophobicContact CB-CB 4.28Å; W80-F94 PolarHBondContact N-O 3.16Å; W80-F94 PolarHBondContact O-N 3.48Å; W80-F94 VanDerWaalsContact O-N 3.16Å; W80-A121 PolarHBondContact NE1-O 2.81Å; W80-L123 HydrophobicContact CB-CD2 4.1Å; W80-L123 HydrophobicContact CD2-CB 3.98Å; W80-L123 HydrophobicContact CD2-CD2 4.17Å; W80-L123 HydrophobicContact CG-CB 4.18Å; W80-L123 HydrophobicContact CG-CD1 4.35Å; W80-L123 HydrophobicContact CG-CD2 3.95Å; W80-L123 HydrophobicContact CG-CG 4.4Å; W80-L123 HydrophobicContact CZ2-CB 3.92Å; W80-K137 WeakPolarHBondContact CA-O 3.46Å; W80-C138 HydrophobicContact CD2-CB 3.94Å; W80-C138 HydrophobicContact CE3-CB 3.98Å; W80-C138 HydrophobicContact CH2-CB 3.63Å; W80-C138 HydrophobicContact CZ2-CB 3.57Å; W80-C138 HydrophobicContact CZ3-CB 3.82Å; W80-V151 HydrophobicContact CH2-CG2 4.3Å
81	T	98.1	Very high	83.8	Confident	1 Å²	1	78.1 Å²	78.1	1%	0.006	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	152.5	172	60	0	0	0	0	111	K79 E90 V91 Y136 K137	K79-T81 HydrophobicContact CD-CG2 4.2Å; K79-T81 VanDerWaalsContact CE-CG2 3.45Å; K79-T81 HydrophobicContact CG-CG2 4.07Å; T81-E90 WeakPolarHBondContact CB-OE2 3.35Å; T81-E90 HydrophobicContact CG2-CB 4.19Å; T81-E90 PolarHBondContact OG1-OE2 2.89Å; T81-V91 CarbonylContact C-O 3.58Å; T81-V91 VanDerWaalsContact CA-O 3.27Å; T81-V91 WeakPolarHBondContact CA-O 3.5Å; T81-V91 WeakPolarHBondContact CB-O 3.37Å; T81-Y136 CarbonylContact O-C 3.56Å; T81-Y136 VanDerWaalsContact O-CA 3.24Å; T81-Y136 WeakPolarHBondContact O-CA 3.47Å; T81-K137 PolarHBondContact N-O 2.78Å; T81-K137 PolarHBondContact O-N 3.4Å
82	K	97.4	Very high	85.6	Confident	37 Å²	37	76 Å²	76	16%	0.161	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	127.6	170.4	-171.1	-173.6	-177.4	-163.9	0	108.8	V91 V93 F107 D131 Y133 Y136	K82-V91 HydrophobicContact CB-CB 4.47Å; K82-V91 PolarHBondContact N-O 2.84Å; K82-V91 PolarHBondContact O-N 2.58Å; K82-V93 HydrophobicContact CB-CG2 3.81Å; K82-F107 HydrophobicContact CD-CZ 4.22Å; K82-D131 PolarHBondContact NZ-O 3.49Å; K82-Y133 WeakPolarHBondContact CE-O 3.34Å; K82-Y133 PolarHBondContact NZ-O 3.36Å; K82-Y136 HydrophobicContact CB-CD1 4.06Å; K82-Y136 HydrophobicContact CB-CE1 3.8Å; K82-Y136 HydrophobicContact CD-CE1 4.19Å; K82-Y136 HydrophobicContact CG-CD1 4.31Å; K82-Y136 HydrophobicContact CG-CE1 3.88Å; K82-Y136 HydrophobicContact CG-CE2 4.3Å
83	L	94.4	Very high	87.6	Confident	29 Å²	29	71 Å²	71	15%	0.152	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	135.4	176.1	-52.3	-176.5	0	0	0	109.8	Y87 E90 R135 K137 V150	L83-Y87 HydrophobicContact CB-CD1 4.11Å; L83-Y87 HydrophobicContact CD1-CD1 4.18Å; L83-E90 HydrophobicContact CD2-CG 3.76Å; L83-R135 HydrophobicContact CB-CB 4.27Å; L83-R135 HydrophobicContact CD1-CB 3.96Å; L83-R135 HydrophobicContact CG-CB 4.24Å; L83-R135 PolarHBondContact N-O 3.22Å; L83-K137 HydrophobicContact CD2-CB 4.24Å; L83-V150 HydrophobicContact CD1-CG1 4.24Å; L83-V150 HydrophobicContact CD1-CG2 4.46Å
84	T	88	Confident	89.4	Confident	37 Å²	37	69.2 Å²	69.2	23%	0.227	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-67.9	160.2	170.4	50.7	0	0	0	0	111.2	D86 Y87 K89 V91	T84-D86 VanDerWaalsContact CB-OD1 3.26Å; T84-D86 WeakPolarHBondContact CB-OD1 3.35Å; T84-D86 PolarHBondContact O-N 2.91Å; T84-D86 PolarHBondContact OG1-OD1 2.98Å; T84-Y87 WeakPolarHBondContact O-CA 3.32Å; T84-Y87 PolarHBondContact O-N 2.62Å; T84-K89 HydrophobicContact CG2-CB 3.77Å; T84-K89 PolarHBondContact N-O 2.98Å; T84-K89 PolarHBondContact OG1-N 3.33Å; T84-K89 PolarHBondContact OG1-O 3.23Å; T84-V91 HydrophobicContact CG2-CG2 4.31Å
85	S	78.6	Confident	91.2	Very high	63 Å²	63	58.5 Å²	58.5	44%	0.441	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-25.7	-177.3	-55.7	0	0	0	0	114.2	Y87	S85-Y87 WeakPolarHBondContact O-CE2 3.47Å
86	D	76.9	Confident	92.1	Very high	84 Å²	84	51.7 Å²	51.7	45%	0.449	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-4.9	173.9	62	0.6	0	0	0	113.3	T84 L88	T84-D86 VanDerWaalsContact CB-OD1 3.26Å; T84-D86 WeakPolarHBondContact CB-OD1 3.35Å; T84-D86 PolarHBondContact O-N 2.91Å; T84-D86 PolarHBondContact OG1-OD1 2.98Å; D86-L88 HydrophobicContact CB-CD1 4.24Å; D86-L88 HydrophobicContact CB-CG 4.08Å; D86-L88 WeakPolarHBondContact O-CG 3.5Å; D86-L88 PolarHBondContact O-N 3.02Å; D86-L88 VanDerWaalsContact O-N 3.13Å; D86-L88 PolarHBondContact OD1-N 3.34Å; D86-L88 VanDerWaalsContact OD1-N 3.11Å
87	Y	78.4	Confident	92.2	Very high	110 Å²	110	54.4 Å²	54.4	43%	0.431	27%	0.269	S	S	.	.	S	Bend	trans	59.1	13.5	-175	-49	-69.2	0	0	0	115.2	L83 T84 S85 R135	L83-Y87 HydrophobicContact CB-CD1 4.11Å; L83-Y87 HydrophobicContact CD1-CD1 4.18Å; T84-Y87 WeakPolarHBondContact O-CA 3.32Å; T84-Y87 PolarHBondContact O-N 2.62Å; S85-Y87 WeakPolarHBondContact O-CE2 3.47Å; Y87-R135 VanDerWaalsContact CD1-NH2 3.34Å; Y87-R135 HydrophobicContact CE1-CG 4.44Å; Y87-R135 PolarHBondContact OH-NE 3.39Å; Y87-R135 PolarHBondContact OH-NH1 2.96Å; Y87-R135 PolarHBondContact OH-NH2 3.05Å
88	L	82.2	Confident	91.8	Very high	141 Å²	141	51.6 Å²	51.6	74%	0.738	27%	0.273	S	S	*	.	S	Bend	trans	-89.2	-18.9	-177.1	-60.9	-179	0	0	0	112.8	D86	D86-L88 HydrophobicContact CB-CD1 4.24Å; D86-L88 HydrophobicContact CB-CG 4.08Å; D86-L88 WeakPolarHBondContact O-CG 3.5Å; D86-L88 PolarHBondContact O-N 3.02Å; D86-L88 VanDerWaalsContact O-N 3.13Å; D86-L88 PolarHBondContact OD1-N 3.34Å; D86-L88 VanDerWaalsContact OD1-N 3.11Å
89	K	89.2	Confident	91.3	Very high	144 Å²	144	61.7 Å²	61.7	63%	0.626	31%	0.312	S	S	*	.			trans	-134.1	150.3	-175.9	-63.4	179.7	-177.2	176.3	0	111.3	T84	T84-K89 HydrophobicContact CG2-CB 3.77Å; T84-K89 PolarHBondContact N-O 2.98Å; T84-K89 PolarHBondContact OG1-N 3.33Å; T84-K89 PolarHBondContact OG1-O 3.23Å
90	E	94.7	Very high	91	Very high	83 Å²	83	67 Å²	67	39%	0.388	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.8	175.3	-63.2	-165	-171.2	0	0	109.5	T81 L83 K137	T81-E90 WeakPolarHBondContact CB-OE2 3.35Å; T81-E90 HydrophobicContact CG2-CB 4.19Å; T81-E90 PolarHBondContact OG1-OE2 2.89Å; L83-E90 HydrophobicContact CD2-CG 3.76Å; E90-K137 VanDerWaalsContact OE1-CE 3.25Å; E90-K137 WeakPolarHBondContact OE1-CE 3.06Å; E90-K137 IonicContact OE1-NZ 3.5Å; E90-K137 PolarHBondContact OE1-NZ 3.17Å; E90-K137 WeakPolarHBondContact OE2-CE 3.27Å; E90-K137 IonicContact OE2-NZ 3.26Å; E90-K137 PolarHBondContact OE2-NZ 2.93Å
91	V	95.8	Very high	90.8	Very high	75 Å²	75	73.4 Å²	73.4	46%	0.455	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	123	174.1	-178.7	0	0	0	0	107.8	T81 K82 T84 V93	T81-V91 CarbonylContact C-O 3.58Å; T81-V91 VanDerWaalsContact CA-O 3.27Å; T81-V91 WeakPolarHBondContact CA-O 3.5Å; T81-V91 WeakPolarHBondContact CB-O 3.37Å; K82-V91 HydrophobicContact CB-CB 4.47Å; K82-V91 PolarHBondContact N-O 2.84Å; K82-V91 PolarHBondContact O-N 2.58Å; T84-V91 HydrophobicContact CG2-CG2 4.31Å; V91-V93 PolarHBondContact O-N 3.09Å
92	D	97.1	Very high	90.7	Very high	60 Å²	60	80.8 Å²	80.8	32%	0.321	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	132.1	176.9	-72.2	-39.9	0	0	0	110.5	K79 Y104	K79-D92 WeakPolarHBondContact CE-OD1 3.49Å; K79-D92 IonicContact NZ-OD1 3.08Å; K79-D92 PolarHBondContact NZ-OD1 2.84Å; D92-Y104 HydrophobicContact CB-CD1 4.2Å; D92-Y104 HydrophobicContact CB-CD2 3.93Å; D92-Y104 HydrophobicContact CB-CE2 4.39Å; D92-Y104 HydrophobicContact CB-CG 3.84Å; D92-Y104 WeakPolarHBondContact O-CB 3.36Å
93	V	98.1	Very high	90.7	Very high	0 Å²	0	80.3 Å²	80.3	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-56.8	178	175.6	0	0	0	0	109.4	W80 K82 V91 S103 Y104 F107 V111 L123 Y136	W80-V93 HydrophobicContact CB-CB 4.26Å; W80-V93 WeakPolarHBondContact O-CB 3.47Å; W80-V93 PolarHBondContact O-N 2.82Å; K82-V93 HydrophobicContact CB-CG2 3.81Å; V91-V93 PolarHBondContact O-N 3.09Å; V93-S103 WeakPolarHBondContact O-CA 3.38Å; V93-Y104 PolarHBondContact O-N 3.5Å; V93-F107 HydrophobicContact CB-CD2 4.18Å; V93-F107 HydrophobicContact CB-CE2 4.41Å; V93-F107 HydrophobicContact CB-CG 4.43Å; V93-F107 HydrophobicContact CG1-CB 4.16Å; V93-F107 HydrophobicContact CG1-CD1 3.96Å; V93-F107 HydrophobicContact CG1-CD2 4.04Å; V93-F107 HydrophobicContact CG1-CE1 4.38Å; V93-F107 HydrophobicContact CG1-CE2 4.47Å; V93-F107 HydrophobicContact CG1-CG 3.78Å; V93-F107 HydrophobicContact CG2-CD2 4Å; V93-F107 HydrophobicContact CG2-CE1 4.45Å; V93-F107 HydrophobicContact CG2-CE2 3.72Å; V93-F107 HydrophobicContact CG2-CZ 3.97Å; V93-V111 HydrophobicContact CG1-CG1 4.29Å; V93-V111 HydrophobicContact CG1-CG2 4.39Å; V93-L123 HydrophobicContact CG1-CD2 3.79Å; V93-Y136 HydrophobicContact CG2-CD1 4.02Å; V93-Y136 HydrophobicContact CG2-CE1 3.86Å
94	F	98.2	Very high	90.8	Very high	9 Å²	9	81.8 Å²	81.8	4%	0.039	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	141.7	-174.9	-177.2	-92.3	0	0	0	111.6	W80 A96 K101 R102 V111 L113 L123	W80-F94 HydrophobicContact CB-CB 4.28Å; W80-F94 PolarHBondContact N-O 3.16Å; W80-F94 PolarHBondContact O-N 3.48Å; W80-F94 VanDerWaalsContact O-N 3.16Å; F94-A96 HydrophobicContact CE1-CB 3.62Å; F94-A96 HydrophobicContact CZ-CB 4.17Å; F94-K101 HydrophobicContact CE2-CB 4.27Å; F94-K101 HydrophobicContact CZ-CB 3.92Å; F94-K101 HydrophobicContact CZ-CD 4.3Å; F94-K101 HydrophobicContact CZ-CG 4.19Å; F94-R102 CarbonylContact C-O 3.57Å; F94-R102 WeakPolarHBondContact CA-O 3.35Å; F94-V111 HydrophobicContact CB-CG2 4.01Å; F94-V111 HydrophobicContact CD2-CG2 3.9Å; F94-V111 HydrophobicContact CG-CG2 4.34Å; F94-L113 HydrophobicContact CD1-CD2 4.24Å; F94-L113 HydrophobicContact CD1-CG 4.39Å; F94-L113 HydrophobicContact CE1-CD1 4.08Å; F94-L113 HydrophobicContact CE1-CD2 3.88Å; F94-L113 HydrophobicContact CE1-CG 3.56Å; F94-L113 HydrophobicContact CZ-CG 4.12Å; F94-L123 HydrophobicContact CB-CD1 3.84Å; F94-L123 HydrophobicContact CD1-CD1 3.89Å; F94-L123 HydrophobicContact CG-CD1 3.83Å
95	V	97.4	Very high	91.2	Very high	17 Å²	17	82.9 Å²	82.9	10%	0.103	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	134.6	173.9	178.2	0	0	0	0	109.5	I78 K79 K101 R102 Y104	I78-V95 CarbonylContact O-C 3.51Å; I78-V95 WeakPolarHBondContact O-CA 3.29Å; K79-V95 HydrophobicContact CB-CG2 4.42Å; K79-V95 HydrophobicContact CG-CG2 4.03Å; V95-K101 CarbonylContact O-C 3.49Å; V95-K101 WeakPolarHBondContact O-CA 3.29Å; V95-R102 PolarHBondContact N-O 2.81Å; V95-R102 PolarHBondContact O-N 2.95Å; V95-Y104 HydrophobicContact CB-CE2 4.22Å; V95-Y104 HydrophobicContact CG2-CE2 3.84Å
96	A	95.1	Very high	92	Very high	4 Å²	4	84.9 Å²	84.9	3%	0.033	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	139.6	170.6	0	0	0	0	0	111.9	R77 I78 F94 H100 K101 L113	R77-A96 CarbonylContact C-O 3.56Å; R77-A96 WeakPolarHBondContact CA-O 3.45Å; I78-A96 PolarHBondContact N-O 3.09Å; I78-A96 PolarHBondContact O-N 2.04Å; F94-A96 HydrophobicContact CE1-CB 3.62Å; F94-A96 HydrophobicContact CZ-CB 4.17Å; A96-H100 CarbonylContact C-O 3.56Å; A96-H100 WeakPolarHBondContact CA-O 3.4Å; A96-K101 HydrophobicContact CB-CG 4.06Å; A96-L113 HydrophobicContact CB-CD1 3.72Å
97	M	92	Very high	92.9	Very high	82 Å²	82	81.3 Å²	81.3	40%	0.404	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	99.9	171.6	-171.3	-178.5	-172.1	0	0	108.8	K75 R77 Y99 H100	K75-M97 HydrophobicContact CB-CE 4.08Å; K75-M97 HydrophobicContact CD-CE 4.35Å; R77-M97 HydrophobicContact CB-CG 4.39Å; M97-Y99 PolarHBondContact O-N 2.97Å; M97-H100 PolarHBondContact N-O 3.38Å; M97-H100 PolarHBondContact O-N 2.9Å; M97-H100 VanDerWaalsContact O-N 3.11Å
98	G	84.3	Confident	93.8	Very high	46 Å²	46	81.7 Å²	81.7	47%	0.474	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	-121.6	-170.7	0	0	0	0	0	111.8
99	Y	85.6	Confident	94.4	Very high	230 Å²	230	78.7 Å²	78.7	90%	0.902	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-14.6	178.7	-59	-71.2	0	0	0	113.9	M97 K101	M97-Y99 PolarHBondContact O-N 2.97Å; Y99-K101 PolarHBondContact O-N 3.08Å
100	H	91.1	Very high	94.7	Very high	154 Å²	154	73.5 Å²	73.5	71%	0.713	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	117.1	179.2	-59.7	-72	0	0	0	109.5	A96 M97	A96-H100 CarbonylContact C-O 3.56Å; A96-H100 WeakPolarHBondContact CA-O 3.4Å; M97-H100 PolarHBondContact N-O 3.38Å; M97-H100 PolarHBondContact O-N 2.9Å; M97-H100 VanDerWaalsContact O-N 3.11Å
101	K	94.4	Very high	94.9	Very high	136 Å²	136	70 Å²	70	59%	0.591	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.5	137.4	179.7	-60.9	179	-176.7	-179.9	0	109.1	F94 V95 A96 Y99	F94-K101 HydrophobicContact CE2-CB 4.27Å; F94-K101 HydrophobicContact CZ-CB 3.92Å; F94-K101 HydrophobicContact CZ-CD 4.3Å; F94-K101 HydrophobicContact CZ-CG 4.19Å; V95-K101 CarbonylContact O-C 3.49Å; V95-K101 WeakPolarHBondContact O-CA 3.29Å; A96-K101 HydrophobicContact CB-CG 4.06Å; Y99-K101 PolarHBondContact O-N 3.08Å
102	R	96.2	Very high	94.9	Very high	156 Å²	156	72.3 Å²	72.3	59%	0.589	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.8	128.7	179.9	-171.8	171.1	-178.6	-177.5	2.6	111	F94 V95 Y104	F94-R102 CarbonylContact C-O 3.57Å; F94-R102 WeakPolarHBondContact CA-O 3.35Å; V95-R102 PolarHBondContact N-O 2.81Å; V95-R102 PolarHBondContact O-N 2.95Å; R102-Y104 HydrophobicContact CB-CE2 4.12Å; R102-Y104 HydrophobicContact CG-CD2 4.46Å; R102-Y104 HydrophobicContact CG-CE1 4.35Å; R102-Y104 HydrophobicContact CG-CE2 3.89Å; R102-Y104 WeakPolarHBondContact O-CE2 3.39Å
103	S	97.3	Very high	94.9	Very high	27 Å²	27	70.8 Å²	70.8	19%	0.189	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	154	168.3	50.5	0	0	0	0	110.8	V93 Q108	V93-S103 WeakPolarHBondContact O-CA 3.38Å; S103-Q108 WeakPolarHBondContact O-CG 3.45Å; S103-Q108 PolarHBondContact O-NE2 3.15Å; S103-Q108 WeakPolarHBondContact OG-CA 3.36Å
104	Y	97.1	Very high	94.7	Very high	60 Å²	60	74.8 Å²	74.8	24%	0.235	39%	0.392	C	S	.	.			trans	-126.1	154.5	-172.6	-63.7	-98.9	0	0	0	112.2	D92 V93 V95 R102 T106 F107	D92-Y104 HydrophobicContact CB-CD1 4.2Å; D92-Y104 HydrophobicContact CB-CD2 3.93Å; D92-Y104 HydrophobicContact CB-CE2 4.39Å; D92-Y104 HydrophobicContact CB-CG 3.84Å; D92-Y104 WeakPolarHBondContact O-CB 3.36Å; V93-Y104 PolarHBondContact O-N 3.5Å; V95-Y104 HydrophobicContact CB-CE2 4.22Å; V95-Y104 HydrophobicContact CG2-CE2 3.84Å; R102-Y104 HydrophobicContact CB-CE2 4.12Å; R102-Y104 HydrophobicContact CG-CD2 4.46Å; R102-Y104 HydrophobicContact CG-CE1 4.35Å; R102-Y104 HydrophobicContact CG-CE2 3.89Å; R102-Y104 WeakPolarHBondContact O-CE2 3.39Å; Y104-T106 PolarHBondContact O-N 2.8Å; Y104-F107 WeakPolarHBondContact O-CB 3.45Å; Y104-F107 WeakPolarHBondContact O-CD2 3.08Å; Y104-F107 PolarHBondContact O-N 3Å; Y104-F107 VanDerWaalsContact O-N 3.09Å
105	G	95.6	Very high	93.9	Very high	59 Å²	59	76.9 Å²	76.9	61%	0.608	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	52.1	-135.6	173.8	0	0	0	0	0	114.2	F107 Q108	G105-F107 PolarHBondContact O-N 2.97Å; G105-Q108 WeakPolarHBondContact O-CG 3.25Å; G105-Q108 PolarHBondContact O-N 3.13Å
106	T	95.3	Very high	93.4	Very high	105 Å²	105	81 Å²	81	64%	0.644	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-71.6	-5.9	179.9	55.3	0	0	0	0	113.8	Y104 R110	Y104-T106 PolarHBondContact O-N 2.8Å; T106-R110 VanDerWaalsContact O-CZ 3.31Å; T106-R110 PolarHBondContact O-NE 3.42Å; T106-R110 PolarHBondContact O-NH2 3.22Å
107	F	96.8	Very high	93	Very high	9 Å²	9	83.2 Å²	83.2	4%	0.039	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-86.2	-10.1	177.6	-54.6	-75.9	0	0	0	112.7	K82 V93 Y104 G105 G109 R110 V111 M125 D132 Y136	K82-F107 HydrophobicContact CD-CZ 4.22Å; V93-F107 HydrophobicContact CB-CD2 4.18Å; V93-F107 HydrophobicContact CB-CE2 4.41Å; V93-F107 HydrophobicContact CB-CG 4.43Å; V93-F107 HydrophobicContact CG1-CB 4.16Å; V93-F107 HydrophobicContact CG1-CD1 3.96Å; V93-F107 HydrophobicContact CG1-CD2 4.04Å; V93-F107 HydrophobicContact CG1-CE1 4.38Å; V93-F107 HydrophobicContact CG1-CE2 4.47Å; V93-F107 HydrophobicContact CG1-CG 3.78Å; V93-F107 HydrophobicContact CG2-CD2 4Å; V93-F107 HydrophobicContact CG2-CE1 4.45Å; V93-F107 HydrophobicContact CG2-CE2 3.72Å; V93-F107 HydrophobicContact CG2-CZ 3.97Å; Y104-F107 WeakPolarHBondContact O-CB 3.45Å; Y104-F107 WeakPolarHBondContact O-CD2 3.08Å; Y104-F107 PolarHBondContact O-N 3Å; Y104-F107 VanDerWaalsContact O-N 3.09Å; G105-F107 PolarHBondContact O-N 2.97Å; F107-G109 PolarHBondContact O-N 3.04Å; F107-R110 PolarHBondContact O-N 3.4Å; F107-V111 HydrophobicContact CB-CG1 3.96Å; F107-V111 HydrophobicContact CB-CG2 3.92Å; F107-V111 HydrophobicContact CD1-CG1 4.19Å; F107-V111 WeakPolarHBondContact O-CG2 3.24Å; F107-V111 PolarHBondContact O-N 3Å; F107-M125 HydrophobicContact CD1-CE 3.79Å; F107-M125 HydrophobicContact CE1-CE 3.77Å; F107-D132 VanDerWaalsContact CE1-OD1 3.24Å; F107-D132 WeakPolarHBondContact CE1-OD1 3.48Å; F107-Y136 HydrophobicContact CE1-CE1 4.19Å; F107-Y136 HydrophobicContact CZ-CE1 4.32Å
108	Q	96.1	Very high	92.7	Very high	118 Å²	118	84.8 Å²	84.8	55%	0.551	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	128.6	-179.6	-71.4	-177.1	-15.2	0	0	112.3	S103 G105 R110	S103-Q108 WeakPolarHBondContact O-CG 3.45Å; S103-Q108 PolarHBondContact O-NE2 3.15Å; S103-Q108 WeakPolarHBondContact OG-CA 3.36Å; G105-Q108 WeakPolarHBondContact O-CG 3.25Å; G105-Q108 PolarHBondContact O-N 3.13Å; Q108-R110 PolarHBondContact O-N 3.29Å
109	G	94.6	Very high	92.9	Very high	78 Å²	78	85.6 Å²	85.6	80%	0.804	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	-2.8	-178.1	0	0	0	0	0	115.2	F107	F107-G109 PolarHBondContact O-N 3.04Å
110	R	96.9	Very high	93.3	Very high	35 Å²	35	75 Å²	75	13%	0.132	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-13.5	-178.9	-61.6	-168.7	-56.3	116	-1.4	114.2	T106 F107 Q108 M125 T126 D127 D132	T106-R110 VanDerWaalsContact O-CZ 3.31Å; T106-R110 PolarHBondContact O-NE 3.42Å; T106-R110 PolarHBondContact O-NH2 3.22Å; F107-R110 PolarHBondContact O-N 3.4Å; Q108-R110 PolarHBondContact O-N 3.29Å; R110-M125 CarbonylContact O-C 3.56Å; R110-M125 VanDerWaalsContact O-CA 3.32Å; R110-M125 WeakPolarHBondContact O-CA 3.12Å; R110-T126 PolarHBondContact NH1-O 2.85Å; R110-T126 PolarHBondContact O-N 3.4Å; R110-T126 PolarHBondContact O-OG1 2.86Å; R110-D127 PolarHBondContact NH1-O 2.81Å; R110-D127 VanDerWaalsContact NH1-O 3.1Å; R110-D132 IonicContact CZ-OD1 3.36Å; R110-D132 IonicContact CZ-OD2 3.07Å; R110-D132 IonicContact NH1-OD1 3.33Å; R110-D132 IonicContact NH1-OD2 3.41Å; R110-D132 PolarHBondContact NH1-OD2 2.98Å; R110-D132 IonicContact NH2-OD1 2.62Å; R110-D132 PolarHBondContact NH2-OD1 3.3Å; R110-D132 IonicContact NH2-OD2 3.61Å; R110-D132 PolarHBondContact NH2-OD2 3.48Å
111	V	97.7	Very high	93.5	Very high	11 Å²	11	67.7 Å²	67.7	7%	0.067	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	139.8	-177	-58.8	0	0	0	0	112.6	V93 F94 F107 L123 V124 M125	V93-V111 HydrophobicContact CG1-CG1 4.29Å; V93-V111 HydrophobicContact CG1-CG2 4.39Å; F94-V111 HydrophobicContact CB-CG2 4.01Å; F94-V111 HydrophobicContact CD2-CG2 3.9Å; F94-V111 HydrophobicContact CG-CG2 4.34Å; F107-V111 HydrophobicContact CB-CG1 3.96Å; F107-V111 HydrophobicContact CB-CG2 3.92Å; F107-V111 HydrophobicContact CD1-CG1 4.19Å; F107-V111 WeakPolarHBondContact O-CG2 3.24Å; F107-V111 PolarHBondContact O-N 3Å; V111-L123 HydrophobicContact CB-CD1 4.14Å; V111-L123 HydrophobicContact CB-CD2 4.21Å; V111-L123 HydrophobicContact CB-CG 4.25Å; V111-L123 HydrophobicContact CG1-CD2 4.24Å; V111-V124 VanDerWaalsContact CA-O 3.27Å; V111-V124 WeakPolarHBondContact CA-O 3.37Å; V111-M125 HydrophobicContact CG1-CB 4.06Å; V111-M125 HydrophobicContact CG1-CE 3.92Å; V111-M125 HydrophobicContact CG1-CG 3.91Å
112	Q	96.4	Very high	93.6	Very high	123 Å²	123	61.4 Å²	61.4	58%	0.575	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-155.1	158.3	175.3	63.6	-178.4	17.7	0	0	111.2	V124	Q112-V124 HydrophobicContact CG-CB 4.23Å; Q112-V124 PolarHBondContact N-O 2.59Å; Q112-V124 PolarHBondContact O-N 2.95Å
113	L	95.8	Very high	93.7	Very high	27 Å²	27	54 Å²	54	14%	0.141	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	140.2	170.1	-64	179.1	0	0	0	110.5	I78 F94 A96 S122 L123	I78-L113 HydrophobicContact CD1-CD1 3.77Å; I78-L113 HydrophobicContact CG2-CD2 4.16Å; F94-L113 HydrophobicContact CD1-CD2 4.24Å; F94-L113 HydrophobicContact CD1-CG 4.39Å; F94-L113 HydrophobicContact CE1-CD1 4.08Å; F94-L113 HydrophobicContact CE1-CD2 3.88Å; F94-L113 HydrophobicContact CE1-CG 3.56Å; F94-L113 HydrophobicContact CZ-CG 4.12Å; A96-L113 HydrophobicContact CB-CD1 3.72Å; L113-S122 WeakPolarHBondContact CA-O 3.24Å; L113-L123 HydrophobicContact CD2-CD1 4.39Å
114	Q	94.4	Very high	93.7	Very high	85 Å²	85	54 Å²	54	40%	0.397	33%	0.334	S	S	.	.			trans	-62.5	-43.9	175.3	-174.2	172.4	-3.4	0	0	111.5	T116 S122 V124	Q114-T116 VanDerWaalsContact C-N 3.35Å; Q114-T116 HydrophobicContact CG-CG2 3.74Å; Q114-T116 PolarHBondContact O-N 3.1Å; Q114-S122 PolarHBondContact N-O 3.45Å; Q114-V124 HydrophobicContact CB-CG2 3.77Å; Q114-V124 HydrophobicContact CG-CG2 4.18Å
115	G	82.6	Confident	93.8	Very high	53 Å²	53	51.1 Å²	51.1	55%	0.546	32%	0.323	S	S	.	.			trans	66.3	30.8	169.8	0	0	0	0	0	114.6	S117	G115-S117 VanDerWaalsContact C-N 3.26Å; G115-S117 PolarHBondContact O-N 3.17Å
116	T	85.1	Confident	93.8	Very high	103 Å²	103	50.6 Å²	50.6	63%	0.632	31%	0.308	S	S	*	.	S	Bend	trans	-67.7	-29.1	176.2	60	0	0	0	0	112.5	Q114 D120	Q114-T116 VanDerWaalsContact C-N 3.35Å; Q114-T116 HydrophobicContact CG-CG2 3.74Å; Q114-T116 PolarHBondContact O-N 3.1Å; T116-D120 WeakPolarHBondContact CB-OD2 3.05Å; T116-D120 PolarHBondContact N-OD2 3.43Å; T116-D120 WeakPolarHBondContact OG1-CB 3.18Å; T116-D120 PolarHBondContact OG1-OD2 2.98Å
117	S	87.9	Confident	93.8	Very high	51 Å²	51	49.4 Å²	49.4	36%	0.357	30%	0.298	S	S	.	.	S	Bend	trans	-150.5	165.3	174.5	80.5	0	0	0	0	110.8	G115 M119 D120	G115-S117 VanDerWaalsContact C-N 3.26Å; G115-S117 PolarHBondContact O-N 3.17Å; S117-M119 PolarHBondContact O-N 3.44Å; S117-M119 VanDerWaalsContact O-N 3.13Å; S117-M119 PolarHBondContact OG-N 2.93Å; S117-M119 VanDerWaalsContact OG-N 3.16Å; S117-D120 PolarHBondContact O-N 2.88Å; S117-D120 PolarHBondContact OG-N 2.82Å
118	P	85.1	Confident	93.8	Very high	115 Å²	115	49 Å²	49	75%	0.747	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-16.5	171.4	-23.9	35.2	0	0	0	114.5
119	M	89.5	Confident	93.7	Very high	62 Å²	62	45.6 Å²	45.6	31%	0.305	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	5.7	178.3	-60.9	-60.6	121.2	0	0	112.4	I64 R66 M76 S117	I64-M119 HydrophobicContact CB-CB 4.35Å; I64-M119 HydrophobicContact CB-SD 4.27Å; I64-M119 HydrophobicContact CG2-SD 4.12Å; I64-M119 PolarHBondContact N-O 3.34Å; I64-M119 WeakPolarHBondContact O-CB 3.32Å; R66-M119 HydrophobicContact CB-SD 4.46Å; M76-M119 HydrophobicContact CE-CE 3.75Å; M76-M119 HydrophobicContact CE-SD 4.07Å; S117-M119 PolarHBondContact O-N 3.44Å; S117-M119 VanDerWaalsContact O-N 3.13Å; S117-M119 PolarHBondContact OG-N 2.93Å; S117-M119 VanDerWaalsContact OG-N 3.16Å
120	D	92.9	Very high	93.7	Very high	8 Å²	8	42.4 Å²	42.4	4%	0.043	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-106.3	102.6	179.6	178.6	17.5	0	0	0	110.3	L63 T116 S117 S122	L63-D120 HydrophobicContact CD2-CB 4.42Å; T116-D120 WeakPolarHBondContact CB-OD2 3.05Å; T116-D120 PolarHBondContact N-OD2 3.43Å; T116-D120 WeakPolarHBondContact OG1-CB 3.18Å; T116-D120 PolarHBondContact OG1-OD2 2.98Å; S117-D120 PolarHBondContact O-N 2.88Å; S117-D120 PolarHBondContact OG-N 2.82Å; D120-S122 WeakPolarHBondContact OD1-CB 3.43Å; D120-S122 PolarHBondContact OD1-N 2.75Å; D120-S122 PolarHBondContact OD1-OG 2.73Å
121	A	95.3	Very high	93.5	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	27%	0.268	C	S	.	.			trans	-97.4	12.8	175.6	0	0	0	0	0	112.5	C62 I64 I78 W80 V140	C62-A121 HydrophobicContact CB-CB 4.16Å; C62-A121 CarbonylContact O-C 3.47Å; C62-A121 WeakPolarHBondContact O-CA 3.47Å; C62-A121 WeakPolarHBondContact O-CB 3.15Å; C62-A121 PolarHBondContact O-N 2.87Å; I64-A121 HydrophobicContact CD1-CB 4.02Å; I64-A121 HydrophobicContact CG1-CB 4.29Å; I78-A121 HydrophobicContact CD1-CB 3.68Å; I78-A121 HydrophobicContact CG1-CB 3.94Å; I78-A121 HydrophobicContact CG2-CB 3.93Å; W80-A121 PolarHBondContact NE1-O 2.81Å; A121-V140 HydrophobicContact CB-CG2 4.1Å
122	S	97.3	Very high	93.4	Very high	4 Å²	4	45.1 Å²	45.1	3%	0.028	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-62.3	138.1	-177.7	-52.2	0	0	0	0	111.6	L60 C62 L113 Q114 D120	L60-S122 CarbonylContact O-C 3.55Å; L60-S122 VanDerWaalsContact O-CA 3.23Å; L60-S122 WeakPolarHBondContact O-CA 3.16Å; L60-S122 WeakPolarHBondContact O-CB 3.25Å; C62-S122 PolarHBondContact N-OG 2.78Å; C62-S122 PolarHBondContact O-N 3.02Å; L113-S122 WeakPolarHBondContact CA-O 3.24Å; Q114-S122 PolarHBondContact N-O 3.45Å; D120-S122 WeakPolarHBondContact OD1-CB 3.43Å; D120-S122 PolarHBondContact OD1-N 2.75Å; D120-S122 PolarHBondContact OD1-OG 2.73Å
123	L	97.9	Very high	93.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	118	-178.2	-167.6	75.6	0	0	0	110.3	T59 L60 W80 V93 F94 V111 L113	T59-L123 CarbonylContact C-O 3.53Å; T59-L123 WeakPolarHBondContact CA-O 3.34Å; L60-L123 HydrophobicContact CB-CB 4.34Å; L60-L123 HydrophobicContact CD1-CD2 4.25Å; L60-L123 PolarHBondContact N-O 3.41Å; L60-L123 PolarHBondContact O-N 2.84Å; W80-L123 HydrophobicContact CB-CD2 4.1Å; W80-L123 HydrophobicContact CD2-CB 3.98Å; W80-L123 HydrophobicContact CD2-CD2 4.17Å; W80-L123 HydrophobicContact CG-CB 4.18Å; W80-L123 HydrophobicContact CG-CD1 4.35Å; W80-L123 HydrophobicContact CG-CD2 3.95Å; W80-L123 HydrophobicContact CG-CG 4.4Å; W80-L123 HydrophobicContact CZ2-CB 3.92Å; V93-L123 HydrophobicContact CG1-CD2 3.79Å; F94-L123 HydrophobicContact CB-CD1 3.84Å; F94-L123 HydrophobicContact CD1-CD1 3.89Å; F94-L123 HydrophobicContact CG-CD1 3.83Å; V111-L123 HydrophobicContact CB-CD1 4.14Å; V111-L123 HydrophobicContact CB-CD2 4.21Å; V111-L123 HydrophobicContact CB-CG 4.25Å; V111-L123 HydrophobicContact CG1-CD2 4.24Å; L113-L123 HydrophobicContact CD2-CD1 4.39Å
124	V	97.7	Very high	93.2	Very high	27 Å²	27	40.6 Å²	40.6	16%	0.164	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	126.5	168.9	-176.1	0	0	0	0	108.5	V58 V111 Q112 Q114	V58-V124 WeakPolarHBondContact O-CA 3.39Å; V111-V124 VanDerWaalsContact CA-O 3.27Å; V111-V124 WeakPolarHBondContact CA-O 3.37Å; Q112-V124 HydrophobicContact CG-CB 4.23Å; Q112-V124 PolarHBondContact N-O 2.59Å; Q112-V124 PolarHBondContact O-N 2.95Å; Q114-V124 HydrophobicContact CB-CG2 3.77Å; Q114-V124 HydrophobicContact CG-CG2 4.18Å
125	M	98.1	Very high	93.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	128.7	173.5	-177.5	-177.9	-62.5	0	0	109.9	N57 V58 F107 R110 V111 V128 D132 Y136 L153	N57-M125 CarbonylContact C-O 3.53Å; N57-M125 VanDerWaalsContact CA-O 3.29Å; N57-M125 WeakPolarHBondContact CA-O 3.42Å; V58-M125 HydrophobicContact CG1-CB 4Å; V58-M125 PolarHBondContact N-O 3.43Å; V58-M125 PolarHBondContact O-N 2.75Å; F107-M125 HydrophobicContact CD1-CE 3.79Å; F107-M125 HydrophobicContact CE1-CE 3.77Å; R110-M125 CarbonylContact O-C 3.56Å; R110-M125 VanDerWaalsContact O-CA 3.32Å; R110-M125 WeakPolarHBondContact O-CA 3.12Å; V111-M125 HydrophobicContact CG1-CB 4.06Å; V111-M125 HydrophobicContact CG1-CE 3.92Å; V111-M125 HydrophobicContact CG1-CG 3.91Å; M125-V128 HydrophobicContact CG-CG2 4.09Å; M125-V128 HydrophobicContact SD-CG2 4.1Å; M125-D132 HydrophobicContact SD-CB 3.92Å; M125-Y136 HydrophobicContact CE-CE1 3.92Å; M125-L153 HydrophobicContact SD-CD2 4.19Å
126	T	97.1	Very high	94	Very high	48 Å²	48	38.2 Å²	38.2	29%	0.294	22%	0.216	S	C	.	.			trans	-109.1	153.9	179	61.8	0	0	0	0	111.8	N57 R110	N57-T126 VanDerWaalsContact OD1-CA 3.29Å; N57-T126 WeakPolarHBondContact OD1-CA 3.36Å; N57-T126 WeakPolarHBondContact OD1-CB 3.47Å; R110-T126 PolarHBondContact NH1-O 2.85Å; R110-T126 PolarHBondContact O-N 3.4Å; R110-T126 PolarHBondContact O-OG1 2.86Å
127	D	94.9	Very high	94.6	Very high	80 Å²	80	34.9 Å²	34.9	43%	0.428	19%	0.192	S	C	.	.	S	Bend	trans	50.1	60.7	179.5	-163	42.8	0	0	0	112.1	G55 G56 N57 R110 T129 K257	G55-D127 WeakPolarHBondContact CA-OD1 3.5Å; G56-D127 PolarHBondContact O-N 2.73Å; N57-D127 PolarHBondContact OD1-N 2.82Å; R110-D127 PolarHBondContact NH1-O 2.81Å; R110-D127 VanDerWaalsContact NH1-O 3.1Å; D127-T129 PolarHBondContact O-N 2.82Å; D127-K257 IonicContact OD1-NZ 3.31Å; D127-K257 PolarHBondContact OD1-NZ 3.04Å
128	V	96	Very high	95	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.006	18%	0.175	C	C	.	.			trans	-64.7	129.4	-176.1	176.8	0	0	0	0	110.9	T52 R54 G55 G56 V58 M125 D132 L153 L155	T52-V128 HydrophobicContact CG2-CB 4.21Å; T52-V128 HydrophobicContact CG2-CG1 3.93Å; T52-V128 HydrophobicContact CG2-CG2 4.14Å; R54-V128 CarbonylContact C-O 3.58Å; R54-V128 WeakPolarHBondContact CA-O 3.42Å; G55-V128 PolarHBondContact N-O 3.18Å; G56-V128 WeakPolarHBondContact O-CG2 3.43Å; G56-V128 PolarHBondContact O-N 2.92Å; V58-V128 HydrophobicContact CG1-CG2 3.79Å; M125-V128 HydrophobicContact CG-CG2 4.09Å; M125-V128 HydrophobicContact SD-CG2 4.1Å; V128-D132 HydrophobicContact CG1-CB 3.9Å; V128-L153 HydrophobicContact CG1-CD2 4.25Å; V128-L155 HydrophobicContact CG1-CD2 3.63Å
129	T	95.1	Very high	95.6	Very high	46 Å²	46	28.7 Å²	28.7	28%	0.282	15%	0.148	S	C	.	.			trans	-100	169.4	-179.7	69.1	0	0	0	0	111.3	D127 D131 D132 L155	D127-T129 PolarHBondContact O-N 2.82Å; T129-D131 PolarHBondContact O-N 2.95Å; T129-D132 PolarHBondContact N-OD2 2.73Å; T129-D132 WeakPolarHBondContact O-CB 3.49Å; T129-D132 PolarHBondContact O-N 3.01Å; T129-D132 PolarHBondContact OG1-N 2.99Å; T129-D132 PolarHBondContact OG1-OD2 2.93Å; T129-L155 WeakPolarHBondContact O-CD1 3.47Å
130	L	94.7	Very high	95.9	Very high	12 Å²	12	25.7 Å²	25.7	6%	0.063	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-62.2	-35.8	175.6	-65.7	178.9	0	0	0	111.7	D132 Y133 L155 V186 F252	L130-D132 PolarHBondContact O-N 3.36Å; L130-Y133 WeakPolarHBondContact O-CB 3.38Å; L130-Y133 PolarHBondContact O-N 2.63Å; L130-L155 HydrophobicContact CD2-CD1 4.21Å; L130-V186 HydrophobicContact CB-CG1 3.72Å; L130-V186 HydrophobicContact CB-CG2 4.12Å; L130-V186 HydrophobicContact CD1-CG1 4.28Å; L130-F252 HydrophobicContact CD2-CD1 4.37Å; L130-F252 HydrophobicContact CD2-CE1 4.12Å
131	D	92.8	Very high	95.8	Very high	103 Å²	103	27.6 Å²	27.6	55%	0.551	14%	0.143	S	C	*	.	G	3₁₀ helix	trans	-72.8	-11	178.5	-63.4	-47.5	0	0	0	113	K82 T129 Y133 V186	K82-D131 PolarHBondContact NZ-O 3.49Å; T129-D131 PolarHBondContact O-N 2.95Å; D131-Y133 VanDerWaalsContact C-N 3.3Å; D131-V186 WeakPolarHBondContact OD1-CG1 3.35Å
132	D	95	Very high	95.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-79.4	-13.8	175.2	-65.1	-38	0	0	0	111.9	F107 R110 M125 V128 T129 L130 G134 Y136 L153	F107-D132 VanDerWaalsContact CE1-OD1 3.24Å; F107-D132 WeakPolarHBondContact CE1-OD1 3.48Å; R110-D132 IonicContact CZ-OD1 3.36Å; R110-D132 IonicContact CZ-OD2 3.07Å; R110-D132 IonicContact NH1-OD1 3.33Å; R110-D132 IonicContact NH1-OD2 3.41Å; R110-D132 PolarHBondContact NH1-OD2 2.98Å; R110-D132 IonicContact NH2-OD1 2.62Å; R110-D132 PolarHBondContact NH2-OD1 3.3Å; R110-D132 IonicContact NH2-OD2 3.61Å; R110-D132 PolarHBondContact NH2-OD2 3.48Å; M125-D132 HydrophobicContact SD-CB 3.92Å; V128-D132 HydrophobicContact CG1-CB 3.9Å; T129-D132 PolarHBondContact N-OD2 2.73Å; T129-D132 WeakPolarHBondContact O-CB 3.49Å; T129-D132 PolarHBondContact O-N 3.01Å; T129-D132 PolarHBondContact OG1-N 2.99Å; T129-D132 PolarHBondContact OG1-OD2 2.93Å; L130-D132 PolarHBondContact O-N 3.36Å; D132-G134 PolarHBondContact O-N 3.35Å; D132-Y136 VanDerWaalsContact O-CE2 3.27Å; D132-Y136 WeakPolarHBondContact O-CE2 3.27Å; D132-Y136 PolarHBondContact O-OH 2.72Å; D132-L153 HydrophobicContact CB-CD2 4.24Å
133	Y	94	Very high	94.8	Very high	41 Å²	41	31 Å²	31	16%	0.161	18%	0.176	C	C	.	.			trans	-53.9	134.8	173	172.7	-87.3	0	0	0	111.4	K82 L130 D131 L153 E154 S189 Q192	K82-Y133 WeakPolarHBondContact CE-O 3.34Å; K82-Y133 PolarHBondContact NZ-O 3.36Å; L130-Y133 WeakPolarHBondContact O-CB 3.38Å; L130-Y133 PolarHBondContact O-N 2.63Å; D131-Y133 VanDerWaalsContact C-N 3.3Å; Y133-L153 WeakPolarHBondContact CD2-O 3.31Å; Y133-E154 HydrophobicContact CE2-CB 4.42Å; Y133-E154 HydrophobicContact CE2-CG 4.08Å; Y133-S189 PolarHBondContact OH-OG 2.93Å; Y133-Q192 HydrophobicContact CE2-CG 4.17Å
134	G	94	Very high	94.1	Very high	13 Å²	13	38.6 Å²	38.6	13%	0.134	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.4	-168.2	173.5	0	0	0	0	0	113.7	D132 L153	D132-G134 PolarHBondContact O-N 3.35Å; G134-L153 PolarHBondContact N-O 2.73Å; G134-L153 VanDerWaalsContact N-O 3.14Å; G134-L153 PolarHBondContact O-N 2.53Å
135	R	95.1	Very high	93.5	Very high	88 Å²	88	39.9 Å²	39.9	33%	0.332	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	137.5	179	-57.3	-175	-162.9	166.4	162.3	110.8	L83 Y87 V150	L83-R135 HydrophobicContact CB-CB 4.27Å; L83-R135 HydrophobicContact CD1-CB 3.96Å; L83-R135 HydrophobicContact CG-CB 4.24Å; L83-R135 PolarHBondContact N-O 3.22Å; Y87-R135 VanDerWaalsContact CD1-NH2 3.34Å; Y87-R135 HydrophobicContact CE1-CG 4.44Å; Y87-R135 PolarHBondContact OH-NE 3.39Å; Y87-R135 PolarHBondContact OH-NH1 2.96Å; Y87-R135 PolarHBondContact OH-NH2 3.05Å; R135-V150 HydrophobicContact CB-CG1 3.85Å; R135-V150 HydrophobicContact CG-CG1 4.43Å
136	Y	97.6	Very high	93.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126.7	-179.2	-69.5	-96.7	0	0	0	109.2	L60 T81 K82 V93 F107 M125 D132 V150 V151 L153	L60-Y136 HydrophobicContact CD1-CD1 3.9Å; L60-Y136 HydrophobicContact CD1-CD2 4Å; L60-Y136 HydrophobicContact CD1-CG 3.61Å; T81-Y136 CarbonylContact O-C 3.56Å; T81-Y136 VanDerWaalsContact O-CA 3.24Å; T81-Y136 WeakPolarHBondContact O-CA 3.47Å; K82-Y136 HydrophobicContact CB-CD1 4.06Å; K82-Y136 HydrophobicContact CB-CE1 3.8Å; K82-Y136 HydrophobicContact CD-CE1 4.19Å; K82-Y136 HydrophobicContact CG-CD1 4.31Å; K82-Y136 HydrophobicContact CG-CE1 3.88Å; K82-Y136 HydrophobicContact CG-CE2 4.3Å; V93-Y136 HydrophobicContact CG2-CD1 4.02Å; V93-Y136 HydrophobicContact CG2-CE1 3.86Å; F107-Y136 HydrophobicContact CE1-CE1 4.19Å; F107-Y136 HydrophobicContact CZ-CE1 4.32Å; M125-Y136 HydrophobicContact CE-CE1 3.92Å; D132-Y136 VanDerWaalsContact O-CE2 3.27Å; D132-Y136 WeakPolarHBondContact O-CE2 3.27Å; D132-Y136 PolarHBondContact O-OH 2.72Å; Y136-V150 CarbonylContact O-C 3.32Å; Y136-V150 WeakPolarHBondContact O-CA 3.48Å; Y136-V151 PolarHBondContact N-O 3.43Å; Y136-V151 PolarHBondContact O-N 2.64Å; Y136-L153 HydrophobicContact CD2-CB 3.98Å; Y136-L153 HydrophobicContact CE2-CB 3.73Å; Y136-L153 HydrophobicContact CE2-CD2 3.96Å; Y136-L153 HydrophobicContact CE2-CG 4.47Å
137	K	97.6	Very high	93	Very high	34 Å²	34	44.8 Å²	44.8	15%	0.148	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	122.1	176.3	-170.4	-177.7	71.5	173.4	0	108.9	W80 T81 L83 E90 T148 V149 V150	W80-K137 WeakPolarHBondContact CA-O 3.46Å; T81-K137 PolarHBondContact N-O 2.78Å; T81-K137 PolarHBondContact O-N 3.4Å; L83-K137 HydrophobicContact CD2-CB 4.24Å; E90-K137 VanDerWaalsContact OE1-CE 3.25Å; E90-K137 WeakPolarHBondContact OE1-CE 3.06Å; E90-K137 IonicContact OE1-NZ 3.5Å; E90-K137 PolarHBondContact OE1-NZ 3.17Å; E90-K137 WeakPolarHBondContact OE2-CE 3.27Å; E90-K137 IonicContact OE2-NZ 3.26Å; E90-K137 PolarHBondContact OE2-NZ 2.93Å; K137-T148 HydrophobicContact CD-CG2 4.34Å; K137-V149 CarbonylContact C-O 3.38Å; K137-V149 WeakPolarHBondContact CA-O 3.26Å; K137-V150 HydrophobicContact CB-CG2 4.22Å; K137-V150 HydrophobicContact CG-CG2 4.08Å
138	C	97.8	Very high	93.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	124.3	164.4	-172.4	0	0	0	0	107.8	C62 W80 T148 V149	C62-C138 HydrophobicContact CB-CB 3.71Å; C62-C138 WeakPolarHBondContact CB-SG 3.47Å; C62-C138 WeakPolarHBondContact SG-CB 3.33Å; C62-C138 CovalentContact SG-SG 2.04Å; C62-C138 PolarHBondContact SG-SG 3.4Å; W80-C138 HydrophobicContact CD2-CB 3.94Å; W80-C138 HydrophobicContact CE3-CB 3.98Å; W80-C138 HydrophobicContact CH2-CB 3.63Å; W80-C138 HydrophobicContact CZ2-CB 3.57Å; W80-C138 HydrophobicContact CZ3-CB 3.82Å; C138-T148 CarbonylContact O-C 3.57Å; C138-T148 WeakPolarHBondContact O-CA 3.47Å; C138-T148 WeakPolarHBondContact O-CB 3.44Å; C138-V149 HydrophobicContact CB-CG1 3.89Å; C138-V149 PolarHBondContact N-O 2.82Å; C138-V149 PolarHBondContact O-N 2.84Å
139	E	97.3	Very high	93.1	Very high	35 Å²	35	45 Å²	45	16%	0.164	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	120.4	175.1	178.4	-177.4	-169.8	0	0	107.5	K79 I141 T148	K79-E139 HydrophobicContact CB-CB 4.32Å; K79-E139 PolarHBondContact N-O 2.98Å; K79-E139 PolarHBondContact O-N 3.33Å; E139-I141 HydrophobicContact CG-CD1 4.33Å; E139-I141 HydrophobicContact CG-CG1 4.13Å; E139-T148 HydrophobicContact CB-CG2 3.87Å; E139-T148 HydrophobicContact CG-CG2 3.86Å
140	V	95.1	Very high	93.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	122.9	177.1	-170.1	0	0	0	0	108.3	F41 V43 I64 R77 I78 A121 D146 D147	F41-V140 HydrophobicContact CE1-CB 4.5Å; F41-V140 WeakPolarHBondContact CE1-O 3.35Å; F41-V140 HydrophobicContact CZ-CB 3.98Å; F41-V140 HydrophobicContact CZ-CG1 3.74Å; V43-V140 HydrophobicContact CG1-CG2 4.33Å; V43-V140 HydrophobicContact CG2-CB 3.71Å; V43-V140 HydrophobicContact CG2-CG2 3.7Å; I64-V140 HydrophobicContact CD1-CG1 3.76Å; I64-V140 HydrophobicContact CD1-CG2 4.27Å; I64-V140 HydrophobicContact CG1-CG1 4.13Å; I64-V140 HydrophobicContact CG1-CG2 4.1Å; R77-V140 WeakPolarHBondContact O-CA 3.34Å; I78-V140 HydrophobicContact CG1-CG1 4.24Å; I78-V140 HydrophobicContact CG1-CG2 4.36Å; A121-V140 HydrophobicContact CB-CG2 4.1Å; V140-D146 WeakPolarHBondContact O-CA 3.36Å; V140-D147 PolarHBondContact N-O 2.8Å; V140-D147 PolarHBondContact O-N 2.82Å; V140-D147 VanDerWaalsContact O-N 3.13Å
141	I	92.3	Very high	93.3	Very high	48 Å²	48	45 Å²	45	25%	0.246	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123.3	-178	-55.1	161.9	0	0	0	108.1	M76 R77 E139 D146	M76-I141 WeakPolarHBondContact CA-O 3.47Å; R77-I141 HydrophobicContact CB-CB 4.36Å; R77-I141 PolarHBondContact N-O 2.82Å; R77-I141 PolarHBondContact O-N 3.19Å; E139-I141 HydrophobicContact CG-CD1 4.33Å; E139-I141 HydrophobicContact CG-CG1 4.13Å; I141-D146 HydrophobicContact CB-CB 4.47Å; I141-D146 HydrophobicContact CG1-CB 4.01Å; I141-D146 HydrophobicContact CG2-CB 4.49Å
142	D	87.3	Confident	93.5	Very high	10 Å²	10	41.8 Å²	41.8	5%	0.053	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	86.7	180	-168.2	32.7	0	0	0	111.6	F41 R66 S73 M76 L144 E145	F41-D142 HydrophobicContact CD2-CB 4.22Å; F41-D142 HydrophobicContact CE2-CB 3.73Å; F41-D142 HydrophobicContact CZ-CB 3.94Å; R66-D142 IonicContact CZ-OD2 2.65Å; R66-D142 IonicContact NE-OD2 3.14Å; R66-D142 PolarHBondContact NE-OD2 3.38Å; R66-D142 VanDerWaalsContact NH2-CG 3.27Å; R66-D142 IonicContact NH2-OD1 3.16Å; R66-D142 PolarHBondContact NH2-OD1 3.31Å; R66-D142 IonicContact NH2-OD2 2.96Å; R66-D142 PolarHBondContact NH2-OD2 3.14Å; S73-D142 WeakPolarHBondContact CB-OD1 3.23Å; S73-D142 PolarHBondContact OG-OD1 3.09Å; M76-D142 HydrophobicContact CG-CB 4.35Å; D142-L144 PolarHBondContact O-N 3.32Å; D142-L144 VanDerWaalsContact O-N 3.09Å; D142-E145 CarbonylContact C-O 3.53Å; D142-E145 PolarHBondContact N-O 2.78Å; D142-E145 PolarHBondContact O-N 2.59Å; D142-E145 VanDerWaalsContact O-N 3.13Å
143	G	84.1	Confident	93.5	Very high	66 Å²	66	41.8 Å²	41.8	68%	0.68	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.5	-105.6	-176.8	0	0	0	0	0	111.7
144	L	82.5	Confident	93.5	Very high	158 Å²	158	42.1 Å²	42.1	83%	0.827	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-8.1	176.3	-62.7	178.3	0	0	0	112.7	D142	D142-L144 PolarHBondContact O-N 3.32Å; D142-L144 VanDerWaalsContact O-N 3.09Å
145	E	85.5	Confident	93.6	Very high	54 Å²	54	42 Å²	42	25%	0.252	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	134.7	177.7	-65	173.5	-174.9	0	0	108.8	F41 D142	F41-E145 HydrophobicContact CB-CB 4.27Å; F41-E145 WeakPolarHBondContact CB-OE2 3.5Å; F41-E145 HydrophobicContact CD1-CB 4.18Å; F41-E145 HydrophobicContact CG-CB 4.28Å; D142-E145 CarbonylContact C-O 3.53Å; D142-E145 PolarHBondContact N-O 2.78Å; D142-E145 PolarHBondContact O-N 2.59Å; D142-E145 VanDerWaalsContact O-N 3.13Å
146	D	90.4	Very high	93.6	Very high	99 Å²	99	42.5 Å²	42.5	53%	0.529	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	144.9	172	68.5	-59.4	0	0	0	110.1	V140 I141	V140-D146 WeakPolarHBondContact O-CA 3.36Å; I141-D146 HydrophobicContact CB-CB 4.47Å; I141-D146 HydrophobicContact CG1-CB 4.01Å; I141-D146 HydrophobicContact CG2-CB 4.49Å
147	D	94.4	Very high	93.5	Very high	52 Å²	52	43.7 Å²	43.7	28%	0.278	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	159.3	171.1	-166.7	19.5	0	0	0	110.2	F41 N42 V43 V140	F41-D147 HydrophobicContact CD1-CB 4.09Å; F41-D147 HydrophobicContact CE1-CB 4.04Å; N42-D147 WeakPolarHBondContact CA-OD2 3.38Å; V43-D147 HydrophobicContact CB-CB 4.2Å; V43-D147 HydrophobicContact CG2-CB 3.93Å; V43-D147 PolarHBondContact N-OD2 2.53Å; V140-D147 PolarHBondContact N-O 2.8Å; V140-D147 PolarHBondContact O-N 2.82Å; V140-D147 VanDerWaalsContact O-N 3.13Å
148	T	95.9	Very high	93.5	Very high	60 Å²	60	42.6 Å²	42.6	37%	0.368	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	149.4	-172.1	63.6	0	0	0	0	112.4	K137 C138 E139	K137-T148 HydrophobicContact CD-CG2 4.34Å; C138-T148 CarbonylContact O-C 3.57Å; C138-T148 WeakPolarHBondContact O-CA 3.47Å; C138-T148 WeakPolarHBondContact O-CB 3.44Å; E139-T148 HydrophobicContact CB-CG2 3.87Å; E139-T148 HydrophobicContact CG-CG2 3.86Å
149	V	96.7	Very high	93.5	Very high	25 Å²	25	43.4 Å²	43.4	15%	0.152	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	146	167.1	71	0	0	0	0	110.4	V43 A45 C62 K137 C138	V43-V149 HydrophobicContact CG1-CB 4.06Å; V43-V149 HydrophobicContact CG1-CG1 3.63Å; A45-V149 HydrophobicContact CB-CB 4.5Å; A45-V149 HydrophobicContact CB-CG1 4.17Å; A45-V149 HydrophobicContact CB-CG2 3.54Å; C62-V149 HydrophobicContact CB-CG1 4.38Å; K137-V149 CarbonylContact C-O 3.38Å; K137-V149 WeakPolarHBondContact CA-O 3.26Å; C138-V149 HydrophobicContact CB-CG1 3.89Å; C138-V149 PolarHBondContact N-O 2.82Å; C138-V149 PolarHBondContact O-N 2.84Å
150	V	96.6	Very high	93.6	Very high	59 Å²	59	41.7 Å²	41.7	36%	0.358	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	127.5	176.3	179.2	0	0	0	0	109.8	L83 R135 Y136 K137	L83-V150 HydrophobicContact CD1-CG1 4.24Å; L83-V150 HydrophobicContact CD1-CG2 4.46Å; R135-V150 HydrophobicContact CB-CG1 3.85Å; R135-V150 HydrophobicContact CG-CG1 4.43Å; Y136-V150 CarbonylContact O-C 3.32Å; Y136-V150 WeakPolarHBondContact O-CA 3.48Å; K137-V150 HydrophobicContact CB-CG2 4.22Å; K137-V150 HydrophobicContact CG-CG2 4.08Å
151	V	97.3	Very high	93.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	130.9	176.4	-178.3	0	0	0	0	109.3	A45 V50 L60 P61 W80 Y136	A45-V151 HydrophobicContact CB-CG2 3.82Å; V50-V151 HydrophobicContact CG1-CG1 4.33Å; V50-V151 HydrophobicContact CG2-CG1 4.19Å; L60-V151 HydrophobicContact CB-CG1 4.43Å; L60-V151 HydrophobicContact CD2-CB 4.42Å; L60-V151 HydrophobicContact CD2-CG1 3.81Å; P61-V151 HydrophobicContact CG-CG2 4.36Å; P61-V151 WeakPolarHBondContact O-CG2 3.45Å; W80-V151 HydrophobicContact CH2-CG2 4.3Å; Y136-V151 PolarHBondContact N-O 3.43Å; Y136-V151 PolarHBondContact O-N 2.64Å
152	S	96.1	Very high	94	Very high	35 Å²	35	41 Å²	41	25%	0.245	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	121.4	174.4	-57.6	0	0	0	0	110.6	A48 K49 V50	A48-S152 PolarHBondContact O-N 3.17Å; K49-S152 WeakPolarHBondContact CA-O 3.32Å; V50-S152 PolarHBondContact N-O 3.47Å
153	L	96.3	Very high	94.5	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	111.9	169.3	176.7	55.8	0	0	0	109.4	V50 T52 V58 L60 M125 V128 D132 Y133 G134 Y136	V50-L153 HydrophobicContact CG2-CD1 3.9Å; T52-L153 HydrophobicContact CG2-CD1 3.78Å; V58-L153 HydrophobicContact CB-CD1 4.3Å; V58-L153 HydrophobicContact CG1-CD1 3.85Å; V58-L153 HydrophobicContact CG1-CD2 4.22Å; V58-L153 HydrophobicContact CG2-CD1 3.93Å; L60-L153 HydrophobicContact CD2-CB 4.15Å; M125-L153 HydrophobicContact SD-CD2 4.19Å; V128-L153 HydrophobicContact CG1-CD2 4.25Å; D132-L153 HydrophobicContact CB-CD2 4.24Å; Y133-L153 WeakPolarHBondContact CD2-O 3.31Å; G134-L153 PolarHBondContact N-O 2.73Å; G134-L153 VanDerWaalsContact N-O 3.14Å; G134-L153 PolarHBondContact O-N 2.53Å; Y136-L153 HydrophobicContact CD2-CB 3.98Å; Y136-L153 HydrophobicContact CE2-CB 3.73Å; Y136-L153 HydrophobicContact CE2-CD2 3.96Å; Y136-L153 HydrophobicContact CE2-CG 4.47Å
154	E	94.6	Very high	95	Very high	47 Å²	47	39.6 Å²	39.6	22%	0.22	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	151.7	174.7	-67.6	-168.3	-160.9	0	0	112.2	K49 V50 V51 T52 Y133	K49-E154 HydrophobicContact CD-CG 4.48Å; K49-E154 WeakPolarHBondContact CD-OE1 3.36Å; K49-E154 WeakPolarHBondContact CE-OE1 3.43Å; K49-E154 WeakPolarHBondContact CE-OE2 3.48Å; K49-E154 HydrophobicContact CG-CG 4.37Å; K49-E154 IonicContact NZ-OE1 3.37Å; K49-E154 PolarHBondContact NZ-OE1 3.05Å; K49-E154 IonicContact NZ-OE2 2.77Å; K49-E154 PolarHBondContact NZ-OE2 2.87Å; V50-E154 PolarHBondContact O-N 3.07Å; V51-E154 WeakPolarHBondContact CA-O 2.87Å; V51-E154 HydrophobicContact CG2-CB 4.25Å; T52-E154 PolarHBondContact N-O 3.06Å; Y133-E154 HydrophobicContact CE2-CB 4.42Å; Y133-E154 HydrophobicContact CE2-CG 4.08Å
155	L	94.9	Very high	95.6	Very high	12 Å²	12	40 Å²	40	6%	0.063	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130.5	177.1	-61.6	179.8	0	0	0	109.7	T52 V128 T129 L130 G157 F252	T52-L155 HydrophobicContact CG2-CD2 3.63Å; T52-L155 CarbonylContact O-C 3.56Å; T52-L155 VanDerWaalsContact O-CA 3.31Å; T52-L155 WeakPolarHBondContact O-CA 3.45Å; V128-L155 HydrophobicContact CG1-CD2 3.63Å; T129-L155 WeakPolarHBondContact O-CD1 3.47Å; L130-L155 HydrophobicContact CD2-CD1 4.21Å; L155-G157 PolarHBondContact O-N 3.11Å; L155-F252 HydrophobicContact CB-CE1 3.94Å; L155-F252 HydrophobicContact CB-CZ 3.84Å; L155-F252 HydrophobicContact CD1-CE1 4.3Å; L155-F252 WeakPolarHBondContact O-CZ 3.34Å
156	E	94.8	Very high	95.9	Very high	97 Å²	97	44.5 Å²	44.5	45%	0.453	23%	0.234	S	C	.	.			trans	-62.6	126.2	165.2	-62.2	-173.7	165.6	0	0	108.9	V51 T52 S254 F255	V51-E156 HydrophobicContact CG1-CG 3.54Å; T52-E156 PolarHBondContact O-N 3.13Å; E156-S254 WeakPolarHBondContact O-CB 3.43Å; E156-S254 PolarHBondContact O-OG 2.99Å; E156-F255 HydrophobicContact CB-CD2 4.23Å; E156-F255 HydrophobicContact CB-CE2 3.8Å; E156-F255 VanDerWaalsContact OE2-CE2 3.3Å; E156-F255 WeakPolarHBondContact OE2-CE2 3.23Å
157	G	95.9	Very high	96.1	Very high	26 Å²	26	40.9 Å²	40.9	27%	0.268	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.2	-164	-173.8	0	0	0	0	0	113.9	L155 T253	L155-G157 PolarHBondContact O-N 3.11Å; G157-T253 CarbonylContact C-O 3.57Å; G157-T253 WeakPolarHBondContact CA-O 3.4Å
158	V	97.3	Very high	96.2	Very high	11 Å²	11	44.4 Å²	44.4	7%	0.067	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	132.1	-176.9	59.7	0	0	0	0	110	F252 T253 F292 W295 K296	V158-F252 WeakPolarHBondContact O-CA 3.47Å; V158-T253 HydrophobicContact CG1-CG2 3.64Å; V158-T253 PolarHBondContact N-O 3.46Å; V158-T253 PolarHBondContact O-N 3.45Å; V158-T253 VanDerWaalsContact O-N 3.07Å; V158-F292 HydrophobicContact CG1-CB 3.96Å; V158-W295 HydrophobicContact CG2-CZ3 4.39Å; V158-K296 HydrophobicContact CB-CB 3.98Å; V158-K296 HydrophobicContact CB-CG 4.06Å; V158-K296 HydrophobicContact CG1-CB 4.45Å; V158-K296 HydrophobicContact CG2-CB 3.81Å; V158-K296 HydrophobicContact CG2-CG 3.88Å
159	V	98.4	Very high	96.2	Very high	16 Å²	16	46.3 Å²	46.3	10%	0.097	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	135.6	166.9	177	0	0	0	0	108.9	A188 Q192 L193 A196 M201 F250 C251 F252	V159-A188 HydrophobicContact CG1-CB 4.16Å; V159-A188 HydrophobicContact CG2-CB 4.07Å; V159-Q192 HydrophobicContact CG2-CB 3.77Å; V159-Q192 WeakPolarHBondContact CG2-O 3.26Å; V159-L193 HydrophobicContact CG1-CD1 4.17Å; V159-A196 HydrophobicContact CB-CB 3.85Å; V159-A196 HydrophobicContact CG1-CB 4.48Å; V159-A196 HydrophobicContact CG2-CB 4.17Å; V159-M201 HydrophobicContact CG1-SD 4.21Å; V159-F250 HydrophobicContact CG1-CB 3.96Å; V159-F250 HydrophobicContact CG1-CD1 4.13Å; V159-F250 HydrophobicContact CG1-CG 4.41Å; V159-C251 CarbonylContact C-O 3.45Å; V159-C251 VanDerWaalsContact CA-O 3.29Å; V159-C251 WeakPolarHBondContact CA-O 3.39Å; V159-F252 HydrophobicContact CG2-CD2 4.05Å
160	F	98.4	Very high	96.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	144.2	174.5	65.2	-87.3	0	0	0	111.8	Y162 Q183 A185 C251 T253 V288 F292	F160-Y162 HydrophobicContact CE2-CD2 4.46Å; F160-Q183 HydrophobicContact CZ-CB 4.4Å; F160-A185 HydrophobicContact CE1-CB 3.84Å; F160-A185 HydrophobicContact CZ-CB 3.76Å; F160-C251 HydrophobicContact CD1-CB 4.23Å; F160-C251 WeakPolarHBondContact CD1-O 3.39Å; F160-C251 HydrophobicContact CD2-CB 4.22Å; F160-C251 HydrophobicContact CE1-CB 3.68Å; F160-C251 HydrophobicContact CE2-CB 3.68Å; F160-C251 HydrophobicContact CG-CB 4.48Å; F160-C251 HydrophobicContact CZ-CB 3.39Å; F160-C251 PolarHBondContact N-O 2.92Å; F160-C251 PolarHBondContact O-N 3.13Å; F160-T253 HydrophobicContact CD1-CG2 4.17Å; F160-T253 HydrophobicContact CE1-CG2 3.77Å; F160-V288 HydrophobicContact CD2-CG1 4.12Å; F160-V288 HydrophobicContact CE2-CG1 3.82Å; F160-F292 HydrophobicContact CB-CB 4.24Å; F160-F292 HydrophobicContact CB-CD1 3.47Å; F160-F292 VanDerWaalsContact CB-CD1 3.47Å; F160-F292 HydrophobicContact CB-CD2 3.56Å; F160-F292 HydrophobicContact CB-CE1 3.53Å; F160-F292 HydrophobicContact CB-CE2 3.62Å; F160-F292 HydrophobicContact CB-CG 3.48Å; F160-F292 VanDerWaalsContact CB-CG 3.48Å; F160-F292 HydrophobicContact CB-CZ 3.61Å; F160-F292 HydrophobicContact CD1-CB 4Å; F160-F292 HydrophobicContact CD1-CD2 4.09Å; F160-F292 HydrophobicContact CD1-CG 4.06Å; F160-F292 AromaticContact CD2-CD2 3.67Å; F160-F292 HydrophobicContact CD2-CD2 3.67Å; F160-F292 AromaticContact CD2-CE2 3.73Å; F160-F292 HydrophobicContact CD2-CE2 3.73Å; F160-F292 HydrophobicContact CD2-CG 4.37Å; F160-F292 HydrophobicContact CD2-CZ 4.47Å; F160-F292 HydrophobicContact CE2-CD2 4.36Å; F160-F292 HydrophobicContact CG-CB 4.2Å; F160-F292 HydrophobicContact CG-CD1 4.25Å; F160-F292 AromaticContact CG-CD2 3.5Å; F160-F292 HydrophobicContact CG-CD2 3.5Å; F160-F292 AromaticContact CG-CE2 3.84Å; F160-F292 HydrophobicContact CG-CE2 3.84Å; F160-F292 AromaticContact CG-CG 3.73Å; F160-F292 HydrophobicContact CG-CG 3.73Å; F160-F292 HydrophobicContact CG-CZ 4.34Å
161	P	98.1	Very high	96.4	Very high	15 Å²	15	46.4 Å²	46.4	10%	0.097	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	143.7	174.8	31.7	-31.4	0	0	0	110.5	M201 W203 F250	P161-M201 HydrophobicContact CG-CE 4.23Å; P161-W203 HydrophobicContact CB-CD2 3.74Å; P161-W203 HydrophobicContact CB-CE3 4.41Å; P161-W203 HydrophobicContact CB-CG 4.03Å; P161-W203 HydrophobicContact CB-CH2 4.32Å; P161-W203 HydrophobicContact CB-CZ2 3.66Å; P161-W203 HydrophobicContact CG-CD2 3.52Å; P161-W203 VanDerWaalsContact CG-CE2 3.42Å; P161-W203 HydrophobicContact CG-CE3 3.68Å; P161-W203 HydrophobicContact CG-CG 4.18Å; P161-W203 HydrophobicContact CG-CH2 3.63Å; P161-W203 HydrophobicContact CG-CZ2 3.49Å; P161-W203 VanDerWaalsContact CG-CZ2 3.49Å; P161-W203 HydrophobicContact CG-CZ3 3.72Å; P161-F250 HydrophobicContact CB-CD1 4.15Å; P161-F250 HydrophobicContact CB-CE1 3.9Å
162	Y	98.5	Very high	96.4	Very high	17 Å²	17	47.6 Å²	47.6	7%	0.067	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	140.6	178.4	-175	-92.1	0	0	0	111.9	F160 A179 Q183 V249 V288	F160-Y162 HydrophobicContact CE2-CD2 4.46Å; Y162-A179 HydrophobicContact CD1-CB 4Å; Y162-A179 HydrophobicContact CE1-CB 3.73Å; Y162-Q183 HydrophobicContact CD2-CG 4.06Å; Y162-Q183 HydrophobicContact CE2-CG 3.56Å; Y162-V249 HydrophobicContact CD1-CG1 4.1Å; Y162-V249 PolarHBondContact N-O 3.23Å; Y162-V249 PolarHBondContact O-N 3.04Å; Y162-V288 HydrophobicContact CD2-CG1 4.41Å; Y162-V288 HydrophobicContact CE2-CG2 4.3Å
163	F	97.3	Very high	96.5	Very high	28 Å²	28	46.1 Å²	46.1	12%	0.123	22%	0.224	C	C	.	.			trans	-143.4	147.9	168.2	63.1	-91.8	0	0	0	109	R168 D248 F333 F336	F163-R168 HydrophobicContact CB-CG 4.4Å; F163-R168 HydrophobicContact CD1-CG 4.1Å; F163-R168 HydrophobicContact CD2-CG 4.05Å; F163-R168 HydrophobicContact CE1-CG 4.38Å; F163-R168 HydrophobicContact CE2-CG 4.32Å; F163-R168 HydrophobicContact CG-CG 3.93Å; F163-R168 HydrophobicContact CZ-CG 4.47Å; F163-D248 HydrophobicContact CB-CB 4.46Å; F163-D248 WeakPolarHBondContact CB-OD1 3.21Å; F163-F333 HydrophobicContact CE1-CE1 4.33Å; F163-F333 HydrophobicContact CE2-CE1 4.02Å; F163-F333 AromaticContact CE2-CZ 3.99Å; F163-F333 HydrophobicContact CE2-CZ 3.99Å; F163-F333 HydrophobicContact CZ-CD1 4.08Å; F163-F333 AromaticContact CZ-CE1 3.4Å; F163-F333 HydrophobicContact CZ-CE1 3.4Å; F163-F333 AromaticContact CZ-CZ 3.73Å; F163-F333 HydrophobicContact CZ-CZ 3.73Å; F163-F336 HydrophobicContact CD2-CE2 4.37Å; F163-F336 HydrophobicContact CE2-CE2 4.03Å
164	P	95.4	Very high	96.6	Very high	20 Å²	20	50.7 Å²	50.7	13%	0.13	24%	0.242	C	C	.	.			trans	-79.6	172.8	-174.3	35.1	-37.9	0	0	0	111.8	L166 G167 N170 L171	P164-L166 PolarHBondContact O-N 3.24Å; P164-L166 VanDerWaalsContact O-N 3.13Å; P164-G167 PolarHBondContact O-N 3.28Å; P164-N170 HydrophobicContact CG-CB 4.47Å; P164-L171 HydrophobicContact CB-CD2 4.42Å; P164-L171 HydrophobicContact CG-CD2 3.82Å; P164-L171 HydrophobicContact CG-CG 4.07Å
165	R	94.3	Very high	96.8	Very high	165 Å²	165	51 Å²	51	62%	0.623	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-28.7	176.1	177.2	175.7	159.3	-153.6	-6.1	114.4	G167 F336	R165-G167 PolarHBondContact O-N 2.52Å; R165-G167 VanDerWaalsContact O-N 3.15Å; R165-F336 HydrophobicContact CB-CB 4.43Å; R165-F336 HydrophobicContact CB-CD1 3.7Å; R165-F336 HydrophobicContact CB-CD2 4.18Å; R165-F336 HydrophobicContact CB-CE1 3.89Å; R165-F336 HydrophobicContact CB-CE2 4.35Å; R165-F336 HydrophobicContact CB-CG 3.86Å; R165-F336 HydrophobicContact CB-CZ 4.22Å; R165-F336 HydrophobicContact CG-CB 3.86Å; R165-F336 HydrophobicContact CG-CD1 4.02Å; R165-F336 HydrophobicContact CG-CD2 4.38Å; R165-F336 HydrophobicContact CG-CG 3.84Å
166	L	93.3	Very high	97	Very high	149 Å²	149	50.4 Å²	50.4	78%	0.78	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-11.8	177	-74.2	92.4	0	0	0	112.9	P164 N170	P164-L166 PolarHBondContact O-N 3.24Å; P164-L166 VanDerWaalsContact O-N 3.13Å; L166-N170 PolarHBondContact O-ND2 2.84Å; L166-N170 VanDerWaalsContact O-ND2 3.16Å
167	G	94	Very high	97.1	Very high	23 Å²	23	49.1 Å²	49.1	24%	0.237	24%	0.236	C	C	.	.			trans	109.6	-179.1	178.5	0	0	0	0	0	112.1	P164 R165 N170	P164-G167 PolarHBondContact O-N 3.28Å; R165-G167 PolarHBondContact O-N 2.52Å; R165-G167 VanDerWaalsContact O-N 3.15Å; G167-N170 VanDerWaalsContact C-ND2 3.32Å; G167-N170 PolarHBondContact O-ND2 3.28Å; G167-N170 VanDerWaalsContact O-ND2 3.09Å
168	R	95.9	Very high	97.3	Very high	126 Å²	126	53.6 Å²	53.6	48%	0.475	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	152.8	-179	-65.8	173.7	177.9	-162.1	-0.2	111.9	F163 N170 N205 D248	F163-R168 HydrophobicContact CB-CG 4.4Å; F163-R168 HydrophobicContact CD1-CG 4.1Å; F163-R168 HydrophobicContact CD2-CG 4.05Å; F163-R168 HydrophobicContact CE1-CG 4.38Å; F163-R168 HydrophobicContact CE2-CG 4.32Å; F163-R168 HydrophobicContact CG-CG 3.93Å; F163-R168 HydrophobicContact CZ-CG 4.47Å; R168-N170 VanDerWaalsContact C-N 3.33Å; R168-N170 PolarHBondContact O-N 3.4Å; R168-N170 PolarHBondContact O-ND2 3.45Å; R168-N205 VanDerWaalsContact CD-ND2 3.26Å; R168-N205 WeakPolarHBondContact CD-ND2 3.4Å; R168-N205 PolarHBondContact NE-ND2 3.39Å; R168-N205 VanDerWaalsContact NE-ND2 3.19Å; R168-N205 PolarHBondContact NH1-ND2 2.67Å; R168-N205 VanDerWaalsContact NH1-ND2 3.14Å; R168-N205 PolarHBondContact NH1-OD1 2.91Å; R168-D248 WeakPolarHBondContact CA-OD1 3.08Å; R168-D248 WeakPolarHBondContact CB-OD1 3.44Å
169	Y	96.9	Very high	97.3	Very high	100 Å²	100	53.6 Å²	53.6	39%	0.392	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	41.1	175	-49.4	-35.4	0	0	0	114.1	N205 A206 H246 Y247 D248	Y169-N205 HydrophobicContact CE1-CB 4.06Å; Y169-N205 WeakPolarHBondContact OH-CA 3.11Å; Y169-A206 HydrophobicContact CE1-CB 4.43Å; Y169-A206 WeakPolarHBondContact CE1-O 3.24Å; Y169-A206 PolarHBondContact OH-N 3.36Å; Y169-H246 VanDerWaalsContact O-CB 3.28Å; Y169-H246 WeakPolarHBondContact O-CB 3.3Å; Y169-Y247 HydrophobicContact CD1-CD1 4.48Å; Y169-D248 PolarHBondContact N-OD1 2.85Å
170	N	97.6	Very high	97.3	Very high	75 Å²	75	52.8 Å²	52.8	40%	0.401	24%	0.241	S	C	.	.			trans	-119.9	10.1	179.6	-74.1	-59	0	0	0	113.5	P164 L166 G167 R168	P164-N170 HydrophobicContact CG-CB 4.47Å; L166-N170 PolarHBondContact O-ND2 2.84Å; L166-N170 VanDerWaalsContact O-ND2 3.16Å; G167-N170 VanDerWaalsContact C-ND2 3.32Å; G167-N170 PolarHBondContact O-ND2 3.28Å; G167-N170 VanDerWaalsContact O-ND2 3.09Å; R168-N170 VanDerWaalsContact C-N 3.33Å; R168-N170 PolarHBondContact O-N 3.4Å; R168-N170 PolarHBondContact O-ND2 3.45Å
171	L	98.3	Very high	97.3	Very high	11 Å²	11	58.1 Å²	58.1	6%	0.058	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-109.8	121.2	177.8	-58	170.5	0	0	0	109.8	P164 D175 A176 A179 W208 H246 Y247 V249	P164-L171 HydrophobicContact CB-CD2 4.42Å; P164-L171 HydrophobicContact CG-CD2 3.82Å; P164-L171 HydrophobicContact CG-CG 4.07Å; L171-D175 HydrophobicContact CB-CB 4.27Å; L171-D175 HydrophobicContact CD2-CB 3.84Å; L171-A176 HydrophobicContact CB-CB 4.1Å; L171-A176 HydrophobicContact CD1-CB 4.35Å; L171-A179 HydrophobicContact CD1-CB 4.13Å; L171-A179 HydrophobicContact CD2-CB 4.34Å; L171-W208 PolarHBondContact O-NE1 3.18Å; L171-H246 CarbonylContact O-C 3.43Å; L171-H246 VanDerWaalsContact O-CA 3.29Å; L171-H246 WeakPolarHBondContact O-CA 3.18Å; L171-Y247 WeakPolarHBondContact CB-O 3.28Å; L171-Y247 PolarHBondContact N-O 2.63Å; L171-Y247 VanDerWaalsContact N-O 3.16Å; L171-Y247 PolarHBondContact O-N 3.13Å; L171-V249 HydrophobicContact CD1-CB 4.4Å; L171-V249 HydrophobicContact CD1-CG1 3.82Å
172	N	98.4	Very high	97.3	Very high	26 Å²	26	62.3 Å²	62.3	14%	0.139	29%	0.288	C	S	.	.			trans	-69.8	176.3	156.1	68.7	42.5	0	0	0	109.9	Y174 D175 A176 K242 S245	N172-Y174 PolarHBondContact O-N 3.18Å; N172-Y174 PolarHBondContact OD1-N 3.24Å; N172-Y174 VanDerWaalsContact OD1-N 3.09Å; N172-D175 PolarHBondContact ND2-OD2 2.76Å; N172-D175 PolarHBondContact O-N 3.35Å; N172-D175 WeakPolarHBondContact OD1-CB 3.49Å; N172-D175 PolarHBondContact OD1-N 2.89Å; N172-D175 PolarHBondContact OD1-OD2 2.94Å; N172-A176 VanDerWaalsContact O-CB 3.31Å; N172-A176 WeakPolarHBondContact O-CB 3.16Å; N172-A176 PolarHBondContact O-N 2.81Å; N172-K242 WeakPolarHBondContact CB-O 3.5Å; N172-S245 WeakPolarHBondContact CA-O 3.02Å
173	F	98.4	Very high	97.2	Very high	4 Å²	4	62 Å²	62	2%	0.018	29%	0.287	C	S	.	.	H	α-helix	trans	-62.4	-42.2	-174.2	178.9	-97.6	0	0	0	112.5	A176 E177 W208 L209 K242	F173-A176 WeakPolarHBondContact O-CB 3.47Å; F173-A176 PolarHBondContact O-N 2.93Å; F173-E177 HydrophobicContact CD1-CG 4.4Å; F173-E177 HydrophobicContact CE1-CG 3.9Å; F173-E177 WeakPolarHBondContact CE1-OE1 3.35Å; F173-E177 WeakPolarHBondContact CE1-OE2 3.25Å; F173-E177 HydrophobicContact CZ-CG 4.03Å; F173-E177 PolarHBondContact O-N 3.03Å; F173-W208 HydrophobicContact CB-CD2 4.22Å; F173-W208 HydrophobicContact CB-CE3 4.26Å; F173-W208 HydrophobicContact CB-CH2 4.27Å; F173-W208 HydrophobicContact CB-CZ2 4.24Å; F173-W208 HydrophobicContact CB-CZ3 4.28Å; F173-W208 HydrophobicContact CD2-CB 4.4Å; F173-W208 HydrophobicContact CD2-CD2 4.08Å; F173-W208 AromaticContact CD2-CE3 3.8Å; F173-W208 HydrophobicContact CD2-CE3 3.8Å; F173-W208 HydrophobicContact CD2-CG 4.37Å; F173-W208 HydrophobicContact CD2-CZ3 4.34Å; F173-L209 WeakPolarHBondContact CE2-O 3.07Å; F173-K242 HydrophobicContact CB-CB 3.72Å; F173-K242 HydrophobicContact CB-CD 4.33Å; F173-K242 HydrophobicContact CB-CG 3.8Å; F173-K242 WeakPolarHBondContact CB-O 3.39Å; F173-K242 HydrophobicContact CD1-CB 4.44Å; F173-K242 HydrophobicContact CD1-CD 3.67Å; F173-K242 HydrophobicContact CD1-CG 4.12Å; F173-K242 HydrophobicContact CE1-CD 4.12Å; F173-K242 HydrophobicContact CG-CB 4.26Å; F173-K242 HydrophobicContact CG-CD 3.93Å; F173-K242 HydrophobicContact CG-CG 3.89Å; F173-K242 PolarHBondContact N-O 2.83Å
174	Y	98.3	Very high	97.2	Very high	96 Å²	96	61.9 Å²	61.9	38%	0.376	29%	0.288	S	S	.	.	H	α-helix	trans	-72.8	-33.8	-178.4	-55.7	-67.3	0	0	0	112.6	N172 A176 R178 K242 D243	N172-Y174 PolarHBondContact O-N 3.18Å; N172-Y174 PolarHBondContact OD1-N 3.24Å; N172-Y174 VanDerWaalsContact OD1-N 3.09Å; Y174-A176 VanDerWaalsContact C-N 3.3Å; Y174-R178 WeakPolarHBondContact O-CG 3.38Å; Y174-R178 PolarHBondContact O-N 3.3Å; Y174-R178 VanDerWaalsContact O-N 3.13Å; Y174-R178 PolarHBondContact O-NH1 3.4Å; Y174-K242 HydrophobicContact CE2-CB 4.23Å; Y174-D243 VanDerWaalsContact CE2-OD1 3.31Å; Y174-D243 WeakPolarHBondContact CE2-OD1 3.47Å
175	D	98.4	Very high	97.3	Very high	53 Å²	53	61.1 Å²	61.1	28%	0.283	28%	0.283	S	S	.	.	H	α-helix	trans	-65.9	-36.3	169.8	-74.5	-43.3	0	0	0	111.2	L171 N172 R178 A179	L171-D175 HydrophobicContact CB-CB 4.27Å; L171-D175 HydrophobicContact CD2-CB 3.84Å; N172-D175 PolarHBondContact ND2-OD2 2.76Å; N172-D175 PolarHBondContact O-N 3.35Å; N172-D175 WeakPolarHBondContact OD1-CB 3.49Å; N172-D175 PolarHBondContact OD1-N 2.89Å; N172-D175 PolarHBondContact OD1-OD2 2.94Å; D175-R178 IonicContact OD1-CZ 3.85Å; D175-R178 IonicContact OD1-NE 3.77Å; D175-R178 IonicContact OD1-NH2 2.98Å; D175-R178 PolarHBondContact OD1-NH2 3.35Å; D175-A179 WeakPolarHBondContact O-CB 3.44Å; D175-A179 PolarHBondContact O-N 3.03Å
176	A	98.5	Very high	97.5	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.7	-42.1	174.9	0	0	0	0	0	112.5	L171 N172 F173 Y174 A179 C180 W208 V249	L171-A176 HydrophobicContact CB-CB 4.1Å; L171-A176 HydrophobicContact CD1-CB 4.35Å; N172-A176 VanDerWaalsContact O-CB 3.31Å; N172-A176 WeakPolarHBondContact O-CB 3.16Å; N172-A176 PolarHBondContact O-N 2.81Å; F173-A176 WeakPolarHBondContact O-CB 3.47Å; F173-A176 PolarHBondContact O-N 2.93Å; Y174-A176 VanDerWaalsContact C-N 3.3Å; A176-A179 PolarHBondContact O-N 3.2Å; A176-C180 PolarHBondContact O-N 3.11Å; A176-C180 PolarHBondContact O-SG 3.39Å; A176-W208 HydrophobicContact CB-CB 4.22Å; A176-W208 HydrophobicContact CB-CG 4.15Å; A176-V249 HydrophobicContact CB-CB 3.75Å; A176-V249 HydrophobicContact CB-CG1 4.3Å; A176-V249 HydrophobicContact CB-CG2 3.81Å
177	E	98.3	Very high	97.7	Very high	71 Å²	71	47.9 Å²	47.9	33%	0.332	23%	0.227	S	C	.	.	H	α-helix	trans	-58.7	-51.1	172.8	-74.6	-177.6	126.6	0	0	111.6	F173 A179 C180 Q181 V187	F173-E177 HydrophobicContact CD1-CG 4.4Å; F173-E177 HydrophobicContact CE1-CG 3.9Å; F173-E177 WeakPolarHBondContact CE1-OE1 3.35Å; F173-E177 WeakPolarHBondContact CE1-OE2 3.25Å; F173-E177 HydrophobicContact CZ-CG 4.03Å; F173-E177 PolarHBondContact O-N 3.03Å; E177-A179 VanDerWaalsContact C-N 3.33Å; E177-A179 PolarHBondContact O-N 3.5Å; E177-C180 PolarHBondContact O-N 2.97Å; E177-Q181 WeakPolarHBondContact O-CG 3.35Å; E177-Q181 PolarHBondContact O-N 3.04Å; E177-V187 HydrophobicContact CB-CG2 4.23Å; E177-V187 HydrophobicContact CG-CG2 3.64Å
178	R	98.3	Very high	97.9	Very high	120 Å²	120	46.8 Å²	46.8	45%	0.453	22%	0.215	S	C	.	.	H	α-helix	trans	-59.6	-43.6	176.4	-74.1	-173.3	-70.7	-86.8	7	112	Y174 D175 C180 Q181 D182	Y174-R178 WeakPolarHBondContact O-CG 3.38Å; Y174-R178 PolarHBondContact O-N 3.3Å; Y174-R178 VanDerWaalsContact O-N 3.13Å; Y174-R178 PolarHBondContact O-NH1 3.4Å; D175-R178 IonicContact OD1-CZ 3.85Å; D175-R178 IonicContact OD1-NE 3.77Å; D175-R178 IonicContact OD1-NH2 2.98Å; D175-R178 PolarHBondContact OD1-NH2 3.35Å; R178-C180 VanDerWaalsContact C-N 3.34Å; R178-C180 PolarHBondContact O-N 3.38Å; R178-Q181 PolarHBondContact O-N 2.93Å; R178-D182 WeakPolarHBondContact O-CB 3.31Å; R178-D182 PolarHBondContact O-N 3.25Å
179	A	98.3	Very high	97.9	Very high	10 Å²	10	41.3 Å²	41.3	8%	0.083	20%	0.196	C	C	.	.	H	α-helix	trans	-59.4	-42.5	178.7	0	0	0	0	0	112.3	Y162 L171 D175 A176 E177 Q183	Y162-A179 HydrophobicContact CD1-CB 4Å; Y162-A179 HydrophobicContact CE1-CB 3.73Å; L171-A179 HydrophobicContact CD1-CB 4.13Å; L171-A179 HydrophobicContact CD2-CB 4.34Å; D175-A179 WeakPolarHBondContact O-CB 3.44Å; D175-A179 PolarHBondContact O-N 3.03Å; A176-A179 PolarHBondContact O-N 3.2Å; E177-A179 VanDerWaalsContact C-N 3.33Å; E177-A179 PolarHBondContact O-N 3.5Å; A179-Q183 WeakPolarHBondContact O-CG 3.07Å; A179-Q183 PolarHBondContact O-N 2.85Å
180	C	98.6	Very high	97.8	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66.1	-44.7	174.3	-66.8	0	0	0	0	111.6	A176 E177 R178 D182 Q183 D184 A185 V249 C251	A176-C180 PolarHBondContact O-N 3.11Å; A176-C180 PolarHBondContact O-SG 3.39Å; E177-C180 PolarHBondContact O-N 2.97Å; R178-C180 VanDerWaalsContact C-N 3.34Å; R178-C180 PolarHBondContact O-N 3.38Å; C180-D182 VanDerWaalsContact C-N 3.34Å; C180-D182 PolarHBondContact O-N 2.6Å; C180-Q183 CarbonylContact O-C 3.51Å; C180-Q183 WeakPolarHBondContact O-CA 3.44Å; C180-Q183 PolarHBondContact O-N 2.99Å; C180-D184 PolarHBondContact O-N 2.87Å; C180-A185 CarbonylContact C-O 3.48Å; C180-A185 HydrophobicContact CB-CB 4.21Å; C180-A185 CarbonylContact O-C 3.6Å; C180-A185 WeakPolarHBondContact O-CA 3.47Å; C180-A185 WeakPolarHBondContact O-CB 3.38Å; C180-A185 PolarHBondContact O-N 3.14Å; C180-A185 VanDerWaalsContact O-O 3.07Å; C180-V249 VanDerWaalsContact SG-CG2 3.53Å; C180-C251 WeakPolarHBondContact CA-SG 3.45Å; C180-C251 HydrophobicContact CB-CB 3.83Å; C180-C251 WeakPolarHBondContact CB-SG 3.34Å; C180-C251 VanDerWaalsContact SG-CA 3.51Å; C180-C251 WeakPolarHBondContact SG-CB 3.37Å; C180-C251 CovalentContact SG-SG 2.04Å; C180-C251 PolarHBondContact SG-SG 3.38Å
181	Q	97.9	Very high	97.6	Very high	111 Å²	111	39.7 Å²	39.7	52%	0.519	19%	0.191	S	C	.	.	H	α-helix	trans	-59.7	-43.8	178.9	-71.6	172	-6.5	0	0	112.1	E177 R178 Q183 D184 A185	E177-Q181 WeakPolarHBondContact O-CG 3.35Å; E177-Q181 PolarHBondContact O-N 3.04Å; R178-Q181 PolarHBondContact O-N 2.93Å; Q181-Q183 PolarHBondContact O-N 2.77Å; Q181-Q183 VanDerWaalsContact O-N 3.14Å; Q181-D184 PolarHBondContact O-N 2.88Å; Q181-A185 VanDerWaalsContact CA-O 3.26Å; Q181-A185 WeakPolarHBondContact CA-O 3.45Å; Q181-A185 PolarHBondContact N-O 2.98Å; Q181-A185 VanDerWaalsContact N-O 3.16Å
182	D	97.9	Very high	97.6	Very high	104 Å²	104	40 Å²	40	56%	0.556	19%	0.192	S	C	*	.	H	α-helix	trans	-58.3	-29.2	175.4	-76.3	-16.2	0	0	0	111.9	R178 C180 K287	R178-D182 WeakPolarHBondContact O-CB 3.31Å; R178-D182 PolarHBondContact O-N 3.25Å; C180-D182 VanDerWaalsContact C-N 3.34Å; C180-D182 PolarHBondContact O-N 2.6Å; D182-K287 WeakPolarHBondContact O-CD 3.5Å; D182-K287 WeakPolarHBondContact O-CE 3.47Å; D182-K287 PolarHBondContact O-NZ 2.97Å
183	Q	98	Very high	97.5	Very high	9 Å²	9	38.7 Å²	38.7	4%	0.042	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	14.6	176.9	-58.5	-42.9	-57.6	0	0	115	F160 Y162 A179 C180 Q181 V288 G289	F160-Q183 HydrophobicContact CZ-CB 4.4Å; Y162-Q183 HydrophobicContact CD2-CG 4.06Å; Y162-Q183 HydrophobicContact CE2-CG 3.56Å; A179-Q183 WeakPolarHBondContact O-CG 3.07Å; A179-Q183 PolarHBondContact O-N 2.85Å; C180-Q183 CarbonylContact O-C 3.51Å; C180-Q183 WeakPolarHBondContact O-CA 3.44Å; C180-Q183 PolarHBondContact O-N 2.99Å; Q181-Q183 PolarHBondContact O-N 2.77Å; Q181-Q183 VanDerWaalsContact O-N 3.14Å; Q183-V288 HydrophobicContact CB-CB 4.25Å; Q183-V288 HydrophobicContact CG-CB 4.09Å; Q183-V288 HydrophobicContact CG-CG2 4.43Å; Q183-V288 VanDerWaalsContact OE1-CG2 3.29Å; Q183-G289 WeakPolarHBondContact O-CA 3.43Å; Q183-G289 PolarHBondContact O-N 3.05Å
184	D	96.8	Very high	97.5	Very high	27 Å²	27	42.8 Å²	42.8	14%	0.144	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	46.1	-178.9	-161.7	19.2	0	0	0	112.4	R54 C180 Q181 T253 H256 K287 Q290	R54-D184 IonicContact CZ-OD1 3.47Å; R54-D184 IonicContact NH1-OD1 2.75Å; R54-D184 PolarHBondContact NH1-OD1 3.16Å; R54-D184 IonicContact NH1-OD2 3.34Å; R54-D184 IonicContact NH2-OD1 3.22Å; R54-D184 PolarHBondContact NH2-OD1 3.32Å; C180-D184 PolarHBondContact O-N 2.87Å; Q181-D184 PolarHBondContact O-N 2.88Å; D184-T253 WeakPolarHBondContact O-CB 3.2Å; D184-T253 PolarHBondContact O-OG1 3.37Å; D184-H256 IonicContact OD2-CD2 2.63Å; D184-H256 PolarHBondContact OD2-CD2 3.18Å; D184-H256 IonicContact OD2-NE2 2.95Å; D184-H256 PolarHBondContact OD2-NE2 3.16Å; D184-K287 HydrophobicContact CB-CD 3.78Å; D184-Q290 HydrophobicContact CB-CG 4.45Å; D184-Q290 PolarHBondContact OD2-NE2 2.74Å
185	A	97.8	Very high	97.4	Very high	3 Å²	3	41.8 Å²	41.8	3%	0.025	20%	0.2	C	C	.	.			trans	-146.3	169.4	-176.4	0	0	0	0	0	110.9	F160 C180 Q181 C251 F252	F160-A185 HydrophobicContact CE1-CB 3.84Å; F160-A185 HydrophobicContact CZ-CB 3.76Å; C180-A185 CarbonylContact C-O 3.48Å; C180-A185 HydrophobicContact CB-CB 4.21Å; C180-A185 CarbonylContact O-C 3.6Å; C180-A185 WeakPolarHBondContact O-CA 3.47Å; C180-A185 WeakPolarHBondContact O-CB 3.38Å; C180-A185 PolarHBondContact O-N 3.14Å; C180-A185 VanDerWaalsContact O-O 3.07Å; Q181-A185 VanDerWaalsContact CA-O 3.26Å; Q181-A185 WeakPolarHBondContact CA-O 3.45Å; Q181-A185 PolarHBondContact N-O 2.98Å; Q181-A185 VanDerWaalsContact N-O 3.16Å; A185-C251 HydrophobicContact CB-CB 3.79Å; A185-F252 CarbonylContact C-O 3.53Å; A185-F252 VanDerWaalsContact CA-O 3.27Å; A185-F252 WeakPolarHBondContact CA-O 3.21Å; A185-F252 VanDerWaalsContact CB-O 3.26Å; A185-F252 WeakPolarHBondContact CB-O 3.4Å
186	V	97.6	Very high	97.4	Very high	23 Å²	23	40.4 Å²	40.4	14%	0.139	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	164.6	169.2	-65.5	0	0	0	0	109.2	L130 D131 A188 C251 F252	L130-V186 HydrophobicContact CB-CG1 3.72Å; L130-V186 HydrophobicContact CB-CG2 4.12Å; L130-V186 HydrophobicContact CD1-CG1 4.28Å; D131-V186 WeakPolarHBondContact OD1-CG1 3.35Å; V186-A188 PolarHBondContact O-N 2.84Å; V186-C251 CarbonylContact O-C 3.53Å; V186-C251 VanDerWaalsContact O-CA 3.29Å; V186-C251 WeakPolarHBondContact O-CA 3.26Å; V186-F252 HydrophobicContact CG2-CB 4.4Å; V186-F252 HydrophobicContact CG2-CD1 4.21Å; V186-F252 PolarHBondContact N-O 3.02Å; V186-F252 PolarHBondContact O-N 3.41Å
187	V	98.1	Very high	97.3	Very high	14 Å²	14	42.8 Å²	42.8	9%	0.085	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	131.3	172.4	-174.8	0	0	0	0	108.6	E177 L209 V249	E177-V187 HydrophobicContact CB-CG2 4.23Å; E177-V187 HydrophobicContact CG-CG2 3.64Å; V187-L209 VanDerWaalsContact CG1-C 3.42Å; V187-V249 HydrophobicContact CG1-CG2 3.98Å; V187-V249 HydrophobicContact CG2-CG2 4.16Å
188	A	97.9	Very high	97.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-67.4	144.5	-177.9	0	0	0	0	0	111.3	V159 V186 Q192 L209 S210 F250 F252	V159-A188 HydrophobicContact CG1-CB 4.16Å; V159-A188 HydrophobicContact CG2-CB 4.07Å; V186-A188 PolarHBondContact O-N 2.84Å; A188-Q192 HydrophobicContact CB-CB 4.42Å; A188-L209 HydrophobicContact CB-CD2 4.32Å; A188-L209 CarbonylContact O-C 3.08Å; A188-L209 WeakPolarHBondContact O-CA 3.4Å; A188-L209 WeakPolarHBondContact O-CD2 3.3Å; A188-S210 PolarHBondContact O-N 3.16Å; A188-F250 HydrophobicContact CB-CB 4.09Å; A188-F250 WeakPolarHBondContact CB-O 3.32Å; A188-F250 PolarHBondContact N-O 2.93Å; A188-F252 HydrophobicContact CB-CB 3.99Å
189	S	95.8	Very high	97.1	Very high	10 Å²	10	43.8 Å²	43.8	7%	0.07	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-76.1	165.2	168.1	73.3	0	0	0	0	111.3	Y133 D191 Q192 L193 S210	Y133-S189 PolarHBondContact OH-OG 2.93Å; S189-D191 VanDerWaalsContact C-N 3.31Å; S189-D191 PolarHBondContact O-N 2.96Å; S189-D191 PolarHBondContact OG-N 3.02Å; S189-Q192 PolarHBondContact O-N 2.97Å; S189-Q192 VanDerWaalsContact OG-CG 3.32Å; S189-Q192 WeakPolarHBondContact OG-CG 3.44Å; S189-Q192 PolarHBondContact OG-N 2.93Å; S189-Q192 VanDerWaalsContact OG-N 3.11Å; S189-L193 PolarHBondContact O-N 3.29Å; S189-S210 WeakPolarHBondContact CA-OG 3.16Å
190	F	95.3	Very high	96.9	Very high	73 Å²	73	45.7 Å²	45.7	32%	0.32	24%	0.244	S	C	.	.	H	α-helix	trans	-57.9	-44.6	170.4	174.6	-98	0	0	0	111.9	Q192 L193 Y194 L209 Q215 I234	F190-Q192 VanDerWaalsContact C-N 3.29Å; F190-Q192 PolarHBondContact O-N 2.76Å; F190-L193 PolarHBondContact O-N 2.84Å; F190-L193 VanDerWaalsContact O-N 3.14Å; F190-Y194 HydrophobicContact CZ-CD2 4.33Å; F190-Y194 WeakPolarHBondContact O-CB 3.29Å; F190-Y194 PolarHBondContact O-N 3.42Å; F190-L209 HydrophobicContact CB-CD1 4.25Å; F190-L209 HydrophobicContact CD2-CD1 4.32Å; F190-Q215 VanDerWaalsContact CE2-OE1 3.28Å; F190-I234 HydrophobicContact CE2-CD1 3.99Å; F190-I234 HydrophobicContact CE2-CG2 4.32Å; F190-I234 HydrophobicContact CZ-CD1 4.46Å
191	D	93.9	Very high	96.8	Very high	69 Å²	69	47.1 Å²	47.1	37%	0.369	25%	0.251	S	S	.	.	H	α-helix	trans	-59.5	-41.7	180	-60	-32.4	0	0	0	111.1	S189 Y194 E195	S189-D191 VanDerWaalsContact C-N 3.31Å; S189-D191 PolarHBondContact O-N 2.96Å; S189-D191 PolarHBondContact OG-N 3.02Å; D191-Y194 PolarHBondContact O-N 3.18Å; D191-E195 WeakPolarHBondContact O-CG 3.1Å; D191-E195 PolarHBondContact O-N 3.36Å
192	Q	96.6	Very high	96.7	Very high	16 Å²	16	43.9 Å²	43.9	8%	0.075	24%	0.237	C	C	.	.	H	α-helix	trans	-65.1	-42.8	175.8	-72.6	169.7	-19.3	0	0	112.1	Y133 V159 A188 S189 F190 Y194 E195 A196 F252	Y133-Q192 HydrophobicContact CE2-CG 4.17Å; V159-Q192 HydrophobicContact CG2-CB 3.77Å; V159-Q192 WeakPolarHBondContact CG2-O 3.26Å; A188-Q192 HydrophobicContact CB-CB 4.42Å; S189-Q192 PolarHBondContact O-N 2.97Å; S189-Q192 VanDerWaalsContact OG-CG 3.32Å; S189-Q192 WeakPolarHBondContact OG-CG 3.44Å; S189-Q192 PolarHBondContact OG-N 2.93Å; S189-Q192 VanDerWaalsContact OG-N 3.11Å; F190-Q192 VanDerWaalsContact C-N 3.29Å; F190-Q192 PolarHBondContact O-N 2.76Å; Q192-Y194 VanDerWaalsContact C-N 3.33Å; Q192-E195 PolarHBondContact O-N 3.37Å; Q192-A196 WeakPolarHBondContact O-CB 3.43Å; Q192-A196 PolarHBondContact O-N 3.17Å; Q192-F252 HydrophobicContact CB-CD2 4.3Å; Q192-F252 VanDerWaalsContact CD-CD2 3.49Å; Q192-F252 VanDerWaalsContact CD-CG 3.47Å; Q192-F252 HydrophobicContact CG-CD2 3.98Å; Q192-F252 HydrophobicContact CG-CE2 4.24Å; Q192-F252 HydrophobicContact CG-CG 4.43Å; Q192-F252 VanDerWaalsContact NE2-CD1 3.33Å; Q192-F252 VanDerWaalsContact NE2-CG 3.34Å
193	L	98	Very high	96.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.4	-40.1	175.6	-176.4	67.5	0	0	0	111.4	V159 S189 F190 A196 W197 M201 L209 Q215 P217 I234 F250	V159-L193 HydrophobicContact CG1-CD1 4.17Å; S189-L193 PolarHBondContact O-N 3.29Å; F190-L193 PolarHBondContact O-N 2.84Å; F190-L193 VanDerWaalsContact O-N 3.14Å; L193-A196 WeakPolarHBondContact O-CB 3.47Å; L193-A196 PolarHBondContact O-N 3.02Å; L193-W197 WeakPolarHBondContact O-CB 3.27Å; L193-W197 PolarHBondContact O-N 3.25Å; L193-M201 HydrophobicContact CD1-SD 4.32Å; L193-L209 HydrophobicContact CB-CD2 4.12Å; L193-L209 HydrophobicContact CD2-CD1 3.98Å; L193-L209 HydrophobicContact CD2-CD2 4.03Å; L193-L209 HydrophobicContact CD2-CG 4.48Å; L193-Q215 HydrophobicContact CD2-CB 4.19Å; L193-P217 HydrophobicContact CD1-CG 3.94Å; L193-I234 HydrophobicContact CD2-CD1 4.11Å; L193-I234 HydrophobicContact CD2-CG2 4.15Å; L193-I234 HydrophobicContact CG-CD1 4Å; L193-F250 HydrophobicContact CD1-CB 4.46Å; L193-F250 HydrophobicContact CD1-CD1 3.9Å; L193-F250 HydrophobicContact CD1-CD2 4.12Å; L193-F250 HydrophobicContact CD1-CE1 4.17Å; L193-F250 HydrophobicContact CD1-CE2 4.37Å; L193-F250 HydrophobicContact CD1-CG 3.87Å; L193-F250 HydrophobicContact CD1-CZ 4.39Å; L193-F250 HydrophobicContact CD2-CD2 4.34Å; L193-F250 HydrophobicContact CD2-CE2 4.48Å
194	Y	97.1	Very high	96.6	Very high	90 Å²	90	43.6 Å²	43.6	35%	0.353	23%	0.233	S	C	.	.	H	α-helix	trans	-61.1	-47.3	177.1	-177.3	-101	0	0	0	111.4	F190 D191 Q192 A196 W197 R198 I234	F190-Y194 HydrophobicContact CZ-CD2 4.33Å; F190-Y194 WeakPolarHBondContact O-CB 3.29Å; F190-Y194 PolarHBondContact O-N 3.42Å; D191-Y194 PolarHBondContact O-N 3.18Å; Q192-Y194 VanDerWaalsContact C-N 3.33Å; Y194-A196 VanDerWaalsContact C-N 3.33Å; Y194-A196 PolarHBondContact O-N 3.13Å; Y194-W197 AromaticContact CD2-CE3 3.99Å; Y194-W197 HydrophobicContact CD2-CE3 3.99Å; Y194-W197 HydrophobicContact CD2-CZ3 4.26Å; Y194-W197 AromaticContact CE2-CE3 3.82Å; Y194-W197 HydrophobicContact CE2-CE3 3.82Å; Y194-W197 AromaticContact CE2-CZ3 3.62Å; Y194-W197 HydrophobicContact CE2-CZ3 3.62Å; Y194-W197 PolarHBondContact O-N 2.95Å; Y194-R198 HydrophobicContact CD1-CG 4.28Å; Y194-R198 HydrophobicContact CE1-CG 3.94Å; Y194-R198 WeakPolarHBondContact O-CG 3.4Å; Y194-R198 PolarHBondContact O-N 3.39Å; Y194-I234 HydrophobicContact CD2-CD1 4.12Å
195	E	96.3	Very high	96.6	Very high	75 Å²	75	42.9 Å²	42.9	35%	0.35	23%	0.229	S	C	.	.	H	α-helix	trans	-62.6	-39.4	174.7	-71.1	-56.4	149.7	0	0	112.5	D191 Q192 W197 R198 G199	D191-E195 WeakPolarHBondContact O-CG 3.1Å; D191-E195 PolarHBondContact O-N 3.36Å; Q192-E195 PolarHBondContact O-N 3.37Å; E195-W197 PolarHBondContact O-N 3.21Å; E195-R198 PolarHBondContact O-N 2.82Å; E195-R198 IonicContact OE1-CZ 2.77Å; E195-R198 IonicContact OE1-NE 2.64Å; E195-R198 PolarHBondContact OE1-NE 3.4Å; E195-R198 IonicContact OE1-NH1 3.05Å; E195-R198 IonicContact OE1-NH2 3.5Å; E195-R198 PolarHBondContact OE1-NH2 3.48Å; E195-R198 IonicContact OE2-CZ 2.65Å; E195-R198 IonicContact OE2-NE 2.96Å; E195-R198 PolarHBondContact OE2-NE 3.28Å; E195-R198 VanDerWaalsContact OE2-NE 3.08Å; E195-R198 IonicContact OE2-NH2 2.72Å; E195-R198 PolarHBondContact OE2-NH2 3.32Å; E195-G199 PolarHBondContact O-N 3.2Å
196	A	97.5	Very high	96.6	Very high	23 Å²	23	42.9 Å²	42.9	19%	0.19	23%	0.229	C	C	.	.	H	α-helix	trans	-62.5	-42.9	174.6	0	0	0	0	0	112.1	V159 Q192 L193 Y194 G199 G200 M201	V159-A196 HydrophobicContact CB-CB 3.85Å; V159-A196 HydrophobicContact CG1-CB 4.48Å; V159-A196 HydrophobicContact CG2-CB 4.17Å; Q192-A196 WeakPolarHBondContact O-CB 3.43Å; Q192-A196 PolarHBondContact O-N 3.17Å; L193-A196 WeakPolarHBondContact O-CB 3.47Å; L193-A196 PolarHBondContact O-N 3.02Å; Y194-A196 VanDerWaalsContact C-N 3.33Å; Y194-A196 PolarHBondContact O-N 3.13Å; A196-G199 CarbonylContact O-C 3.59Å; A196-G199 WeakPolarHBondContact O-CA 3.34Å; A196-G199 PolarHBondContact O-N 3.5Å; A196-G199 VanDerWaalsContact O-N 3.17Å; A196-G200 PolarHBondContact O-N 3.06Å; A196-M201 VanDerWaalsContact C-CB 3.48Å; A196-M201 HydrophobicContact CB-CB 4.12Å; A196-M201 HydrophobicContact CB-SD 3.74Å; A196-M201 WeakPolarHBondContact O-CB 3.35Å; A196-M201 PolarHBondContact O-N 3.09Å
197	W	97.9	Very high	96.6	Very high	51 Å²	51	41.8 Å²	41.8	19%	0.193	22%	0.222	C	C	.	.	H	α-helix	trans	-63	-45.7	175.1	169.6	72.9	0	0	0	112.2	L193 Y194 E195 G199 G200 P217 I218 P232 I234	L193-W197 WeakPolarHBondContact O-CB 3.27Å; L193-W197 PolarHBondContact O-N 3.25Å; Y194-W197 AromaticContact CD2-CE3 3.99Å; Y194-W197 HydrophobicContact CD2-CE3 3.99Å; Y194-W197 HydrophobicContact CD2-CZ3 4.26Å; Y194-W197 AromaticContact CE2-CE3 3.82Å; Y194-W197 HydrophobicContact CE2-CE3 3.82Å; Y194-W197 AromaticContact CE2-CZ3 3.62Å; Y194-W197 HydrophobicContact CE2-CZ3 3.62Å; Y194-W197 PolarHBondContact O-N 2.95Å; E195-W197 PolarHBondContact O-N 3.21Å; W197-G199 PolarHBondContact O-N 2.77Å; W197-G200 WeakPolarHBondContact O-CA 3.46Å; W197-G200 PolarHBondContact O-N 2.9Å; W197-P217 HydrophobicContact CB-CB 3.74Å; W197-P217 HydrophobicContact CG-CB 4.03Å; W197-I218 PolarHBondContact NE1-O 3.21Å; W197-P232 HydrophobicContact CZ2-CB 4.28Å; W197-I234 HydrophobicContact CB-CD1 4.29Å; W197-I234 HydrophobicContact CB-CG1 4.22Å; W197-I234 HydrophobicContact CD2-CG1 4.48Å; W197-I234 HydrophobicContact CG-CG1 4.18Å
198	R	97.2	Very high	96.6	Very high	152 Å²	152	41.1 Å²	41.1	57%	0.574	22%	0.218	S	C	*	.	H	α-helix	trans	-58.7	-33.4	173	-67	-158	-44.4	-175.7	12.9	111.9	Y194 E195 G200	Y194-R198 HydrophobicContact CD1-CG 4.28Å; Y194-R198 HydrophobicContact CE1-CG 3.94Å; Y194-R198 WeakPolarHBondContact O-CG 3.4Å; Y194-R198 PolarHBondContact O-N 3.39Å; E195-R198 PolarHBondContact O-N 2.82Å; E195-R198 IonicContact OE1-CZ 2.77Å; E195-R198 IonicContact OE1-NE 2.64Å; E195-R198 PolarHBondContact OE1-NE 3.4Å; E195-R198 IonicContact OE1-NH1 3.05Å; E195-R198 IonicContact OE1-NH2 3.5Å; E195-R198 PolarHBondContact OE1-NH2 3.48Å; E195-R198 IonicContact OE2-CZ 2.65Å; E195-R198 IonicContact OE2-NE 2.96Å; E195-R198 PolarHBondContact OE2-NE 3.28Å; E195-R198 VanDerWaalsContact OE2-NE 3.08Å; E195-R198 IonicContact OE2-NH2 2.72Å; E195-R198 PolarHBondContact OE2-NH2 3.32Å; R198-G200 PolarHBondContact O-N 3.09Å
199	G	94.6	Very high	96.6	Very high	59 Å²	59	41.1 Å²	41.1	61%	0.608	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.3	5.3	172.9	0	0	0	0	0	115.3	E195 A196 W197	E195-G199 PolarHBondContact O-N 3.2Å; A196-G199 CarbonylContact O-C 3.59Å; A196-G199 WeakPolarHBondContact O-CA 3.34Å; A196-G199 PolarHBondContact O-N 3.5Å; A196-G199 VanDerWaalsContact O-N 3.17Å; W197-G199 PolarHBondContact O-N 2.77Å
200	G	95.2	Very high	96.6	Very high	50 Å²	50	42.1 Å²	42.1	52%	0.515	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	97	12	175.6	0	0	0	0	0	115.4	A196 W197 R198 D202	A196-G200 PolarHBondContact O-N 3.06Å; W197-G200 WeakPolarHBondContact O-CA 3.46Å; W197-G200 PolarHBondContact O-N 2.9Å; R198-G200 PolarHBondContact O-N 3.09Å; G200-D202 PolarHBondContact O-N 3.05Å
201	M	96.3	Very high	96.5	Very high	30 Å²	30	41.2 Å²	41.2	15%	0.148	22%	0.224	C	C	.	.			trans	-68.2	120.5	177.2	-174.8	173.6	-175.7	0	0	111.5	V159 P161 L193 A196 W203 P217 F250	V159-M201 HydrophobicContact CG1-SD 4.21Å; P161-M201 HydrophobicContact CG-CE 4.23Å; L193-M201 HydrophobicContact CD1-SD 4.32Å; A196-M201 VanDerWaalsContact C-CB 3.48Å; A196-M201 HydrophobicContact CB-CB 4.12Å; A196-M201 HydrophobicContact CB-SD 3.74Å; A196-M201 WeakPolarHBondContact O-CB 3.35Å; A196-M201 PolarHBondContact O-N 3.09Å; M201-W203 HydrophobicContact CE-CB 4.19Å; M201-P217 HydrophobicContact CG-CG 3.96Å; M201-P217 HydrophobicContact SD-CG 4.26Å; M201-F250 HydrophobicContact CE-CD1 3.71Å; M201-F250 HydrophobicContact CE-CE1 3.44Å; M201-F250 VanDerWaalsContact CE-CE1 3.44Å
202	D	95.9	Very high	96.6	Very high	43 Å²	43	38 Å²	38	23%	0.23	21%	0.207	C	C	.	.			trans	-121.6	115.5	173.7	-171.4	-65.9	0	0	0	109.5	G200 T219 T220 R222	G200-D202 PolarHBondContact O-N 3.05Å; D202-T219 HydrophobicContact CB-CG2 4.33Å; D202-T219 WeakPolarHBondContact CB-OG1 3.37Å; D202-T219 PolarHBondContact OD2-N 3.5Å; D202-T219 PolarHBondContact OD2-OG1 3.45Å; D202-T220 PolarHBondContact OD2-N 3.06Å; D202-R222 VanDerWaalsContact CG-NH1 3.27Å; D202-R222 IonicContact OD1-CZ 2.66Å; D202-R222 IonicContact OD1-NH1 3.02Å; D202-R222 PolarHBondContact OD1-NH1 3.4Å; D202-R222 IonicContact OD1-NH2 2.76Å; D202-R222 PolarHBondContact OD1-NH2 2.89Å; D202-R222 IonicContact OD2-NH1 2.74Å; D202-R222 PolarHBondContact OD2-NH1 3.34Å
203	W	96.7	Very high	96.6	Very high	75 Å²	75	37.3 Å²	37.3	28%	0.284	20%	0.204	S	C	.	.			trans	-144.9	116.5	-178.4	-162.5	-99.9	0	0	0	111.2	P161 M201 N205 Y216 P217 F250	P161-W203 HydrophobicContact CB-CD2 3.74Å; P161-W203 HydrophobicContact CB-CE3 4.41Å; P161-W203 HydrophobicContact CB-CG 4.03Å; P161-W203 HydrophobicContact CB-CH2 4.32Å; P161-W203 HydrophobicContact CB-CZ2 3.66Å; P161-W203 HydrophobicContact CG-CD2 3.52Å; P161-W203 VanDerWaalsContact CG-CE2 3.42Å; P161-W203 HydrophobicContact CG-CE3 3.68Å; P161-W203 HydrophobicContact CG-CG 4.18Å; P161-W203 HydrophobicContact CG-CH2 3.63Å; P161-W203 HydrophobicContact CG-CZ2 3.49Å; P161-W203 VanDerWaalsContact CG-CZ2 3.49Å; P161-W203 HydrophobicContact CG-CZ3 3.72Å; M201-W203 HydrophobicContact CE-CB 4.19Å; W203-N205 VanDerWaalsContact C-N 3.31Å; W203-N205 PolarHBondContact O-N 2.04Å; W203-Y216 WeakPolarHBondContact O-CB 3.47Å; W203-Y216 WeakPolarHBondContact O-CD2 3.49Å; W203-P217 HydrophobicContact CB-CG 4.23Å; W203-P217 PolarHBondContact N-O 3.15Å; W203-F250 HydrophobicContact CB-CE1 4.17Å; W203-F250 HydrophobicContact CB-CZ 4.29Å; W203-F250 AromaticContact CD1-CE1 3.88Å; W203-F250 AromaticContact CD1-CZ 3.79Å; W203-F250 HydrophobicContact CG-CE1 4.15Å; W203-F250 HydrophobicContact CG-CZ 4.32Å
204	C	95.4	Very high	96.6	Very high	33 Å²	33	37.3 Å²	37.3	22%	0.223	20%	0.204	C	C	.	.			trans	-95.6	38.3	-173.2	-176.4	0	0	0	0	113.6	I218 P224 C225	C204-I218 HydrophobicContact CB-CD1 4Å; C204-P224 PolarHBondContact SG-O 2.82Å; C204-C225 HydrophobicContact CB-CB 3.88Å; C204-C225 WeakPolarHBondContact CB-SG 3.44Å; C204-C225 WeakPolarHBondContact SG-CA 3.43Å; C204-C225 WeakPolarHBondContact SG-CB 3.28Å; C204-C225 CovalentContact SG-SG 2Å; C204-C225 PolarHBondContact SG-SG 2.99Å
205	N	96.4	Very high	96.7	Very high	11 Å²	11	33.4 Å²	33.4	6%	0.059	19%	0.189	C	C	.	.	S	Bend	trans	-129.4	133.3	169.5	-59.3	11.4	0	0	0	109.1	R168 Y169 W203 Y216 D248	R168-N205 VanDerWaalsContact CD-ND2 3.26Å; R168-N205 WeakPolarHBondContact CD-ND2 3.4Å; R168-N205 PolarHBondContact NE-ND2 3.39Å; R168-N205 VanDerWaalsContact NE-ND2 3.19Å; R168-N205 PolarHBondContact NH1-ND2 2.67Å; R168-N205 VanDerWaalsContact NH1-ND2 3.14Å; R168-N205 PolarHBondContact NH1-OD1 2.91Å; Y169-N205 HydrophobicContact CE1-CB 4.06Å; Y169-N205 WeakPolarHBondContact OH-CA 3.11Å; W203-N205 VanDerWaalsContact C-N 3.31Å; W203-N205 PolarHBondContact O-N 2.04Å; N205-Y216 WeakPolarHBondContact O-CB 3.2Å; N205-D248 WeakPolarHBondContact CB-OD2 3.29Å; N205-D248 PolarHBondContact ND2-OD2 2.91Å
206	A	97.9	Very high	96.8	Very high	3 Å²	3	30.6 Å²	30.6	3%	0.025	18%	0.176	C	C	.	.			trans	-66.2	130.7	174.1	0	0	0	0	0	110.8	Y169 V214 Y216 Y237 Y247 D248	Y169-A206 HydrophobicContact CE1-CB 4.43Å; Y169-A206 WeakPolarHBondContact CE1-O 3.24Å; Y169-A206 PolarHBondContact OH-N 3.36Å; A206-V214 HydrophobicContact CB-CG1 3.72Å; A206-Y216 HydrophobicContact CB-CD1 4.16Å; A206-Y237 HydrophobicContact CB-CD2 4.14Å; A206-Y237 HydrophobicContact CB-CE2 3.81Å; A206-Y247 HydrophobicContact CB-CD1 3.93Å; A206-Y247 HydrophobicContact CB-CE1 4.35Å; A206-D248 PolarHBondContact O-N 2.87Å
207	G	98.4	Very high	96.8	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	151.3	179.6	0	0	0	0	0	113	V214 Q215 D248	G207-V214 WeakPolarHBondContact O-CA 3.5Å; G207-Q215 PolarHBondContact N-O 3.38Å; G207-Q215 PolarHBondContact O-N 3.47Å; G207-D248 CarbonylContact C-O 3.07Å; G207-D248 VanDerWaalsContact CA-O 3.24Å; G207-D248 WeakPolarHBondContact CA-O 3.38Å
208	W	98.7	Very high	96.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	145.1	174.3	-68.4	110	0	0	0	112.6	L171 F173 A176 G212 V214 R240 S245 Y247 D248 V249 F250	L171-W208 PolarHBondContact O-NE1 3.18Å; F173-W208 HydrophobicContact CB-CD2 4.22Å; F173-W208 HydrophobicContact CB-CE3 4.26Å; F173-W208 HydrophobicContact CB-CH2 4.27Å; F173-W208 HydrophobicContact CB-CZ2 4.24Å; F173-W208 HydrophobicContact CB-CZ3 4.28Å; F173-W208 HydrophobicContact CD2-CB 4.4Å; F173-W208 HydrophobicContact CD2-CD2 4.08Å; F173-W208 AromaticContact CD2-CE3 3.8Å; F173-W208 HydrophobicContact CD2-CE3 3.8Å; F173-W208 HydrophobicContact CD2-CG 4.37Å; F173-W208 HydrophobicContact CD2-CZ3 4.34Å; A176-W208 HydrophobicContact CB-CB 4.22Å; A176-W208 HydrophobicContact CB-CG 4.15Å; W208-G212 WeakPolarHBondContact CZ3-O 3.36Å; W208-V214 HydrophobicContact CD2-CG2 3.69Å; W208-V214 HydrophobicContact CE3-CG2 3.32Å; W208-V214 HydrophobicContact CG-CG2 4.39Å; W208-V214 HydrophobicContact CH2-CG2 4.15Å; W208-V214 HydrophobicContact CZ2-CG2 4.44Å; W208-V214 HydrophobicContact CZ3-CG2 3.59Å; W208-R240 HydrophobicContact CH2-CB 3.58Å; W208-R240 HydrophobicContact CZ3-CB 3.71Å; W208-S245 WeakPolarHBondContact CZ2-O 3.2Å; W208-Y247 HydrophobicContact CD2-CD2 4.4Å; W208-Y247 AromaticContact CE2-CD2 3.77Å; W208-Y247 HydrophobicContact CH2-CD2 4.35Å; W208-Y247 AromaticContact CZ2-CD2 3.75Å; W208-Y247 HydrophobicContact CZ2-CD2 3.75Å; W208-Y247 HydrophobicContact CZ2-CE2 4.29Å; W208-D248 VanDerWaalsContact CD1-O 3.24Å; W208-D248 PolarHBondContact N-O 3.26Å; W208-V249 HydrophobicContact CB-CB 4.44Å; W208-V249 HydrophobicContact CB-CG2 4.18Å; W208-F250 PolarHBondContact O-N 3.32Å
209	L	98.1	Very high	96.7	Very high	0 Å²	0	22 Å²	22	0%	0	14%	0.143	C	C	.	.			trans	-121.4	162.1	168.6	-63.8	179.3	0	0	0	110.8	F173 V187 A188 F190 L193 D211 G212 S213 Q215 F250	F173-L209 WeakPolarHBondContact CE2-O 3.07Å; V187-L209 VanDerWaalsContact CG1-C 3.42Å; A188-L209 HydrophobicContact CB-CD2 4.32Å; A188-L209 CarbonylContact O-C 3.08Å; A188-L209 WeakPolarHBondContact O-CA 3.4Å; A188-L209 WeakPolarHBondContact O-CD2 3.3Å; F190-L209 HydrophobicContact CB-CD1 4.25Å; F190-L209 HydrophobicContact CD2-CD1 4.32Å; L193-L209 HydrophobicContact CB-CD2 4.12Å; L193-L209 HydrophobicContact CD2-CD1 3.98Å; L193-L209 HydrophobicContact CD2-CD2 4.03Å; L193-L209 HydrophobicContact CD2-CG 4.48Å; L209-D211 PolarHBondContact O-N 3.42Å; L209-D211 VanDerWaalsContact O-N 3.09Å; L209-G212 PolarHBondContact O-N 3.16Å; L209-S213 PolarHBondContact N-O 2.9Å; L209-Q215 HydrophobicContact CD1-CB 3.98Å; L209-Q215 HydrophobicContact CD1-CG 3.81Å; L209-F250 HydrophobicContact CD2-CB 4.11Å; L209-F250 HydrophobicContact CD2-CD2 4.27Å
210	S	95.5	Very high	96.7	Very high	32 Å²	32	23.4 Å²	23.4	22%	0.224	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-24	-168.7	68.9	0	0	0	0	114.5	A188 S189 G212	A188-S210 PolarHBondContact O-N 3.16Å; S189-S210 WeakPolarHBondContact CA-OG 3.16Å; S210-G212 VanDerWaalsContact C-N 3.25Å; S210-G212 PolarHBondContact O-N 3.35Å
211	D	93.5	Very high	96.7	Very high	53 Å²	53	22.8 Å²	22.8	28%	0.283	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-4.4	175.8	66.4	-11.4	0	0	0	113.2	L209 S213 L239	L209-D211 PolarHBondContact O-N 3.42Å; L209-D211 VanDerWaalsContact O-N 3.09Å; D211-S213 VanDerWaalsContact C-N 3.34Å; D211-S213 VanDerWaalsContact OD1-CB 3.23Å; D211-S213 WeakPolarHBondContact OD1-CB 3.4Å; D211-S213 PolarHBondContact OD1-N 3.45Å; D211-S213 PolarHBondContact OD1-OG 2.98Å; D211-S213 PolarHBondContact OD2-OG 2.86Å; D211-L239 WeakPolarHBondContact O-CD2 3.22Å
212	G	95.1	Very high	96.7	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.01	13%	0.133	C	C	.	.	S	Bend	trans	82.4	10.4	-174	0	0	0	0	0	113.8	W208 L209 S210 R240	W208-G212 WeakPolarHBondContact CZ3-O 3.36Å; L209-G212 PolarHBondContact O-N 3.16Å; S210-G212 VanDerWaalsContact C-N 3.25Å; S210-G212 PolarHBondContact O-N 3.35Å; G212-R240 PolarHBondContact O-N 2.94Å
213	S	97.2	Very high	96.6	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.021	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	160.7	167.3	72.3	0	0	0	0	111.3	L209 D211 Q215 G238	L209-S213 PolarHBondContact N-O 2.9Å; D211-S213 VanDerWaalsContact C-N 3.34Å; D211-S213 VanDerWaalsContact OD1-CB 3.23Å; D211-S213 WeakPolarHBondContact OD1-CB 3.4Å; D211-S213 PolarHBondContact OD1-N 3.45Å; D211-S213 PolarHBondContact OD1-OG 2.98Å; D211-S213 PolarHBondContact OD2-OG 2.86Å; S213-Q215 PolarHBondContact OG-NE2 3.36Å; S213-G238 VanDerWaalsContact CA-O 3.28Å; S213-G238 WeakPolarHBondContact CA-O 3.33Å
214	V	98.4	Very high	96.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	122.2	176.6	172.4	0	0	0	0	109.1	A206 G207 W208 Y237 G238 R240 Y247	A206-V214 HydrophobicContact CB-CG1 3.72Å; G207-V214 WeakPolarHBondContact O-CA 3.5Å; W208-V214 HydrophobicContact CD2-CG2 3.69Å; W208-V214 HydrophobicContact CE3-CG2 3.32Å; W208-V214 HydrophobicContact CG-CG2 4.39Å; W208-V214 HydrophobicContact CH2-CG2 4.15Å; W208-V214 HydrophobicContact CZ2-CG2 4.44Å; W208-V214 HydrophobicContact CZ3-CG2 3.59Å; V214-Y237 HydrophobicContact CG1-CD2 4.13Å; V214-Y237 WeakPolarHBondContact O-CB 3.11Å; V214-Y237 PolarHBondContact O-N 2.86Å; V214-G238 PolarHBondContact N-O 2.83Å; V214-R240 HydrophobicContact CB-CG 3.85Å; V214-R240 HydrophobicContact CG2-CB 4.12Å; V214-R240 HydrophobicContact CG2-CG 3.57Å; V214-Y247 HydrophobicContact CB-CD2 4.29Å; V214-Y247 HydrophobicContact CB-CE2 4.29Å; V214-Y247 HydrophobicContact CG1-CD1 3.74Å; V214-Y247 HydrophobicContact CG1-CD2 3.94Å; V214-Y247 HydrophobicContact CG1-CE1 3.94Å; V214-Y247 HydrophobicContact CG1-CE2 4.1Å; V214-Y247 HydrophobicContact CG1-CG 3.74Å; V214-Y247 HydrophobicContact CG2-CD2 3.49Å; V214-Y247 VanDerWaalsContact CG2-CD2 3.49Å; V214-Y247 HydrophobicContact CG2-CE2 3.7Å; V214-Y247 HydrophobicContact CG2-CG 4.06Å
215	Q	98.2	Very high	96.3	Very high	7 Å²	7	28 Å²	28	3%	0.033	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	169.7	-171.4	-50.9	-164.9	38.6	0	0	111.1	F190 L193 G207 L209 S213 I234 R235 N236 F250	F190-Q215 VanDerWaalsContact CE2-OE1 3.28Å; L193-Q215 HydrophobicContact CD2-CB 4.19Å; G207-Q215 PolarHBondContact N-O 3.38Å; G207-Q215 PolarHBondContact O-N 3.47Å; L209-Q215 HydrophobicContact CD1-CB 3.98Å; L209-Q215 HydrophobicContact CD1-CG 3.81Å; S213-Q215 PolarHBondContact OG-NE2 3.36Å; Q215-I234 HydrophobicContact CB-CG2 3.71Å; Q215-I234 HydrophobicContact CG-CG2 4.47Å; Q215-R235 CarbonylContact C-O 3.39Å; Q215-R235 WeakPolarHBondContact CA-O 3.34Å; Q215-R235 WeakPolarHBondContact CB-O 3.43Å; Q215-N236 HydrophobicContact CG-CB 4.33Å; Q215-F250 VanDerWaalsContact O-CE2 3.28Å; Q215-F250 WeakPolarHBondContact O-CE2 3.16Å
216	Y	98.1	Very high	95.8	Very high	17 Å²	17	29.6 Å²	29.6	7%	0.067	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	139.7	169.1	65.9	-85.3	0	0	0	113.2	W203 N205 A206 I218 C225 R235 Y237	W203-Y216 WeakPolarHBondContact O-CB 3.47Å; W203-Y216 WeakPolarHBondContact O-CD2 3.49Å; N205-Y216 WeakPolarHBondContact O-CB 3.2Å; A206-Y216 HydrophobicContact CB-CD1 4.16Å; Y216-I218 HydrophobicContact CD2-CD1 3.85Å; Y216-I218 HydrophobicContact CD2-CG1 3.73Å; Y216-I218 HydrophobicContact CE2-CD1 3.86Å; Y216-I218 HydrophobicContact CE2-CG1 3.59Å; Y216-C225 PolarHBondContact OH-O 3.37Å; Y216-R235 HydrophobicContact CD1-CB 3.75Å; Y216-R235 HydrophobicContact CD2-CB 4.16Å; Y216-R235 HydrophobicContact CD2-CG 4.18Å; Y216-R235 HydrophobicContact CE1-CB 3.35Å; Y216-R235 HydrophobicContact CE1-CG 4.02Å; Y216-R235 HydrophobicContact CE2-CB 3.8Å; Y216-R235 HydrophobicContact CE2-CG 3.57Å; Y216-R235 HydrophobicContact CG-CB 4.13Å; Y216-R235 VanDerWaalsContact CZ-CG 3.47Å; Y216-R235 PolarHBondContact N-O 2.62Å; Y216-R235 PolarHBondContact O-N 3.33Å; Y216-Y237 AromaticContact CE1-CE1 3.79Å; Y216-Y237 HydrophobicContact CE1-CE1 3.79Å; Y216-Y237 AromaticContact CE1-CZ 4Å
217	P	97.9	Very high	95.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	132.9	-174.6	35.1	-35	0	0	0	112.5	L193 W197 M201 W203 I234 F250	L193-P217 HydrophobicContact CD1-CG 3.94Å; W197-P217 HydrophobicContact CB-CB 3.74Å; W197-P217 HydrophobicContact CG-CB 4.03Å; M201-P217 HydrophobicContact CG-CG 3.96Å; M201-P217 HydrophobicContact SD-CG 4.26Å; W203-P217 HydrophobicContact CB-CG 4.23Å; W203-P217 PolarHBondContact N-O 3.15Å; P217-I234 HydrophobicContact CB-CG1 4.21Å; P217-F250 HydrophobicContact CG-CZ 4.48Å
218	I	97.8	Very high	95	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	121.1	174.9	-61.8	-63.5	0	0	0	109.9	W197 C204 Y216 T220 C225 P232 G233 R235	W197-I218 PolarHBondContact NE1-O 3.21Å; C204-I218 HydrophobicContact CB-CD1 4Å; Y216-I218 HydrophobicContact CD2-CD1 3.85Å; Y216-I218 HydrophobicContact CD2-CG1 3.73Å; Y216-I218 HydrophobicContact CE2-CD1 3.86Å; Y216-I218 HydrophobicContact CE2-CG1 3.59Å; I218-T220 WeakPolarHBondContact CG2-O 3.47Å; I218-C225 HydrophobicContact CD1-CB 3.67Å; I218-C225 HydrophobicContact CG1-CB 4.25Å; I218-P232 CarbonylContact O-C 3.58Å; I218-P232 WeakPolarHBondContact O-CA 3.19Å; I218-G233 PolarHBondContact N-O 3.12Å; I218-G233 PolarHBondContact O-N 2.86Å; I218-R235 HydrophobicContact CG1-CG 4.35Å
219	T	96.1	Very high	94.6	Very high	44 Å²	44	46.5 Å²	46.5	27%	0.27	26%	0.255	S	S	.	.	S	Bend	trans	-95.1	-31.5	171.4	64.4	0	0	0	0	111.2	D202 P232	D202-T219 HydrophobicContact CB-CG2 4.33Å; D202-T219 WeakPolarHBondContact CB-OG1 3.37Å; D202-T219 PolarHBondContact OD2-N 3.5Å; D202-T219 PolarHBondContact OD2-OG1 3.45Å; T219-P232 WeakPolarHBondContact O-CG 3.41Å
220	T	94.8	Very high	94.3	Very high	90 Å²	90	48.8 Å²	48.8	55%	0.552	27%	0.269	S	S	*	.	S	Bend	trans	-118.3	100.6	179.2	-55.1	0	0	0	0	110.6	D202 I218 R222	D202-T220 PolarHBondContact OD2-N 3.06Å; I218-T220 WeakPolarHBondContact CG2-O 3.47Å; T220-R222 PolarHBondContact O-NH1 2.84Å
221	P	94.8	Very high	94.2	Very high	36 Å²	36	52.7 Å²	52.7	23%	0.234	29%	0.291	C	S	.	.			trans	-54.5	135.8	178.3	-27	35.1	0	0	0	112.8	T230 P232	P221-T230 VanDerWaalsContact CB-O 3.24Å; P221-T230 WeakPolarHBondContact CB-O 3.47Å; P221-T230 WeakPolarHBondContact CG-O 3.45Å; P221-P232 HydrophobicContact CG-CG 4.14Å
222	R	95.7	Very high	94.3	Very high	75 Å²	75	53.4 Å²	53.4	28%	0.283	30%	0.299	S	S	.	.			trans	-159.9	152.1	-178.5	58.7	-166.7	-179.3	-90	6.5	110.9	D202 T220 P224 C225 G227	D202-R222 VanDerWaalsContact CG-NH1 3.27Å; D202-R222 IonicContact OD1-CZ 2.66Å; D202-R222 IonicContact OD1-NH1 3.02Å; D202-R222 PolarHBondContact OD1-NH1 3.4Å; D202-R222 IonicContact OD1-NH2 2.76Å; D202-R222 PolarHBondContact OD1-NH2 2.89Å; D202-R222 IonicContact OD2-NH1 2.74Å; D202-R222 PolarHBondContact OD2-NH1 3.34Å; T220-R222 PolarHBondContact O-NH1 2.84Å; R222-P224 HydrophobicContact CG-CG 4.35Å; R222-C225 HydrophobicContact CG-CB 3.68Å; R222-C225 VanDerWaalsContact CG-SG 3.51Å; R222-C225 VanDerWaalsContact CZ-SG 3.53Å; R222-C225 PolarHBondContact NE-SG 2.79Å; R222-C225 CarbonylContact O-C 3.55Å; R222-C225 WeakPolarHBondContact O-CA 3.46Å; R222-C225 PolarHBondContact O-N 3.33Å; R222-G227 PolarHBondContact O-N 2.87Å
223	E	93.3	Very high	94.4	Very high	105 Å²	105	53.9 Å²	53.9	49%	0.491	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-45.9	-55.7	-175	-78.3	-46.4	129.1	0	0	114.7	C225 G227 R228	E223-C225 PolarHBondContact O-N 3.5Å; E223-G227 PolarHBondContact O-N 2.9Å; E223-R228 HydrophobicContact CG-CG 3.81Å; E223-R228 VanDerWaalsContact OE1-CB 3.27Å; E223-R228 WeakPolarHBondContact OE1-CB 3.33Å; E223-R228 WeakPolarHBondContact OE1-CD 3.4Å; E223-R228 WeakPolarHBondContact OE1-CG 3.43Å; E223-R228 PolarHBondContact OE1-N 3.23Å
224	P	93.3	Very high	94.4	Very high	110 Å²	110	55.2 Å²	55.2	71%	0.714	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-67.4	-6.3	-176.3	27.3	-35	0	0	0	113.9	C204 R222	C204-P224 PolarHBondContact SG-O 2.82Å; R222-P224 HydrophobicContact CG-CG 4.35Å
225	C	93.6	Very high	94.3	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.014	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-122	33.8	-169.4	-51.9	0	0	0	0	112.6	C204 Y216 I218 R222 E223	C204-C225 HydrophobicContact CB-CB 3.88Å; C204-C225 WeakPolarHBondContact CB-SG 3.44Å; C204-C225 WeakPolarHBondContact SG-CA 3.43Å; C204-C225 WeakPolarHBondContact SG-CB 3.28Å; C204-C225 CovalentContact SG-SG 2Å; C204-C225 PolarHBondContact SG-SG 2.99Å; Y216-C225 PolarHBondContact OH-O 3.37Å; I218-C225 HydrophobicContact CD1-CB 3.67Å; I218-C225 HydrophobicContact CG1-CB 4.25Å; R222-C225 HydrophobicContact CG-CB 3.68Å; R222-C225 VanDerWaalsContact CG-SG 3.51Å; R222-C225 VanDerWaalsContact CZ-SG 3.53Å; R222-C225 PolarHBondContact NE-SG 2.79Å; R222-C225 CarbonylContact O-C 3.55Å; R222-C225 WeakPolarHBondContact O-CA 3.46Å; R222-C225 PolarHBondContact O-N 3.33Å; E223-C225 PolarHBondContact O-N 3.5Å
226	G	85.9	Confident	94.1	Very high	43 Å²	43	61.4 Å²	61.4	44%	0.443	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.6	8.7	179.7	0	0	0	0	0	114.7	T230	G226-T230 WeakPolarHBondContact O-CG2 3.3Å
227	G	90.1	Very high	94	Very high	15 Å²	15	66.2 Å²	66.2	16%	0.155	36%	0.359	C	S	.	.			trans	100.8	146.2	175	0	0	0	0	0	114.3	R222 E223 N229 T230	R222-G227 PolarHBondContact O-N 2.87Å; E223-G227 PolarHBondContact O-N 2.9Å; G227-N229 VanDerWaalsContact C-N 3.32Å; G227-N229 PolarHBondContact O-N 3.16Å; G227-T230 PolarHBondContact O-OG1 2.84Å
228	R	89.5	Confident	93.9	Very high	175 Å²	175	67.5 Å²	67.5	66%	0.66	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-30.4	179.3	-75.1	171.6	179	-175.2	3.9	113.8	E223 T230	E223-R228 HydrophobicContact CG-CG 3.81Å; E223-R228 VanDerWaalsContact OE1-CB 3.27Å; E223-R228 WeakPolarHBondContact OE1-CB 3.33Å; E223-R228 WeakPolarHBondContact OE1-CD 3.4Å; E223-R228 WeakPolarHBondContact OE1-CG 3.43Å; E223-R228 PolarHBondContact OE1-N 3.23Å; R228-T230 PolarHBondContact O-N 3.06Å
229	N	90.1	Very high	93.8	Very high	168 Å²	168	73.8 Å²	73.8	90%	0.898	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	25.5	-175.1	-60.6	-27.3	0	0	0	113	G227	G227-N229 VanDerWaalsContact C-N 3.32Å; G227-N229 PolarHBondContact O-N 3.16Å
230	T	91	Very high	93.9	Very high	49 Å²	49	76.9 Å²	76.9	30%	0.301	41%	0.412	S	S	.	.	S	Bend	trans	-104.9	155.6	179	59.3	0	0	0	0	111.4	P221 G226 G227 R228 R235	P221-T230 VanDerWaalsContact CB-O 3.24Å; P221-T230 WeakPolarHBondContact CB-O 3.47Å; P221-T230 WeakPolarHBondContact CG-O 3.45Å; G226-T230 WeakPolarHBondContact O-CG2 3.3Å; G227-T230 PolarHBondContact O-OG1 2.84Å; R228-T230 PolarHBondContact O-N 3.06Å; T230-R235 VanDerWaalsContact CB-NH2 3.27Å; T230-R235 PolarHBondContact OG1-NH2 3.09Å
231	V	93.6	Very high	94	Very high	113 Å²	113	75.9 Å²	75.9	69%	0.685	40%	0.404	S	S	*	.			trans	-81.1	146	175.3	-62.5	0	0	0	0	110.9	G233 R235	V231-G233 PolarHBondContact O-N 3.07Å; V231-R235 VanDerWaalsContact O-CZ 3.26Å; V231-R235 PolarHBondContact O-NH1 2.68Å; V231-R235 PolarHBondContact O-NH2 2.56Å
232	P	96	Very high	94.2	Very high	68 Å²	68	77.6 Å²	77.6	44%	0.442	41%	0.407	S	S	.	.	S	Bend	trans	-49.7	141.6	169.7	-25.9	34.4	0	0	0	111.7	W197 I218 T219 P221	W197-P232 HydrophobicContact CZ2-CB 4.28Å; I218-P232 CarbonylContact O-C 3.58Å; I218-P232 WeakPolarHBondContact O-CA 3.19Å; T219-P232 WeakPolarHBondContact O-CG 3.41Å; P221-P232 HydrophobicContact CG-CG 4.14Å
233	G	96.4	Very high	94.2	Very high	11 Å²	11	78.9 Å²	78.9	11%	0.113	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.3	177.8	-178.8	0	0	0	0	0	113.4	I218 V231	I218-G233 PolarHBondContact N-O 3.12Å; I218-G233 PolarHBondContact O-N 2.86Å; V231-G233 PolarHBondContact O-N 3.07Å
234	I	97.3	Very high	94.5	Very high	32 Å²	32	81.6 Å²	81.6	16%	0.164	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	123	171.7	-63.3	179.4	0	0	0	108.9	F190 L193 Y194 W197 Q215 P217	F190-I234 HydrophobicContact CE2-CD1 3.99Å; F190-I234 HydrophobicContact CE2-CG2 4.32Å; F190-I234 HydrophobicContact CZ-CD1 4.46Å; L193-I234 HydrophobicContact CD2-CD1 4.11Å; L193-I234 HydrophobicContact CD2-CG2 4.15Å; L193-I234 HydrophobicContact CG-CD1 4Å; Y194-I234 HydrophobicContact CD2-CD1 4.12Å; W197-I234 HydrophobicContact CB-CD1 4.29Å; W197-I234 HydrophobicContact CB-CG1 4.22Å; W197-I234 HydrophobicContact CD2-CG1 4.48Å; W197-I234 HydrophobicContact CG-CG1 4.18Å; Q215-I234 HydrophobicContact CB-CG2 3.71Å; Q215-I234 HydrophobicContact CG-CG2 4.47Å; P217-I234 HydrophobicContact CB-CG1 4.21Å
235	R	96.3	Very high	94.7	Very high	42 Å²	42	77.1 Å²	77.1	16%	0.158	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	129.4	174.3	-58	-60.2	-177.8	-116.4	-3.8	108.3	Q215 Y216 I218 T230 V231	Q215-R235 CarbonylContact C-O 3.39Å; Q215-R235 WeakPolarHBondContact CA-O 3.34Å; Q215-R235 WeakPolarHBondContact CB-O 3.43Å; Y216-R235 HydrophobicContact CD1-CB 3.75Å; Y216-R235 HydrophobicContact CD2-CB 4.16Å; Y216-R235 HydrophobicContact CD2-CG 4.18Å; Y216-R235 HydrophobicContact CE1-CB 3.35Å; Y216-R235 HydrophobicContact CE1-CG 4.02Å; Y216-R235 HydrophobicContact CE2-CB 3.8Å; Y216-R235 HydrophobicContact CE2-CG 3.57Å; Y216-R235 HydrophobicContact CG-CB 4.13Å; Y216-R235 VanDerWaalsContact CZ-CG 3.47Å; Y216-R235 PolarHBondContact N-O 2.62Å; Y216-R235 PolarHBondContact O-N 3.33Å; I218-R235 HydrophobicContact CG1-CG 4.35Å; T230-R235 VanDerWaalsContact CB-NH2 3.27Å; T230-R235 PolarHBondContact OG1-NH2 3.09Å; V231-R235 VanDerWaalsContact O-CZ 3.26Å; V231-R235 PolarHBondContact O-NH1 2.68Å; V231-R235 PolarHBondContact O-NH2 2.56Å
236	N	95.3	Very high	94.9	Very high	94 Å²	94	81.1 Å²	81.1	50%	0.503	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	121	-169.6	-170.8	-10.8	0	0	0	110.4	Q215 G238	Q215-N236 HydrophobicContact CG-CB 4.33Å; N236-G238 VanDerWaalsContact OD1-CA 3.29Å; N236-G238 WeakPolarHBondContact OD1-CA 3.42Å; N236-G238 PolarHBondContact OD1-N 3.27Å
237	Y	95.6	Very high	95.5	Very high	118 Å²	118	80.7 Å²	80.7	46%	0.463	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-0.8	174	-70.2	5.6	0	0	0	112.6	A206 V214 Y216 Y247	A206-Y237 HydrophobicContact CB-CD2 4.14Å; A206-Y237 HydrophobicContact CB-CE2 3.81Å; V214-Y237 HydrophobicContact CG1-CD2 4.13Å; V214-Y237 WeakPolarHBondContact O-CB 3.11Å; V214-Y237 PolarHBondContact O-N 2.86Å; Y216-Y237 AromaticContact CE1-CE1 3.79Å; Y216-Y237 HydrophobicContact CE1-CE1 3.79Å; Y216-Y237 AromaticContact CE1-CZ 4Å; Y237-Y247 HydrophobicContact CD2-CE1 4.16Å; Y237-Y247 HydrophobicContact CE2-CE1 4.4Å
238	G	96	Very high	95.9	Very high	27 Å²	27	80.1 Å²	80.1	28%	0.278	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	77.9	-169.7	-179.5	0	0	0	0	0	113.2	S213 V214 N236	S213-G238 VanDerWaalsContact CA-O 3.28Å; S213-G238 WeakPolarHBondContact CA-O 3.33Å; V214-G238 PolarHBondContact N-O 2.83Å; N236-G238 VanDerWaalsContact OD1-CA 3.29Å; N236-G238 WeakPolarHBondContact OD1-CA 3.42Å; N236-G238 PolarHBondContact OD1-N 3.27Å
239	L	96.4	Very high	96.3	Very high	132 Å²	132	71.8 Å²	71.8	69%	0.691	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.2	134.3	169.5	-66.3	174.5	0	0	0	109.7	D211	D211-L239 WeakPolarHBondContact O-CD2 3.22Å
240	R	97.4	Very high	96.8	Very high	109 Å²	109	63.9 Å²	63.9	41%	0.411	32%	0.324	S	S	.	.			trans	-119.8	157.4	179.1	-56.9	-58.2	-61.7	171.7	2	110.2	W208 G212 V214 K242 Y247	W208-R240 HydrophobicContact CH2-CB 3.58Å; W208-R240 HydrophobicContact CZ3-CB 3.71Å; G212-R240 PolarHBondContact O-N 2.94Å; V214-R240 HydrophobicContact CB-CG 3.85Å; V214-R240 HydrophobicContact CG2-CB 4.12Å; V214-R240 HydrophobicContact CG2-CG 3.57Å; R240-K242 PolarHBondContact O-N 2.04Å; R240-K242 VanDerWaalsContact O-N 3.15Å; R240-Y247 HydrophobicContact CB-CE2 4.23Å; R240-Y247 HydrophobicContact CG-CE2 3.91Å; R240-Y247 PolarHBondContact NE-OH 2.88Å
241	D	97.5	Very high	97.1	Very high	70 Å²	70	61.5 Å²	61.5	37%	0.374	31%	0.31	S	S	.	.			trans	-63.7	115	173.9	-176.3	-52.2	0	0	0	108.7	D243 K244 S245	D241-D243 PolarHBondContact O-N 3.03Å; D241-D243 PolarHBondContact OD1-N 3.34Å; D241-K244 HydrophobicContact CB-CB 4.33Å; D241-K244 PolarHBondContact OD1-N 3.47Å; D241-K244 IonicContact OD2-NZ 3.05Å; D241-S245 PolarHBondContact N-OG 3.11Å; D241-S245 WeakPolarHBondContact O-CB 2.96Å; D241-S245 PolarHBondContact O-N 2.88Å; D241-S245 PolarHBondContact O-OG 3.35Å
242	K	97.3	Very high	97.4	Very high	71 Å²	71	56.5 Å²	56.5	31%	0.309	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-24	-171.6	-73.3	-172.5	174.3	-166.1	0	113.4	N172 F173 Y174 R240	N172-K242 WeakPolarHBondContact CB-O 3.5Å; F173-K242 HydrophobicContact CB-CB 3.72Å; F173-K242 HydrophobicContact CB-CD 4.33Å; F173-K242 HydrophobicContact CB-CG 3.8Å; F173-K242 WeakPolarHBondContact CB-O 3.39Å; F173-K242 HydrophobicContact CD1-CB 4.44Å; F173-K242 HydrophobicContact CD1-CD 3.67Å; F173-K242 HydrophobicContact CD1-CG 4.12Å; F173-K242 HydrophobicContact CE1-CD 4.12Å; F173-K242 HydrophobicContact CG-CB 4.26Å; F173-K242 HydrophobicContact CG-CD 3.93Å; F173-K242 HydrophobicContact CG-CG 3.89Å; F173-K242 PolarHBondContact N-O 2.83Å; Y174-K242 HydrophobicContact CE2-CB 4.23Å; R240-K242 PolarHBondContact O-N 2.04Å; R240-K242 VanDerWaalsContact O-N 3.15Å
243	D	97.6	Very high	97.4	Very high	103 Å²	103	53.3 Å²	53.3	55%	0.551	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-41.3	-178.1	-64.9	-72.8	0	0	0	111.8	Y174 D241	Y174-D243 VanDerWaalsContact CE2-OD1 3.31Å; Y174-D243 WeakPolarHBondContact CE2-OD1 3.47Å; D241-D243 PolarHBondContact O-N 3.03Å; D241-D243 PolarHBondContact OD1-N 3.34Å
244	K	97.6	Very high	97.4	Very high	161 Å²	161	52.8 Å²	52.8	70%	0.7	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-30.4	-170.7	-62.5	177.1	-172.2	161.2	0	114.3	D241 H246	D241-K244 HydrophobicContact CB-CB 4.33Å; D241-K244 PolarHBondContact OD1-N 3.47Å; D241-K244 IonicContact OD2-NZ 3.05Å; K244-H246 PolarHBondContact O-CE1 2.92Å; K244-H246 VanDerWaalsContact O-CE1 3.32Å; K244-H246 PolarHBondContact O-ND1 3.49Å
245	S	98.1	Very high	97.1	Very high	16 Å²	16	53.5 Å²	53.5	11%	0.112	26%	0.255	C	S	.	.			trans	-81.8	146.4	-175.5	-44.8	0	0	0	0	110.3	N172 W208 D241	N172-S245 WeakPolarHBondContact CA-O 3.02Å; W208-S245 WeakPolarHBondContact CZ2-O 3.2Å; D241-S245 PolarHBondContact N-OG 3.11Å; D241-S245 WeakPolarHBondContact O-CB 2.96Å; D241-S245 PolarHBondContact O-N 2.88Å; D241-S245 PolarHBondContact O-OG 3.35Å
246	H	98.3	Very high	96.6	Very high	86 Å²	86	53 Å²	53	40%	0.398	25%	0.254	S	S	.	.			trans	-130	128.6	-178.9	-64.5	73.1	0	0	0	110.5	Y169 L171 K244	Y169-H246 VanDerWaalsContact O-CB 3.28Å; Y169-H246 WeakPolarHBondContact O-CB 3.3Å; L171-H246 CarbonylContact O-C 3.43Å; L171-H246 VanDerWaalsContact O-CA 3.29Å; L171-H246 WeakPolarHBondContact O-CA 3.18Å; K244-H246 PolarHBondContact O-CE1 2.92Å; K244-H246 VanDerWaalsContact O-CE1 3.32Å; K244-H246 PolarHBondContact O-ND1 3.49Å
247	Y	98.4	Very high	96	Very high	34 Å²	34	54.8 Å²	54.8	13%	0.133	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-145.4	-177	-177	-63.7	-76.2	0	0	0	110.9	Y169 L171 A206 W208 V214 Y237 R240	Y169-Y247 HydrophobicContact CD1-CD1 4.48Å; L171-Y247 WeakPolarHBondContact CB-O 3.28Å; L171-Y247 PolarHBondContact N-O 2.63Å; L171-Y247 VanDerWaalsContact N-O 3.16Å; L171-Y247 PolarHBondContact O-N 3.13Å; A206-Y247 HydrophobicContact CB-CD1 3.93Å; A206-Y247 HydrophobicContact CB-CE1 4.35Å; W208-Y247 HydrophobicContact CD2-CD2 4.4Å; W208-Y247 AromaticContact CE2-CD2 3.77Å; W208-Y247 HydrophobicContact CH2-CD2 4.35Å; W208-Y247 AromaticContact CZ2-CD2 3.75Å; W208-Y247 HydrophobicContact CZ2-CD2 3.75Å; W208-Y247 HydrophobicContact CZ2-CE2 4.29Å; V214-Y247 HydrophobicContact CB-CD2 4.29Å; V214-Y247 HydrophobicContact CB-CE2 4.29Å; V214-Y247 HydrophobicContact CG1-CD1 3.74Å; V214-Y247 HydrophobicContact CG1-CD2 3.94Å; V214-Y247 HydrophobicContact CG1-CE1 3.94Å; V214-Y247 HydrophobicContact CG1-CE2 4.1Å; V214-Y247 HydrophobicContact CG1-CG 3.74Å; V214-Y247 HydrophobicContact CG2-CD2 3.49Å; V214-Y247 VanDerWaalsContact CG2-CD2 3.49Å; V214-Y247 HydrophobicContact CG2-CE2 3.7Å; V214-Y247 HydrophobicContact CG2-CG 4.06Å; Y237-Y247 HydrophobicContact CD2-CE1 4.16Å; Y237-Y247 HydrophobicContact CE2-CE1 4.4Å; R240-Y247 HydrophobicContact CB-CE2 4.23Å; R240-Y247 HydrophobicContact CG-CE2 3.91Å; R240-Y247 PolarHBondContact NE-OH 2.88Å
248	D	98.4	Very high	95.8	Very high	3 Å²	3	50 Å²	50	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-169.4	163.6	-68.5	-6.6	0	0	0	108.2	F163 R168 Y169 N205 A206 G207 W208	F163-D248 HydrophobicContact CB-CB 4.46Å; F163-D248 WeakPolarHBondContact CB-OD1 3.21Å; R168-D248 WeakPolarHBondContact CA-OD1 3.08Å; R168-D248 WeakPolarHBondContact CB-OD1 3.44Å; Y169-D248 PolarHBondContact N-OD1 2.85Å; N205-D248 WeakPolarHBondContact CB-OD2 3.29Å; N205-D248 PolarHBondContact ND2-OD2 2.91Å; A206-D248 PolarHBondContact O-N 2.87Å; G207-D248 CarbonylContact C-O 3.07Å; G207-D248 VanDerWaalsContact CA-O 3.24Å; G207-D248 WeakPolarHBondContact CA-O 3.38Å; W208-D248 VanDerWaalsContact CD1-O 3.24Å; W208-D248 PolarHBondContact N-O 3.26Å
249	V	98.8	Very high	95.8	Very high	1 Å²	1	55 Å²	55	1%	0.006	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	145.7	174.1	61.4	0	0	0	0	111.2	Y162 L171 A176 C180 V187 W208	Y162-V249 HydrophobicContact CD1-CG1 4.1Å; Y162-V249 PolarHBondContact N-O 3.23Å; Y162-V249 PolarHBondContact O-N 3.04Å; L171-V249 HydrophobicContact CD1-CB 4.4Å; L171-V249 HydrophobicContact CD1-CG1 3.82Å; A176-V249 HydrophobicContact CB-CB 3.75Å; A176-V249 HydrophobicContact CB-CG1 4.3Å; A176-V249 HydrophobicContact CB-CG2 3.81Å; C180-V249 VanDerWaalsContact SG-CG2 3.53Å; V187-V249 HydrophobicContact CG1-CG2 3.98Å; V187-V249 HydrophobicContact CG2-CG2 4.16Å; W208-V249 HydrophobicContact CB-CB 4.44Å; W208-V249 HydrophobicContact CB-CG2 4.18Å
250	F	98.8	Very high	95.8	Very high	1 Å²	1	49.7 Å²	49.7	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	118.3	163.3	-67.6	-74.7	0	0	0	108.7	V159 P161 A188 L193 M201 W203 W208 L209 Q215 P217	V159-F250 HydrophobicContact CG1-CB 3.96Å; V159-F250 HydrophobicContact CG1-CD1 4.13Å; V159-F250 HydrophobicContact CG1-CG 4.41Å; P161-F250 HydrophobicContact CB-CD1 4.15Å; P161-F250 HydrophobicContact CB-CE1 3.9Å; A188-F250 HydrophobicContact CB-CB 4.09Å; A188-F250 WeakPolarHBondContact CB-O 3.32Å; A188-F250 PolarHBondContact N-O 2.93Å; L193-F250 HydrophobicContact CD1-CB 4.46Å; L193-F250 HydrophobicContact CD1-CD1 3.9Å; L193-F250 HydrophobicContact CD1-CD2 4.12Å; L193-F250 HydrophobicContact CD1-CE1 4.17Å; L193-F250 HydrophobicContact CD1-CE2 4.37Å; L193-F250 HydrophobicContact CD1-CG 3.87Å; L193-F250 HydrophobicContact CD1-CZ 4.39Å; L193-F250 HydrophobicContact CD2-CD2 4.34Å; L193-F250 HydrophobicContact CD2-CE2 4.48Å; M201-F250 HydrophobicContact CE-CD1 3.71Å; M201-F250 HydrophobicContact CE-CE1 3.44Å; M201-F250 VanDerWaalsContact CE-CE1 3.44Å; W203-F250 HydrophobicContact CB-CE1 4.17Å; W203-F250 HydrophobicContact CB-CZ 4.29Å; W203-F250 AromaticContact CD1-CE1 3.88Å; W203-F250 AromaticContact CD1-CZ 3.79Å; W203-F250 HydrophobicContact CG-CE1 4.15Å; W203-F250 HydrophobicContact CG-CZ 4.32Å; W208-F250 PolarHBondContact O-N 3.32Å; L209-F250 HydrophobicContact CD2-CB 4.11Å; L209-F250 HydrophobicContact CD2-CD2 4.27Å; Q215-F250 VanDerWaalsContact O-CE2 3.28Å; Q215-F250 WeakPolarHBondContact O-CE2 3.16Å; P217-F250 HydrophobicContact CG-CZ 4.48Å
251	C	98.7	Very high	95.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	145.8	176.5	-58.6	0	0	0	0	109.9	V159 F160 C180 A185 V186	V159-C251 CarbonylContact C-O 3.45Å; V159-C251 VanDerWaalsContact CA-O 3.29Å; V159-C251 WeakPolarHBondContact CA-O 3.39Å; F160-C251 HydrophobicContact CD1-CB 4.23Å; F160-C251 WeakPolarHBondContact CD1-O 3.39Å; F160-C251 HydrophobicContact CD2-CB 4.22Å; F160-C251 HydrophobicContact CE1-CB 3.68Å; F160-C251 HydrophobicContact CE2-CB 3.68Å; F160-C251 HydrophobicContact CG-CB 4.48Å; F160-C251 HydrophobicContact CZ-CB 3.39Å; F160-C251 PolarHBondContact N-O 2.92Å; F160-C251 PolarHBondContact O-N 3.13Å; C180-C251 WeakPolarHBondContact CA-SG 3.45Å; C180-C251 HydrophobicContact CB-CB 3.83Å; C180-C251 WeakPolarHBondContact CB-SG 3.34Å; C180-C251 VanDerWaalsContact SG-CA 3.51Å; C180-C251 WeakPolarHBondContact SG-CB 3.37Å; C180-C251 CovalentContact SG-SG 2.04Å; C180-C251 PolarHBondContact SG-SG 3.38Å; A185-C251 HydrophobicContact CB-CB 3.79Å; V186-C251 CarbonylContact O-C 3.53Å; V186-C251 VanDerWaalsContact O-CA 3.29Å; V186-C251 WeakPolarHBondContact O-CA 3.26Å
252	F	98.3	Very high	95.9	Very high	8 Å²	8	43.8 Å²	43.8	4%	0.035	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	133.6	172.6	173.8	-92.4	0	0	0	110.3	L130 L155 V158 V159 A185 V186 A188 Q192	L130-F252 HydrophobicContact CD2-CD1 4.37Å; L130-F252 HydrophobicContact CD2-CE1 4.12Å; L155-F252 HydrophobicContact CB-CE1 3.94Å; L155-F252 HydrophobicContact CB-CZ 3.84Å; L155-F252 HydrophobicContact CD1-CE1 4.3Å; L155-F252 WeakPolarHBondContact O-CZ 3.34Å; V158-F252 WeakPolarHBondContact O-CA 3.47Å; V159-F252 HydrophobicContact CG2-CD2 4.05Å; A185-F252 CarbonylContact C-O 3.53Å; A185-F252 VanDerWaalsContact CA-O 3.27Å; A185-F252 WeakPolarHBondContact CA-O 3.21Å; A185-F252 VanDerWaalsContact CB-O 3.26Å; A185-F252 WeakPolarHBondContact CB-O 3.4Å; V186-F252 HydrophobicContact CG2-CB 4.4Å; V186-F252 HydrophobicContact CG2-CD1 4.21Å; V186-F252 PolarHBondContact N-O 3.02Å; V186-F252 PolarHBondContact O-N 3.41Å; A188-F252 HydrophobicContact CB-CB 3.99Å; Q192-F252 HydrophobicContact CB-CD2 4.3Å; Q192-F252 VanDerWaalsContact CD-CD2 3.49Å; Q192-F252 VanDerWaalsContact CD-CG 3.47Å; Q192-F252 HydrophobicContact CG-CD2 3.98Å; Q192-F252 HydrophobicContact CG-CE2 4.24Å; Q192-F252 HydrophobicContact CG-CG 4.43Å; Q192-F252 VanDerWaalsContact NE2-CD1 3.33Å; Q192-F252 VanDerWaalsContact NE2-CG 3.34Å
253	T	97.5	Very high	95.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	162.9	172.7	-168.8	0	0	0	0	110.4	G157 V158 F160 D184 H256 G289 A293	G157-T253 CarbonylContact C-O 3.57Å; G157-T253 WeakPolarHBondContact CA-O 3.4Å; V158-T253 HydrophobicContact CG1-CG2 3.64Å; V158-T253 PolarHBondContact N-O 3.46Å; V158-T253 PolarHBondContact O-N 3.45Å; V158-T253 VanDerWaalsContact O-N 3.07Å; F160-T253 HydrophobicContact CD1-CG2 4.17Å; F160-T253 HydrophobicContact CE1-CG2 3.77Å; D184-T253 WeakPolarHBondContact O-CB 3.2Å; D184-T253 PolarHBondContact O-OG1 3.37Å; T253-H256 PolarHBondContact OG1-CE1 2.95Å; T253-H256 PolarHBondContact OG1-NE2 3.26Å; T253-G289 WeakPolarHBondContact CG2-O 3.28Å; T253-A293 HydrophobicContact CG2-CB 4.17Å
254	S	95.4	Very high	95.9	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	-166.5	-174.4	-174.4	0	0	0	0	110.6	R54 E156 H256 A293	R54-S254 PolarHBondContact N-OG 3.49Å; E156-S254 WeakPolarHBondContact O-CB 3.43Å; E156-S254 PolarHBondContact O-OG 2.99Å; S254-H256 PolarHBondContact O-CE1 3.24Å; S254-H256 PolarHBondContact O-ND1 3.12Å; S254-A293 WeakPolarHBondContact O-CB 3.31Å
255	F	91	Very high	95.7	Very high	48 Å²	48	39 Å²	39	21%	0.211	18%	0.183	C	C	.	.			trans	-58.4	148.2	170.5	-74.2	-89.3	0	0	0	111.3	R53 R54 E156 L297	R53-F255 HydrophobicContact CB-CB 4.33Å; R53-F255 HydrophobicContact CB-CD2 3.73Å; R53-F255 HydrophobicContact CB-CE2 4.48Å; R53-F255 HydrophobicContact CB-CG 4.34Å; R54-F255 WeakPolarHBondContact CB-O 3.4Å; E156-F255 HydrophobicContact CB-CD2 4.23Å; E156-F255 HydrophobicContact CB-CE2 3.8Å; E156-F255 VanDerWaalsContact OE2-CE2 3.3Å; E156-F255 WeakPolarHBondContact OE2-CE2 3.23Å; F255-L297 HydrophobicContact CD1-CB 4.16Å; F255-L297 HydrophobicContact CD1-CD1 4.09Å; F255-L297 HydrophobicContact CD2-CD1 3.78Å; F255-L297 HydrophobicContact CE1-CB 3.61Å; F255-L297 HydrophobicContact CE1-CD1 4.19Å; F255-L297 HydrophobicContact CE1-CG 4.43Å; F255-L297 HydrophobicContact CE2-CB 4.34Å; F255-L297 HydrophobicContact CE2-CD1 3.88Å; F255-L297 HydrophobicContact CE2-CD2 4.25Å; F255-L297 HydrophobicContact CE2-CG 4.39Å; F255-L297 HydrophobicContact CG-CD1 3.9Å; F255-L297 HydrophobicContact CZ-CB 3.72Å; F255-L297 HydrophobicContact CZ-CD1 4.1Å; F255-L297 HydrophobicContact CZ-CD2 4.27Å; F255-L297 HydrophobicContact CZ-CG 4.24Å
256	H	85.5	Confident	95.4	Very high	30 Å²	30	44.2 Å²	44.2	14%	0.139	22%	0.22	C	C	.	.			trans	-119.5	142.7	175.3	-57.8	87	0	0	0	108.8	R54 D184 T253 S254 G258 A293 Y349	R54-H256 PolarHBondContact NH1-NE2 3.41Å; D184-H256 IonicContact OD2-CD2 2.63Å; D184-H256 PolarHBondContact OD2-CD2 3.18Å; D184-H256 IonicContact OD2-NE2 2.95Å; D184-H256 PolarHBondContact OD2-NE2 3.16Å; T253-H256 PolarHBondContact OG1-CE1 2.95Å; T253-H256 PolarHBondContact OG1-NE2 3.26Å; S254-H256 PolarHBondContact O-CE1 3.24Å; S254-H256 PolarHBondContact O-ND1 3.12Å; H256-G258 PolarHBondContact O-N 2.87Å; H256-A293 VanDerWaalsContact CE1-CB 3.45Å; H256-A293 WeakPolarHBondContact CE1-CB 3.29Å; H256-A293 VanDerWaalsContact ND1-CB 3.34Å; H256-A293 WeakPolarHBondContact ND1-CB 3.28Å; H256-Y349 HydrophobicContact CB-CE2 4.02Å; H256-Y349 WeakPolarHBondContact CB-OH 3.05Å
257	K	83.9	Confident	95.3	Very high	133 Å²	133	43.4 Å²	43.4	58%	0.578	22%	0.224	S	C	*	.	S	Bend	trans	-74.5	-11.7	-178.5	-72	179.3	177.5	166.6	0	113.2	G55 D127 N352	G55-K257 PolarHBondContact O-NZ 3.03Å; D127-K257 IonicContact OD1-NZ 3.31Å; D127-K257 PolarHBondContact OD1-NZ 3.04Å; K257-N352 WeakPolarHBondContact O-CB 3.44Å; K257-N352 PolarHBondContact O-ND2 3.27Å
258	G	91.1	Very high	95.2	Very high	16 Å²	16	45.8 Å²	45.8	17%	0.165	24%	0.235	C	C	.	.	S	Bend	trans	-99.9	-179.2	-177.9	0	0	0	0	0	115.4	H256 Y349 K350	H256-G258 PolarHBondContact O-N 2.87Å; G258-Y349 VanDerWaalsContact CA-OH 3.25Å; G258-Y349 WeakPolarHBondContact CA-OH 3.46Å; G258-Y349 PolarHBondContact N-OH 2.89Å; G258-K350 CarbonylContact C-O 3.55Å; G258-K350 WeakPolarHBondContact CA-O 3.2Å
259	K	95.1	Very high	95.1	Very high	132 Å²	132	46.2 Å²	46.2	57%	0.574	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	116.9	-178	-172.7	-178.9	179.8	179.7	0	111.1	Y261 Y349 K350	K259-Y261 HydrophobicContact CD-CD1 4.32Å; K259-Y261 HydrophobicContact CG-CD1 4.02Å; K259-Y261 WeakPolarHBondContact O-CD1 3.38Å; K259-Y349 WeakPolarHBondContact O-CA 2.98Å; K259-K350 PolarHBondContact N-O 3.24Å; K259-K350 PolarHBondContact O-N 2.81Å
260	F	97.5	Very high	95.1	Very high	21 Å²	21	47 Å²	47	9%	0.092	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	131.1	168	177.9	-89.2	0	0	0	110.5	A286 Q290 M291 A294 Y300 Y347 Y349	F260-A286 HydrophobicContact CD2-CB 3.71Å; F260-A286 HydrophobicContact CE2-CB 3.49Å; F260-A286 VanDerWaalsContact CE2-CB 3.49Å; F260-Q290 HydrophobicContact CD2-CB 4.15Å; F260-M291 HydrophobicContact CE1-CG 4.46Å; F260-M291 HydrophobicContact CE2-CB 3.7Å; F260-M291 HydrophobicContact CE2-CG 4.35Å; F260-M291 HydrophobicContact CZ-CB 3.64Å; F260-M291 HydrophobicContact CZ-CE 3.78Å; F260-M291 HydrophobicContact CZ-CG 3.76Å; F260-A294 HydrophobicContact CB-CB 3.84Å; F260-A294 HydrophobicContact CD1-CB 3.43Å; F260-A294 VanDerWaalsContact CD1-CB 3.43Å; F260-A294 HydrophobicContact CE1-CB 4.1Å; F260-A294 HydrophobicContact CG-CB 3.68Å; F260-Y300 HydrophobicContact CD1-CD1 4.17Å; F260-Y300 HydrophobicContact CD1-CD2 4.22Å; F260-Y300 HydrophobicContact CD1-CE1 4.2Å; F260-Y300 HydrophobicContact CD1-CE2 4.25Å; F260-Y300 HydrophobicContact CD1-CG 4.18Å; F260-Y300 AromaticContact CE1-CD1 3.8Å; F260-Y300 HydrophobicContact CE1-CD1 3.8Å; F260-Y300 AromaticContact CE1-CE1 3.7Å; F260-Y300 HydrophobicContact CE1-CE1 3.7Å; F260-Y300 HydrophobicContact CE1-CG 4.28Å; F260-Y347 AromaticContact CE1-CD1 3.59Å; F260-Y347 HydrophobicContact CE1-CD1 3.59Å; F260-Y347 HydrophobicContact CE1-CE1 4.06Å; F260-Y347 HydrophobicContact CE1-CG 4.44Å; F260-Y347 HydrophobicContact CE2-CD1 4.27Å; F260-Y347 HydrophobicContact CE2-CG 4.38Å; F260-Y347 AromaticContact CZ-CD1 3.35Å; F260-Y347 HydrophobicContact CZ-CD1 3.35Å; F260-Y347 HydrophobicContact CZ-CE1 4.07Å; F260-Y347 AromaticContact CZ-CG 3.76Å; F260-Y347 HydrophobicContact CZ-CG 3.76Å; F260-Y349 HydrophobicContact CB-CD2 4.29Å
261	Y	98.2	Very high	95.1	Very high	34 Å²	34	48.5 Å²	48.5	13%	0.133	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	160.3	-179.5	60.9	-75.4	0	0	0	112.5	K259 L263 D281 A283 Y347 C348 K350	K259-Y261 HydrophobicContact CD-CD1 4.32Å; K259-Y261 HydrophobicContact CG-CD1 4.02Å; K259-Y261 WeakPolarHBondContact O-CD1 3.38Å; Y261-L263 HydrophobicContact CE2-CB 4.46Å; Y261-L263 HydrophobicContact CE2-CD1 4.25Å; Y261-D281 WeakPolarHBondContact CE2-OD2 3.5Å; Y261-D281 PolarHBondContact OH-OD2 2.79Å; Y261-A283 WeakPolarHBondContact OH-CB 3.28Å; Y261-Y347 CarbonylContact O-C 3.56Å; Y261-Y347 WeakPolarHBondContact O-CA 3.32Å; Y261-C348 HydrophobicContact CE1-CB 4.04Å; Y261-C348 HydrophobicContact CE2-CB 4.08Å; Y261-C348 PolarHBondContact N-O 2.94Å; Y261-C348 PolarHBondContact O-N 3.12Å; Y261-K350 HydrophobicContact CE1-CB 4.12Å
262	Y	98.4	Very high	95	Very high	21 Å²	21	53 Å²	53	8%	0.082	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	125.5	169.4	-177.6	-84.8	0	0	0	109.4	I264 Y300 D304 G345 Y347	Y262-I264 HydrophobicContact CD1-CG1 4.45Å; Y262-I264 PolarHBondContact O-N 3.21Å; Y262-Y300 PolarHBondContact N-OH 2.96Å; Y262-D304 HydrophobicContact CD2-CB 4.08Å; Y262-D304 HydrophobicContact CE1-CB 4.4Å; Y262-D304 HydrophobicContact CE2-CB 3.51Å; Y262-G345 WeakPolarHBondContact OH-CA 2.91Å; Y262-Y347 HydrophobicContact CD2-CD1 4.16Å; Y262-Y347 HydrophobicContact CD2-CD2 4.26Å; Y262-Y347 AromaticContact CD2-CE1 3.79Å; Y262-Y347 HydrophobicContact CD2-CE1 3.79Å; Y262-Y347 AromaticContact CD2-CE2 3.86Å; Y262-Y347 HydrophobicContact CD2-CE2 3.86Å; Y262-Y347 HydrophobicContact CD2-CG 4.39Å; Y262-Y347 AromaticContact CD2-CZ 3.62Å; Y262-Y347 HydrophobicContact CE2-CE2 4.39Å; Y262-Y347 HydrophobicContact CG-CE1 4.27Å
263	L	98.2	Very high	95	Very high	18 Å²	18	54.8 Å²	54.8	9%	0.094	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	117.8	179	-178.1	63.6	0	0	0	109.9	Y261 Q265 A277 D281 V346	Y261-L263 HydrophobicContact CE2-CB 4.46Å; Y261-L263 HydrophobicContact CE2-CD1 4.25Å; L263-Q265 HydrophobicContact CG-CG 4.41Å; L263-Q265 PolarHBondContact O-N 3.08Å; L263-A277 HydrophobicContact CD2-CB 3.81Å; L263-D281 HydrophobicContact CD1-CB 4.4Å; L263-D281 HydrophobicContact CD2-CB 4.48Å; L263-V346 HydrophobicContact CB-CG1 3.86Å; L263-V346 HydrophobicContact CD2-CG1 4.15Å; L263-V346 PolarHBondContact N-O 2.74Å
264	I	96.6	Very high	95.1	Very high	131 Å²	131	54.8 Å²	54.8	67%	0.672	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-75.1	125.2	179.1	-58.6	176.3	0	0	0	108.6	Y262	Y262-I264 HydrophobicContact CD1-CG1 4.45Å; Y262-I264 PolarHBondContact O-N 3.21Å
265	Q	94.1	Very high	95.2	Very high	85 Å²	85	56.2 Å²	56.2	40%	0.397	29%	0.289	S	S	.	.			trans	-129.1	152.3	178.2	-69	-67.9	-32.1	0	0	109.5	L263 S267 L269	L263-Q265 HydrophobicContact CG-CG 4.41Å; L263-Q265 PolarHBondContact O-N 3.08Å; Q265-S267 VanDerWaalsContact C-N 3.28Å; Q265-S267 WeakPolarHBondContact CB-O 3.2Å; Q265-S267 PolarHBondContact O-N 2.87Å; Q265-L269 HydrophobicContact CB-CD2 4.48Å; Q265-L269 HydrophobicContact CG-CD1 4.03Å; Q265-L269 HydrophobicContact CG-CD2 4.38Å
266	S	92.1	Very high	95.6	Very high	127 Å²	127	61 Å²	61	89%	0.888	31%	0.305	S	S	*	.	S	Bend	trans	-69.6	-26.2	180	55.1	0	0	0	0	113
267	S	94.6	Very high	96.2	Very high	68 Å²	68	60.2 Å²	60.2	48%	0.476	31%	0.305	S	S	.	.	S	Bend	trans	-132.5	161.3	175.3	67.1	0	0	0	0	111.6	Q265	Q265-S267 VanDerWaalsContact C-N 3.28Å; Q265-S267 WeakPolarHBondContact CB-O 3.2Å; Q265-S267 PolarHBondContact O-N 2.87Å
268	K	96.8	Very high	96.9	Very high	85 Å²	85	53.9 Å²	53.9	37%	0.37	28%	0.277	S	S	.	.			trans	-65.9	157.9	167.5	-60.6	-56.7	-173.4	-176.7	0	110.7	K342 L343	K268-K342 WeakPolarHBondContact CB-O 2.94Å; K268-L343 WeakPolarHBondContact CG-O 3.47Å
269	L	96.9	Very high	97.2	Very high	11 Å²	11	59 Å²	59	6%	0.058	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-122.8	147.9	-168.1	-52.8	172.2	0	0	0	111.2	Q265 E273 A274 A277 W307 Y344 V346	Q265-L269 HydrophobicContact CB-CD2 4.48Å; Q265-L269 HydrophobicContact CG-CD1 4.03Å; Q265-L269 HydrophobicContact CG-CD2 4.38Å; L269-E273 HydrophobicContact CB-CB 4.02Å; L269-E273 HydrophobicContact CD2-CB 4.21Å; L269-A274 HydrophobicContact CB-CB 4.16Å; L269-A274 HydrophobicContact CD1-CB 4.03Å; L269-A277 HydrophobicContact CD1-CB 4.18Å; L269-W307 PolarHBondContact O-NE1 2.91Å; L269-Y344 PolarHBondContact N-O 3.44Å; L269-V346 HydrophobicContact CD1-CB 4.23Å; L269-V346 HydrophobicContact CD1-CG1 3.84Å
270	T	98.1	Very high	97.3	Very high	19 Å²	19	62.1 Å²	62.1	12%	0.117	31%	0.31	C	S	.	.			trans	-68.1	167.6	156.8	68.3	0	0	0	0	110.1	D272 E273 A274 K339 K340 K342	T270-D272 VanDerWaalsContact C-N 3.35Å; T270-D272 PolarHBondContact O-N 3.22Å; T270-E273 PolarHBondContact N-OE2 3.01Å; T270-E273 PolarHBondContact O-N 3.07Å; T270-E273 WeakPolarHBondContact OG1-CB 3.18Å; T270-E273 VanDerWaalsContact OG1-CG 3.22Å; T270-E273 WeakPolarHBondContact OG1-CG 3.34Å; T270-E273 PolarHBondContact OG1-N 2.91Å; T270-E273 PolarHBondContact OG1-OE2 3.1Å; T270-A274 WeakPolarHBondContact O-CB 3.34Å; T270-A274 PolarHBondContact O-N 2.91Å; T270-K339 VanDerWaalsContact CB-O 3.26Å; T270-K339 WeakPolarHBondContact CB-O 3.36Å; T270-K340 VanDerWaalsContact CG2-O 3.27Å; T270-K340 WeakPolarHBondContact CG2-O 3.4Å; T270-K342 HydrophobicContact CG2-CD 4.42Å; T270-K342 HydrophobicContact CG2-CG 3.51Å
271	Y	98.2	Very high	97.3	Very high	31 Å²	31	64.4 Å²	64.4	12%	0.122	32%	0.324	C	S	.	.	H	α-helix	trans	-59.6	-45	176	175.7	-96.7	0	0	0	111.9	E273 A274 V275 I285 W307 L308 A309 A311 K339	Y271-E273 VanDerWaalsContact C-N 3.32Å; Y271-E273 PolarHBondContact O-N 3.02Å; Y271-A274 WeakPolarHBondContact O-CB 3.13Å; Y271-A274 PolarHBondContact O-N 3.16Å; Y271-A274 VanDerWaalsContact O-N 3.16Å; Y271-V275 HydrophobicContact CD1-CG2 4.32Å; Y271-V275 HydrophobicContact CE1-CG2 3.88Å; Y271-V275 HydrophobicContact CE2-CG2 4.29Å; Y271-V275 WeakPolarHBondContact O-CG2 3.28Å; Y271-V275 PolarHBondContact O-N 2.86Å; Y271-I285 HydrophobicContact CE2-CD1 4.13Å; Y271-W307 HydrophobicContact CD2-CB 4.47Å; Y271-W307 HydrophobicContact CD2-CD2 4.14Å; Y271-W307 AromaticContact CD2-CE3 3.85Å; Y271-W307 HydrophobicContact CD2-CE3 3.85Å; Y271-W307 HydrophobicContact CD2-CG 4.45Å; Y271-W307 HydrophobicContact CD2-CZ3 4.39Å; Y271-L308 WeakPolarHBondContact CE2-O 3.32Å; Y271-A309 PolarHBondContact OH-O 3.07Å; Y271-A311 HydrophobicContact CD2-CB 3.72Å; Y271-A311 HydrophobicContact CE2-CB 3.51Å; Y271-A311 HydrophobicContact CG-CB 4.38Å; Y271-K339 HydrophobicContact CD1-CD 3.78Å; Y271-K339 HydrophobicContact CD1-CG 4.37Å; Y271-K339 HydrophobicContact CE1-CD 4.42Å; Y271-K339 HydrophobicContact CG-CD 4.03Å; Y271-K339 HydrophobicContact CG-CG 4.13Å; Y271-K339 PolarHBondContact N-O 3.5Å; Y271-K339 VanDerWaalsContact N-O 3.07Å
272	D	98.1	Very high	97.2	Very high	94 Å²	94	65.3 Å²	65.3	50%	0.503	34%	0.343	S	S	.	.	H	α-helix	trans	-70.7	-29.1	-178.5	-60.2	-31.4	0	0	0	112.6	T270 R276	T270-D272 VanDerWaalsContact C-N 3.35Å; T270-D272 PolarHBondContact O-N 3.22Å; D272-R276 WeakPolarHBondContact O-CG 3.37Å; D272-R276 PolarHBondContact O-N 3Å; D272-R276 PolarHBondContact O-NE 2.94Å
273	E	98.2	Very high	97.2	Very high	47 Å²	47	64.7 Å²	64.7	22%	0.22	34%	0.342	C	S	.	.	H	α-helix	trans	-69.3	-40.7	169.7	-73.4	172.5	163.6	0	0	111.4	L269 T270 Y271 R276 A277 K342	L269-E273 HydrophobicContact CB-CB 4.02Å; L269-E273 HydrophobicContact CD2-CB 4.21Å; T270-E273 PolarHBondContact N-OE2 3.01Å; T270-E273 PolarHBondContact O-N 3.07Å; T270-E273 WeakPolarHBondContact OG1-CB 3.18Å; T270-E273 VanDerWaalsContact OG1-CG 3.22Å; T270-E273 WeakPolarHBondContact OG1-CG 3.34Å; T270-E273 PolarHBondContact OG1-N 2.91Å; T270-E273 PolarHBondContact OG1-OE2 3.1Å; Y271-E273 VanDerWaalsContact C-N 3.32Å; Y271-E273 PolarHBondContact O-N 3.02Å; E273-R276 PolarHBondContact O-N 3.47Å; E273-A277 VanDerWaalsContact O-CB 3.28Å; E273-A277 WeakPolarHBondContact O-CB 3.4Å; E273-A277 PolarHBondContact O-N 3.35Å; E273-K342 WeakPolarHBondContact OE1-CE 3.38Å; E273-K342 IonicContact OE1-NZ 2.87Å; E273-K342 PolarHBondContact OE1-NZ 3.22Å; E273-K342 WeakPolarHBondContact OE2-CE 3.34Å; E273-K342 IonicContact OE2-NZ 3.58Å; E273-K342 PolarHBondContact OE2-NZ 3.04Å
274	A	98.4	Very high	97.2	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-60.5	-46.8	176.7	0	0	0	0	0	112.4	L269 T270 Y271 A277 C278 W307 V346	L269-A274 HydrophobicContact CB-CB 4.16Å; L269-A274 HydrophobicContact CD1-CB 4.03Å; T270-A274 WeakPolarHBondContact O-CB 3.34Å; T270-A274 PolarHBondContact O-N 2.91Å; Y271-A274 WeakPolarHBondContact O-CB 3.13Å; Y271-A274 PolarHBondContact O-N 3.16Å; Y271-A274 VanDerWaalsContact O-N 3.16Å; A274-A277 PolarHBondContact O-N 2.65Å; A274-C278 PolarHBondContact O-N 3.08Å; A274-W307 HydrophobicContact CB-CB 4.04Å; A274-W307 HydrophobicContact CB-CG 4.11Å; A274-V346 HydrophobicContact CB-CB 3.66Å; A274-V346 HydrophobicContact CB-CG1 4.4Å; A274-V346 HydrophobicContact CB-CG2 3.65Å
275	V	98.4	Very high	97.3	Very high	30 Å²	30	64.2 Å²	64.2	18%	0.182	34%	0.337	C	S	.	.	H	α-helix	trans	-58.8	-49.8	175.8	174.8	0	0	0	0	110.9	Y271 A277 C278 Q279 I285	Y271-V275 HydrophobicContact CD1-CG2 4.32Å; Y271-V275 HydrophobicContact CE1-CG2 3.88Å; Y271-V275 HydrophobicContact CE2-CG2 4.29Å; Y271-V275 WeakPolarHBondContact O-CG2 3.28Å; Y271-V275 PolarHBondContact O-N 2.86Å; V275-A277 VanDerWaalsContact C-N 3.3Å; V275-A277 PolarHBondContact O-N 2.96Å; V275-C278 PolarHBondContact O-N 3.41Å; V275-Q279 WeakPolarHBondContact O-CG 3.34Å; V275-Q279 PolarHBondContact O-N 3.15Å; V275-Q279 VanDerWaalsContact O-N 3.13Å; V275-I285 HydrophobicContact CG2-CB 4.46Å; V275-I285 HydrophobicContact CG2-CD1 3.94Å; V275-I285 HydrophobicContact CG2-CG2 4.17Å
276	R	98.3	Very high	97.5	Very high	147 Å²	147	60.1 Å²	60.1	56%	0.555	32%	0.318	S	S	*	.	H	α-helix	trans	-64	-34.4	179	-74.4	-178.5	-70.3	153.4	-4.1	112.8	D272 E273 Q279 K280	D272-R276 WeakPolarHBondContact O-CG 3.37Å; D272-R276 PolarHBondContact O-N 3Å; D272-R276 PolarHBondContact O-NE 2.94Å; E273-R276 PolarHBondContact O-N 3.47Å; R276-Q279 PolarHBondContact O-N 3.44Å; R276-K280 WeakPolarHBondContact O-CB 3.48Å; R276-K280 PolarHBondContact O-N 3.28Å
277	A	98.3	Very high	97.8	Very high	15 Å²	15	57 Å²	57	12%	0.124	29%	0.289	C	S	.	.	H	α-helix	trans	-64	-44.6	177.9	0	0	0	0	0	111.6	L263 L269 E273 A274 V275 K280 D281	L263-A277 HydrophobicContact CD2-CB 3.81Å; L269-A277 HydrophobicContact CD1-CB 4.18Å; E273-A277 VanDerWaalsContact O-CB 3.28Å; E273-A277 WeakPolarHBondContact O-CB 3.4Å; E273-A277 PolarHBondContact O-N 3.35Å; A274-A277 PolarHBondContact O-N 2.65Å; V275-A277 VanDerWaalsContact C-N 3.3Å; V275-A277 PolarHBondContact O-N 2.96Å; A277-K280 PolarHBondContact O-N 3.13Å; A277-D281 PolarHBondContact O-N 3.03Å
278	C	98.4	Very high	98	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.6	-44.2	173.6	-64.1	0	0	0	0	111.7	A274 V275 K280 D281 G282 A283 V346 C348	A274-C278 PolarHBondContact O-N 3.08Å; V275-C278 PolarHBondContact O-N 3.41Å; C278-K280 VanDerWaalsContact C-N 3.34Å; C278-K280 PolarHBondContact O-N 2.84Å; C278-D281 CarbonylContact O-C 3.58Å; C278-D281 WeakPolarHBondContact O-CA 3.44Å; C278-D281 WeakPolarHBondContact O-CB 3.38Å; C278-D281 PolarHBondContact O-N 3.28Å; C278-G282 PolarHBondContact O-N 3.16Å; C278-A283 CarbonylContact C-O 3.59Å; C278-A283 CarbonylContact O-C 3.51Å; C278-A283 WeakPolarHBondContact O-CA 3.38Å; C278-A283 PolarHBondContact O-N 2.95Å; C278-V346 WeakPolarHBondContact SG-CG2 3.27Å; C278-C348 WeakPolarHBondContact CA-SG 3.47Å; C278-C348 HydrophobicContact CB-CB 3.81Å; C278-C348 WeakPolarHBondContact CB-SG 3.25Å; C278-C348 VanDerWaalsContact SG-CA 3.59Å; C278-C348 WeakPolarHBondContact SG-CB 3.24Å; C278-C348 CovalentContact SG-SG 2.04Å; C278-C348 PolarHBondContact SG-SG 2.94Å
279	Q	98.1	Very high	98	Very high	123 Å²	123	49.8 Å²	49.8	58%	0.575	25%	0.248	S	C	*	.	H	α-helix	trans	-59.7	-43.2	178.6	-71.9	172.9	-17.9	0	0	112.2	V275 R276 D281 G282 A283	V275-Q279 WeakPolarHBondContact O-CG 3.34Å; V275-Q279 PolarHBondContact O-N 3.15Å; V275-Q279 VanDerWaalsContact O-N 3.13Å; R276-Q279 PolarHBondContact O-N 3.44Å; Q279-D281 PolarHBondContact O-N 3.14Å; Q279-G282 PolarHBondContact O-N 2.8Å; Q279-A283 VanDerWaalsContact CA-O 3.28Å; Q279-A283 WeakPolarHBondContact CA-O 3.26Å; Q279-A283 PolarHBondContact N-O 2.96Å
280	K	97.7	Very high	98.1	Very high	198 Å²	198	49.8 Å²	49.8	86%	0.861	25%	0.248	S	C	*	.	H	α-helix	trans	-62.5	-27.6	176.3	-174	176.7	178.2	-178.9	0	112.6	R276 A277 C278 G282	R276-K280 WeakPolarHBondContact O-CB 3.48Å; R276-K280 PolarHBondContact O-N 3.28Å; A277-K280 PolarHBondContact O-N 3.13Å; C278-K280 VanDerWaalsContact C-N 3.34Å; C278-K280 PolarHBondContact O-N 2.84Å; K280-G282 PolarHBondContact O-N 3.09Å
281	D	97.3	Very high	98.1	Very high	69 Å²	69	48.9 Å²	48.9	37%	0.369	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	3.7	175.5	-162.2	49.6	0	0	0	113.1	Y261 L263 A277 C278 Q279 A283 K350	Y261-D281 WeakPolarHBondContact CE2-OD2 3.5Å; Y261-D281 PolarHBondContact OH-OD2 2.79Å; L263-D281 HydrophobicContact CD1-CB 4.4Å; L263-D281 HydrophobicContact CD2-CB 4.48Å; A277-D281 PolarHBondContact O-N 3.03Å; C278-D281 CarbonylContact O-C 3.58Å; C278-D281 WeakPolarHBondContact O-CA 3.44Å; C278-D281 WeakPolarHBondContact O-CB 3.38Å; C278-D281 PolarHBondContact O-N 3.28Å; Q279-D281 PolarHBondContact O-N 3.14Å; D281-A283 VanDerWaalsContact C-N 3.32Å; D281-K350 PolarHBondContact O-NZ 3.45Å
282	G	97.1	Very high	98.1	Very high	52 Å²	52	48.2 Å²	48.2	54%	0.536	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	68	33.9	-175.4	0	0	0	0	0	112.4	C278 Q279 K280 K350	C278-G282 PolarHBondContact O-N 3.16Å; Q279-G282 PolarHBondContact O-N 2.8Å; K280-G282 PolarHBondContact O-N 3.09Å; G282-K350 WeakPolarHBondContact O-CE 3.27Å
283	A	97.8	Very high	98.1	Very high	8 Å²	8	43.9 Å²	43.9	7%	0.066	22%	0.218	C	C	.	.			trans	-131.6	170.8	179	0	0	0	0	0	110.7	Y261 C278 Q279 D281 C348 Y349 K350	Y261-A283 WeakPolarHBondContact OH-CB 3.28Å; C278-A283 CarbonylContact C-O 3.59Å; C278-A283 CarbonylContact O-C 3.51Å; C278-A283 WeakPolarHBondContact O-CA 3.38Å; C278-A283 PolarHBondContact O-N 2.95Å; Q279-A283 VanDerWaalsContact CA-O 3.28Å; Q279-A283 WeakPolarHBondContact CA-O 3.26Å; Q279-A283 PolarHBondContact N-O 2.96Å; D281-A283 VanDerWaalsContact C-N 3.32Å; A283-C348 HydrophobicContact CB-CB 3.99Å; A283-Y349 WeakPolarHBondContact CB-O 3.46Å; A283-K350 HydrophobicContact CB-CB 4.01Å
284	Q	97.8	Very high	98	Very high	117 Å²	117	41.9 Å²	41.9	55%	0.547	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	157.9	170.8	-62.3	-180	3.4	0	0	109.5	A286 C348 Y349	Q284-A286 PolarHBondContact O-N 3.16Å; Q284-C348 CarbonylContact O-C 3.56Å; Q284-C348 VanDerWaalsContact O-CA 3.24Å; Q284-C348 WeakPolarHBondContact O-CA 3.49Å; Q284-Y349 PolarHBondContact N-O 3.21Å; Q284-Y349 PolarHBondContact O-N 3.26Å
285	I	98.4	Very high	98	Very high	22 Å²	22	43.2 Å²	43.2	11%	0.113	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	132.4	168	-170.5	167.3	0	0	0	108.6	Y271 V275 W307 A309 V346	Y271-I285 HydrophobicContact CE2-CD1 4.13Å; V275-I285 HydrophobicContact CG2-CB 4.46Å; V275-I285 HydrophobicContact CG2-CD1 3.94Å; V275-I285 HydrophobicContact CG2-CG2 4.17Å; I285-W307 HydrophobicContact CD1-CB 4.12Å; I285-A309 HydrophobicContact CG2-CB 3.9Å; I285-V346 HydrophobicContact CD1-CG2 3.88Å; I285-V346 HydrophobicContact CG1-CG2 3.85Å
286	A	98.6	Very high	97.9	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-69.9	146.6	-172.6	0	0	0	0	0	111.8	F260 Q284 L308 A309 Y347	F260-A286 HydrophobicContact CD2-CB 3.71Å; F260-A286 HydrophobicContact CE2-CB 3.49Å; F260-A286 VanDerWaalsContact CE2-CB 3.49Å; Q284-A286 PolarHBondContact O-N 3.16Å; A286-L308 HydrophobicContact CB-CD2 3.91Å; A286-L308 WeakPolarHBondContact O-CA 3.37Å; A286-L308 WeakPolarHBondContact O-CD2 3.11Å; A286-A309 PolarHBondContact O-N 3.19Å; A286-Y347 WeakPolarHBondContact CB-O 3.33Å; A286-Y347 PolarHBondContact N-O 2.9Å
287	K	98.4	Very high	97.7	Very high	62 Å²	62	41.5 Å²	41.5	27%	0.27	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-84.7	162	173.9	-68.1	176.6	170	-158.6	0	111.6	D182 D184 G289 Q290 M291 A309	D182-K287 WeakPolarHBondContact O-CD 3.5Å; D182-K287 WeakPolarHBondContact O-CE 3.47Å; D182-K287 PolarHBondContact O-NZ 2.97Å; D184-K287 HydrophobicContact CB-CD 3.78Å; K287-G289 PolarHBondContact O-N 2.98Å; K287-Q290 HydrophobicContact CB-CG 4.24Å; K287-Q290 PolarHBondContact O-N 3.04Å; K287-M291 PolarHBondContact O-N 2.85Å; K287-A309 HydrophobicContact CG-CB 4.02Å
288	V	98.4	Very high	97.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.6	-43.9	178.9	175.4	0	0	0	0	111.6	F160 Y162 Q183 Q290 M291 F292 L308 D310	F160-V288 HydrophobicContact CD2-CG1 4.12Å; F160-V288 HydrophobicContact CE2-CG1 3.82Å; Y162-V288 HydrophobicContact CD2-CG1 4.41Å; Y162-V288 HydrophobicContact CE2-CG2 4.3Å; Q183-V288 HydrophobicContact CB-CB 4.25Å; Q183-V288 HydrophobicContact CG-CB 4.09Å; Q183-V288 HydrophobicContact CG-CG2 4.43Å; Q183-V288 VanDerWaalsContact OE1-CG2 3.29Å; V288-Q290 VanDerWaalsContact C-N 3.3Å; V288-Q290 PolarHBondContact O-N 3.04Å; V288-M291 WeakPolarHBondContact O-CB 3.49Å; V288-M291 PolarHBondContact O-N 3.21Å; V288-M291 VanDerWaalsContact O-N 3.12Å; V288-F292 HydrophobicContact CG1-CD2 3.72Å; V288-F292 HydrophobicContact CG1-CE2 3.68Å; V288-F292 WeakPolarHBondContact O-CD2 3.39Å; V288-F292 PolarHBondContact O-N 3.19Å; V288-L308 HydrophobicContact CG2-CD1 3.87Å; V288-D310 HydrophobicContact CG2-CB 4.46Å; V288-D310 VanDerWaalsContact CG2-OD2 3.3Å; V288-D310 WeakPolarHBondContact CG2-OD2 3.45Å
289	G	97.9	Very high	97.5	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.8	-41	177.8	0	0	0	0	0	112.3	Q183 T253 K287 M291 F292 A293	Q183-G289 WeakPolarHBondContact O-CA 3.43Å; Q183-G289 PolarHBondContact O-N 3.05Å; T253-G289 WeakPolarHBondContact CG2-O 3.28Å; K287-G289 PolarHBondContact O-N 2.98Å; G289-M291 VanDerWaalsContact C-N 3.32Å; G289-M291 PolarHBondContact O-N 2.87Å; G289-F292 PolarHBondContact O-N 3.43Å; G289-F292 VanDerWaalsContact O-N 3.16Å; G289-A293 WeakPolarHBondContact O-CB 3.34Å; G289-A293 PolarHBondContact O-N 2.77Å
290	Q	98	Very high	97.4	Very high	11 Å²	11	48.4 Å²	48.4	5%	0.051	24%	0.239	C	C	.	.	H	α-helix	trans	-61.1	-38.8	175.9	-65.5	168.1	-12.6	0	0	112.3	D184 F260 K287 V288 A294 Y349	D184-Q290 HydrophobicContact CB-CG 4.45Å; D184-Q290 PolarHBondContact OD2-NE2 2.74Å; F260-Q290 HydrophobicContact CD2-CB 4.15Å; K287-Q290 HydrophobicContact CB-CG 4.24Å; K287-Q290 PolarHBondContact O-N 3.04Å; V288-Q290 VanDerWaalsContact C-N 3.3Å; V288-Q290 PolarHBondContact O-N 3.04Å; Q290-A294 VanDerWaalsContact O-CB 3.3Å; Q290-A294 WeakPolarHBondContact O-CB 3.24Å; Q290-A294 PolarHBondContact O-N 3.13Å; Q290-Y349 HydrophobicContact CB-CD2 4.4Å; Q290-Y349 HydrophobicContact CG-CD2 4.24Å; Q290-Y349 HydrophobicContact CG-CE2 4.43Å; Q290-Y349 HydrophobicContact CG-CG 4.45Å; Q290-Y349 VanDerWaalsContact OE1-CG 3.29Å
291	M	98.4	Very high	97.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-64.5	-45.4	173.8	-179.9	177.4	-80.3	0	0	111.8	F260 K287 V288 G289 A294 W295 L308 R314 P316 V331 Y347	F260-M291 HydrophobicContact CE1-CG 4.46Å; F260-M291 HydrophobicContact CE2-CB 3.7Å; F260-M291 HydrophobicContact CE2-CG 4.35Å; F260-M291 HydrophobicContact CZ-CB 3.64Å; F260-M291 HydrophobicContact CZ-CE 3.78Å; F260-M291 HydrophobicContact CZ-CG 3.76Å; K287-M291 PolarHBondContact O-N 2.85Å; V288-M291 WeakPolarHBondContact O-CB 3.49Å; V288-M291 PolarHBondContact O-N 3.21Å; V288-M291 VanDerWaalsContact O-N 3.12Å; G289-M291 VanDerWaalsContact C-N 3.32Å; G289-M291 PolarHBondContact O-N 2.87Å; M291-A294 PolarHBondContact O-N 3.1Å; M291-W295 VanDerWaalsContact O-CB 3.25Å; M291-W295 WeakPolarHBondContact O-CB 3.38Å; M291-W295 PolarHBondContact O-N 3.07Å; M291-L308 HydrophobicContact CB-CD1 4.48Å; M291-L308 HydrophobicContact CE-CD1 3.9Å; M291-L308 HydrophobicContact CE-CD2 3.9Å; M291-L308 HydrophobicContact CE-CG 4.13Å; M291-L308 HydrophobicContact SD-CD1 3.94Å; M291-R314 HydrophobicContact CE-CB 4.12Å; M291-R314 HydrophobicContact SD-CB 3.6Å; M291-P316 HydrophobicContact CG-CB 4.28Å; M291-P316 HydrophobicContact CG-CG 4.3Å; M291-P316 HydrophobicContact SD-CG 4.5Å; M291-V331 HydrophobicContact CG-CG1 4.21Å; M291-V331 HydrophobicContact CG-CG2 4.38Å; M291-V331 HydrophobicContact SD-CG1 3.54Å; M291-V331 VanDerWaalsContact SD-CG1 3.54Å; M291-Y347 HydrophobicContact CE-CD1 4.01Å; M291-Y347 HydrophobicContact CE-CD2 3.33Å; M291-Y347 HydrophobicContact CE-CE1 4.08Å; M291-Y347 HydrophobicContact CE-CE2 3.44Å; M291-Y347 VanDerWaalsContact CE-CE2 3.44Å; M291-Y347 HydrophobicContact CE-CG 3.63Å
292	F	98.3	Very high	97.5	Very high	18 Å²	18	40.8 Å²	40.8	8%	0.079	20%	0.203	C	C	.	.	H	α-helix	trans	-64.4	-41.7	178.7	-86.7	-81.4	0	0	0	112.2	V158 F160 V288 G289 W295 K296 V331	V158-F292 HydrophobicContact CG1-CB 3.96Å; F160-F292 HydrophobicContact CB-CB 4.24Å; F160-F292 HydrophobicContact CB-CD1 3.47Å; F160-F292 VanDerWaalsContact CB-CD1 3.47Å; F160-F292 HydrophobicContact CB-CD2 3.56Å; F160-F292 HydrophobicContact CB-CE1 3.53Å; F160-F292 HydrophobicContact CB-CE2 3.62Å; F160-F292 HydrophobicContact CB-CG 3.48Å; F160-F292 VanDerWaalsContact CB-CG 3.48Å; F160-F292 HydrophobicContact CB-CZ 3.61Å; F160-F292 HydrophobicContact CD1-CB 4Å; F160-F292 HydrophobicContact CD1-CD2 4.09Å; F160-F292 HydrophobicContact CD1-CG 4.06Å; F160-F292 AromaticContact CD2-CD2 3.67Å; F160-F292 HydrophobicContact CD2-CD2 3.67Å; F160-F292 AromaticContact CD2-CE2 3.73Å; F160-F292 HydrophobicContact CD2-CE2 3.73Å; F160-F292 HydrophobicContact CD2-CG 4.37Å; F160-F292 HydrophobicContact CD2-CZ 4.47Å; F160-F292 HydrophobicContact CE2-CD2 4.36Å; F160-F292 HydrophobicContact CG-CB 4.2Å; F160-F292 HydrophobicContact CG-CD1 4.25Å; F160-F292 AromaticContact CG-CD2 3.5Å; F160-F292 HydrophobicContact CG-CD2 3.5Å; F160-F292 AromaticContact CG-CE2 3.84Å; F160-F292 HydrophobicContact CG-CE2 3.84Å; F160-F292 AromaticContact CG-CG 3.73Å; F160-F292 HydrophobicContact CG-CG 3.73Å; F160-F292 HydrophobicContact CG-CZ 4.34Å; V288-F292 HydrophobicContact CG1-CD2 3.72Å; V288-F292 HydrophobicContact CG1-CE2 3.68Å; V288-F292 WeakPolarHBondContact O-CD2 3.39Å; V288-F292 PolarHBondContact O-N 3.19Å; G289-F292 PolarHBondContact O-N 3.43Å; G289-F292 VanDerWaalsContact O-N 3.16Å; F292-W295 AromaticContact CD1-CE3 3.97Å; F292-W295 HydrophobicContact CD1-CE3 3.97Å; F292-W295 HydrophobicContact CD1-CZ3 4.16Å; F292-W295 PolarHBondContact O-N 3.41Å; F292-K296 WeakPolarHBondContact O-CB 3.35Å; F292-K296 PolarHBondContact O-N 2.81Å; F292-V331 HydrophobicContact CD1-CB 4.21Å; F292-V331 HydrophobicContact CD1-CG2 3.65Å; F292-V331 HydrophobicContact CD2-CG2 4.45Å; F292-V331 HydrophobicContact CE1-CB 3.65Å; F292-V331 HydrophobicContact CE1-CG1 4.47Å; F292-V331 HydrophobicContact CE1-CG2 3.62Å; F292-V331 HydrophobicContact CE2-CB 4.22Å; F292-V331 HydrophobicContact CE2-CG1 4.16Å; F292-V331 HydrophobicContact CE2-CG2 4.42Å; F292-V331 HydrophobicContact CG-CG2 4.09Å; F292-V331 HydrophobicContact CZ-CB 3.66Å; F292-V331 HydrophobicContact CZ-CG1 4.04Å; F292-V331 HydrophobicContact CZ-CG2 4.03Å
293	A	97.2	Very high	97.4	Very high	3 Å²	3	40.6 Å²	40.6	3%	0.025	19%	0.193	C	C	.	.	H	α-helix	trans	-61.5	-48.1	174.3	0	0	0	0	0	111.4	T253 S254 H256 G289 W295 K296 L297	T253-A293 HydrophobicContact CG2-CB 4.17Å; S254-A293 WeakPolarHBondContact O-CB 3.31Å; H256-A293 VanDerWaalsContact CE1-CB 3.45Å; H256-A293 WeakPolarHBondContact CE1-CB 3.29Å; H256-A293 VanDerWaalsContact ND1-CB 3.34Å; H256-A293 WeakPolarHBondContact ND1-CB 3.28Å; G289-A293 WeakPolarHBondContact O-CB 3.34Å; G289-A293 PolarHBondContact O-N 2.77Å; A293-W295 PolarHBondContact O-N 3.38Å; A293-K296 PolarHBondContact O-N 2.79Å; A293-L297 HydrophobicContact CB-CD1 4.21Å; A293-L297 WeakPolarHBondContact O-CA 3.48Å; A293-L297 WeakPolarHBondContact O-CB 3.11Å; A293-L297 WeakPolarHBondContact O-CG 3.22Å; A293-L297 PolarHBondContact O-N 3.35Å
294	A	97.4	Very high	97.4	Very high	4 Å²	4	42.7 Å²	42.7	3%	0.033	20%	0.203	C	C	.	.	H	α-helix	trans	-60.9	-44.7	177.6	0	0	0	0	0	112	F260 Q290 M291 N298 K299 Y300	F260-A294 HydrophobicContact CB-CB 3.84Å; F260-A294 HydrophobicContact CD1-CB 3.43Å; F260-A294 VanDerWaalsContact CD1-CB 3.43Å; F260-A294 HydrophobicContact CE1-CB 4.1Å; F260-A294 HydrophobicContact CG-CB 3.68Å; Q290-A294 VanDerWaalsContact O-CB 3.3Å; Q290-A294 WeakPolarHBondContact O-CB 3.24Å; Q290-A294 PolarHBondContact O-N 3.13Å; M291-A294 PolarHBondContact O-N 3.1Å; A294-N298 CarbonylContact O-C 3.41Å; A294-N298 WeakPolarHBondContact O-CA 3.34Å; A294-N298 WeakPolarHBondContact O-CB 3.29Å; A294-N298 PolarHBondContact O-N 3.05Å; A294-N298 VanDerWaalsContact O-N 3.16Å; A294-K299 PolarHBondContact O-N 2.87Å; A294-Y300 VanDerWaalsContact C-CB 3.48Å; A294-Y300 HydrophobicContact CB-CG 4.36Å; A294-Y300 WeakPolarHBondContact O-CB 3.47Å; A294-Y300 PolarHBondContact O-N 2.84Å
295	W	97.4	Very high	97.4	Very high	28 Å²	28	38 Å²	38	11%	0.106	19%	0.185	C	C	.	.	H	α-helix	trans	-61.9	-51.3	178.2	166.3	69.9	0	0	0	112.5	V158 M291 F292 A293 K299 P316 I317 Y318 A329 V331	V158-W295 HydrophobicContact CG2-CZ3 4.39Å; M291-W295 VanDerWaalsContact O-CB 3.25Å; M291-W295 WeakPolarHBondContact O-CB 3.38Å; M291-W295 PolarHBondContact O-N 3.07Å; F292-W295 AromaticContact CD1-CE3 3.97Å; F292-W295 HydrophobicContact CD1-CE3 3.97Å; F292-W295 HydrophobicContact CD1-CZ3 4.16Å; F292-W295 PolarHBondContact O-N 3.41Å; A293-W295 PolarHBondContact O-N 3.38Å; W295-K299 WeakPolarHBondContact O-CA 3.49Å; W295-K299 PolarHBondContact O-N 3.48Å; W295-P316 HydrophobicContact CB-CB 3.78Å; W295-P316 HydrophobicContact CG-CB 4.03Å; W295-I317 PolarHBondContact NE1-O 2.65Å; W295-Y318 WeakPolarHBondContact O-CD2 3.26Å; W295-A329 HydrophobicContact CZ2-CB 4.21Å; W295-A329 WeakPolarHBondContact CZ2-O 3.38Å; W295-V331 HydrophobicContact CB-CG2 3.93Å; W295-V331 HydrophobicContact CD2-CG2 3.8Å; W295-V331 HydrophobicContact CE3-CG2 3.94Å; W295-V331 HydrophobicContact CG-CG2 3.78Å
296	K	95.9	Very high	97.4	Very high	103 Å²	103	37 Å²	37	45%	0.448	18%	0.179	S	C	.	.	H	α-helix	trans	-80.5	-45.1	-172.9	-170.8	66	174	-174	0	112.7	V158 F292 A293	V158-K296 HydrophobicContact CB-CB 3.98Å; V158-K296 HydrophobicContact CB-CG 4.06Å; V158-K296 HydrophobicContact CG1-CB 4.45Å; V158-K296 HydrophobicContact CG2-CB 3.81Å; V158-K296 HydrophobicContact CG2-CG 3.88Å; F292-K296 WeakPolarHBondContact O-CB 3.35Å; F292-K296 PolarHBondContact O-N 2.81Å; A293-K296 PolarHBondContact O-N 2.79Å
297	L	94.8	Very high	97.4	Very high	39 Å²	39	37 Å²	37	20%	0.204	18%	0.179	C	C	.	.	H	α-helix	trans	-91.7	-36.2	-169.6	-51.5	176.4	0	0	0	112.2	F255 A293	F255-L297 HydrophobicContact CD1-CB 4.16Å; F255-L297 HydrophobicContact CD1-CD1 4.09Å; F255-L297 HydrophobicContact CD2-CD1 3.78Å; F255-L297 HydrophobicContact CE1-CB 3.61Å; F255-L297 HydrophobicContact CE1-CD1 4.19Å; F255-L297 HydrophobicContact CE1-CG 4.43Å; F255-L297 HydrophobicContact CE2-CB 4.34Å; F255-L297 HydrophobicContact CE2-CD1 3.88Å; F255-L297 HydrophobicContact CE2-CD2 4.25Å; F255-L297 HydrophobicContact CE2-CG 4.39Å; F255-L297 HydrophobicContact CG-CD1 3.9Å; F255-L297 HydrophobicContact CZ-CB 3.72Å; F255-L297 HydrophobicContact CZ-CD1 4.1Å; F255-L297 HydrophobicContact CZ-CD2 4.27Å; F255-L297 HydrophobicContact CZ-CG 4.24Å; A293-L297 HydrophobicContact CB-CD1 4.21Å; A293-L297 WeakPolarHBondContact O-CA 3.48Å; A293-L297 WeakPolarHBondContact O-CB 3.11Å; A293-L297 WeakPolarHBondContact O-CG 3.22Å; A293-L297 PolarHBondContact O-N 3.35Å
298	N	95	Very high	97.4	Very high	105 Å²	105	34 Å²	34	56%	0.561	17%	0.167	S	C	*	.	S	Bend	trans	-103.1	7.6	179.4	-60.3	-32.1	0	0	0	113.2	A294 Y300	A294-N298 CarbonylContact O-C 3.41Å; A294-N298 WeakPolarHBondContact O-CA 3.34Å; A294-N298 WeakPolarHBondContact O-CB 3.29Å; A294-N298 PolarHBondContact O-N 3.05Å; A294-N298 VanDerWaalsContact O-N 3.16Å; N298-Y300 PolarHBondContact O-N 2.85Å; N298-Y300 VanDerWaalsContact O-N 3.12Å
299	K	96.8	Very high	97.4	Very high	129 Å²	129	35.3 Å²	35.3	56%	0.561	18%	0.177	S	C	*	.			trans	54.5	31.3	-179.9	-50.6	-176.2	177.7	-178.2	0	112.9	A294 W295 D301 Y318	A294-K299 PolarHBondContact O-N 2.87Å; W295-K299 WeakPolarHBondContact O-CA 3.49Å; W295-K299 PolarHBondContact O-N 3.48Å; K299-D301 PolarHBondContact O-N 2.87Å; K299-Y318 HydrophobicContact CB-CD1 3.87Å; K299-Y318 HydrophobicContact CB-CD2 3.96Å; K299-Y318 HydrophobicContact CB-CE1 3.78Å; K299-Y318 HydrophobicContact CB-CE2 3.87Å; K299-Y318 HydrophobicContact CB-CG 3.96Å; K299-Y318 HydrophobicContact CD-CE1 3.83Å; K299-Y318 HydrophobicContact CD-CE2 4.32Å; K299-Y318 WeakPolarHBondContact CD-OH 3.44Å; K299-Y318 WeakPolarHBondContact CE-OH 3.35Å; K299-Y318 HydrophobicContact CG-CD1 4.47Å; K299-Y318 HydrophobicContact CG-CD2 4.27Å; K299-Y318 HydrophobicContact CG-CE1 3.9Å; K299-Y318 HydrophobicContact CG-CE2 3.67Å; K299-Y318 VanDerWaalsContact CG-CZ 3.47Å
300	Y	97.7	Very high	97.4	Very high	48 Å²	48	36.5 Å²	36.5	19%	0.188	18%	0.183	C	C	.	.			trans	-66	126.9	-176.7	-172.4	-85.3	0	0	0	110.4	F260 Y262 A294 N298 R302 P316 Y347	F260-Y300 HydrophobicContact CD1-CD1 4.17Å; F260-Y300 HydrophobicContact CD1-CD2 4.22Å; F260-Y300 HydrophobicContact CD1-CE1 4.2Å; F260-Y300 HydrophobicContact CD1-CE2 4.25Å; F260-Y300 HydrophobicContact CD1-CG 4.18Å; F260-Y300 AromaticContact CE1-CD1 3.8Å; F260-Y300 HydrophobicContact CE1-CD1 3.8Å; F260-Y300 AromaticContact CE1-CE1 3.7Å; F260-Y300 HydrophobicContact CE1-CE1 3.7Å; F260-Y300 HydrophobicContact CE1-CG 4.28Å; Y262-Y300 PolarHBondContact N-OH 2.96Å; A294-Y300 VanDerWaalsContact C-CB 3.48Å; A294-Y300 HydrophobicContact CB-CG 4.36Å; A294-Y300 WeakPolarHBondContact O-CB 3.47Å; A294-Y300 PolarHBondContact O-N 2.84Å; N298-Y300 PolarHBondContact O-N 2.85Å; N298-Y300 VanDerWaalsContact O-N 3.12Å; Y300-R302 HydrophobicContact CE1-CB 3.67Å; Y300-P316 HydrophobicContact CD1-CB 4.44Å; Y300-P316 HydrophobicContact CD1-CG 3.5Å; Y300-P316 VanDerWaalsContact CD1-CG 3.5Å; Y300-P316 HydrophobicContact CE1-CG 3.79Å; Y300-Y347 AromaticContact CE1-CE1 3.92Å; Y300-Y347 HydrophobicContact CE1-CE1 3.92Å
301	D	97.8	Very high	97.4	Very high	46 Å²	46	36.1 Å²	36.1	25%	0.246	18%	0.182	C	C	.	.			trans	-129.5	122.4	-175.4	-171.9	-70.2	0	0	0	110.7	K299 Y318 H319 R321	K299-D301 PolarHBondContact O-N 2.87Å; D301-Y318 PolarHBondContact OD2-N 2.78Å; D301-H319 PolarHBondContact OD2-N 3.5Å; D301-R321 VanDerWaalsContact CG-NH1 3.26Å; D301-R321 IonicContact OD1-CZ 3.03Å; D301-R321 IonicContact OD1-NH1 2.67Å; D301-R321 PolarHBondContact OD1-NH1 2.64Å; D301-R321 IonicContact OD1-NH2 2.93Å; D301-R321 PolarHBondContact OD1-NH2 2.66Å; D301-R321 IonicContact OD2-NH1 3.89Å; D301-R321 PolarHBondContact OD2-NH1 3.3Å
302	R	97.3	Very high	97.3	Very high	62 Å²	62	36.1 Å²	36.1	23%	0.234	18%	0.182	C	C	.	.			trans	-154.4	126.5	176.3	-171.3	119.3	-172.2	177.2	4.9	111.8	Y300 D304 P316 Y347	Y300-R302 HydrophobicContact CE1-CB 3.67Å; R302-D304 VanDerWaalsContact C-N 3.31Å; R302-D304 HydrophobicContact CG-CB 3.96Å; R302-D304 IonicContact CZ-OD2 2.64Å; R302-D304 VanDerWaalsContact CZ-OD2 3.26Å; R302-D304 IonicContact NE-OD2 3.15Å; R302-D304 PolarHBondContact NE-OD2 3.31Å; R302-D304 IonicContact NH2-OD2 3.62Å; R302-D304 PolarHBondContact NH2-OD2 3.3Å; R302-D304 PolarHBondContact O-N 3.25Å; R302-P316 CarbonylContact C-O 3.43Å; R302-P316 HydrophobicContact CB-CG 4.47Å; R302-P316 PolarHBondContact N-O 3.24Å; R302-Y347 HydrophobicContact CB-CE1 4.44Å; R302-Y347 HydrophobicContact CG-CE1 4.48Å; R302-Y347 WeakPolarHBondContact CG-OH 3.47Å
303	C	96.3	Very high	97.4	Very high	47 Å²	47	35.3 Å²	35.3	32%	0.318	18%	0.179	S	C	.	.			trans	-96.6	41.8	176.2	-173.2	0	0	0	0	112.7	I317 R321 C324	C303-I317 HydrophobicContact CB-CD1 3.81Å; C303-R321 VanDerWaalsContact CB-NH2 3.34Å; C303-C324 HydrophobicContact CB-CB 3.76Å; C303-C324 WeakPolarHBondContact CB-SG 3.32Å; C303-C324 VanDerWaalsContact SG-CA 3.58Å; C303-C324 WeakPolarHBondContact SG-CB 3.36Å; C303-C324 CovalentContact SG-SG 2.01Å; C303-C324 PolarHBondContact SG-SG 3.17Å
304	D	97.3	Very high	97.4	Very high	52 Å²	52	35.8 Å²	35.8	28%	0.278	18%	0.18	S	C	.	.			trans	-122.6	118	174.6	-71.7	-63	0	0	0	109.3	Y262 R302 G306 Y315 Y347	Y262-D304 HydrophobicContact CD2-CB 4.08Å; Y262-D304 HydrophobicContact CE1-CB 4.4Å; Y262-D304 HydrophobicContact CE2-CB 3.51Å; R302-D304 VanDerWaalsContact C-N 3.31Å; R302-D304 HydrophobicContact CG-CB 3.96Å; R302-D304 IonicContact CZ-OD2 2.64Å; R302-D304 VanDerWaalsContact CZ-OD2 3.26Å; R302-D304 IonicContact NE-OD2 3.15Å; R302-D304 PolarHBondContact NE-OD2 3.31Å; R302-D304 IonicContact NH2-OD2 3.62Å; R302-D304 PolarHBondContact NH2-OD2 3.3Å; R302-D304 PolarHBondContact O-N 3.25Å; D304-G306 PolarHBondContact O-N 3.39Å; D304-Y315 VanDerWaalsContact O-CB 3.27Å; D304-Y315 WeakPolarHBondContact O-CB 3.21Å; D304-Y347 PolarHBondContact O-OH 2.93Å
305	A	97.6	Very high	97.4	Very high	20 Å²	20	37.4 Å²	37.4	17%	0.165	19%	0.186	C	C	.	.			trans	-65.5	127.4	173.1	0	0	0	0	0	110.4	V313 Y315 Y344 G345	A305-V313 HydrophobicContact CB-CG1 3.74Å; A305-Y315 HydrophobicContact CB-CD1 4.14Å; A305-Y344 HydrophobicContact CB-CD1 3.74Å; A305-Y344 HydrophobicContact CB-CE1 4.16Å; A305-G345 PolarHBondContact O-N 2.72Å; A305-G345 VanDerWaalsContact O-N 3.1Å
306	G	98.4	Very high	97.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	152.7	-177.8	0	0	0	0	0	113	D304 V313 R314 G345	D304-G306 PolarHBondContact O-N 3.39Å; G306-V313 WeakPolarHBondContact O-CA 3.27Å; G306-R314 PolarHBondContact N-O 2.96Å; G306-R314 VanDerWaalsContact N-O 3.07Å; G306-R314 PolarHBondContact O-N 2.89Å; G306-R314 VanDerWaalsContact O-N 3.08Å; G306-G345 CarbonylContact C-O 3.55Å; G306-G345 VanDerWaalsContact CA-O 3.28Å; G306-G345 WeakPolarHBondContact CA-O 3.14Å
307	W	98.6	Very high	97.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	144	174.4	-66.4	110.7	0	0	0	111.8	L269 Y271 A274 I285 A311 V313 P337 Y344 G345 V346 Y347	L269-W307 PolarHBondContact O-NE1 2.91Å; Y271-W307 HydrophobicContact CD2-CB 4.47Å; Y271-W307 HydrophobicContact CD2-CD2 4.14Å; Y271-W307 AromaticContact CD2-CE3 3.85Å; Y271-W307 HydrophobicContact CD2-CE3 3.85Å; Y271-W307 HydrophobicContact CD2-CG 4.45Å; Y271-W307 HydrophobicContact CD2-CZ3 4.39Å; A274-W307 HydrophobicContact CB-CB 4.04Å; A274-W307 HydrophobicContact CB-CG 4.11Å; I285-W307 HydrophobicContact CD1-CB 4.12Å; W307-A311 WeakPolarHBondContact CZ3-O 3.35Å; W307-V313 HydrophobicContact CD2-CG2 3.82Å; W307-V313 HydrophobicContact CE3-CG2 3.48Å; W307-V313 VanDerWaalsContact CE3-CG2 3.48Å; W307-V313 HydrophobicContact CH2-CG2 4.2Å; W307-V313 HydrophobicContact CZ2-CG2 4.46Å; W307-V313 HydrophobicContact CZ3-CG2 3.7Å; W307-P337 HydrophobicContact CH2-CB 4.34Å; W307-P337 HydrophobicContact CH2-CG 3.61Å; W307-P337 HydrophobicContact CZ2-CG 4.37Å; W307-P337 HydrophobicContact CZ3-CG 3.87Å; W307-Y344 AromaticContact CE2-CD2 3.96Å; W307-Y344 AromaticContact CZ2-CD2 3.88Å; W307-Y344 HydrophobicContact CZ2-CD2 3.88Å; W307-G345 PolarHBondContact N-O 3.18Å; W307-V346 HydrophobicContact CB-CG2 4.43Å; W307-Y347 PolarHBondContact O-N 3.22Å
308	L	98.7	Very high	97.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.162	C	C	.	.			trans	-121.3	168.8	169.1	-70.7	173.6	0	0	0	110.9	Y271 A286 V288 M291 D310 A311 S312 R314	Y271-L308 WeakPolarHBondContact CE2-O 3.32Å; A286-L308 HydrophobicContact CB-CD2 3.91Å; A286-L308 WeakPolarHBondContact O-CA 3.37Å; A286-L308 WeakPolarHBondContact O-CD2 3.11Å; V288-L308 HydrophobicContact CG2-CD1 3.87Å; M291-L308 HydrophobicContact CB-CD1 4.48Å; M291-L308 HydrophobicContact CE-CD1 3.9Å; M291-L308 HydrophobicContact CE-CD2 3.9Å; M291-L308 HydrophobicContact CE-CG 4.13Å; M291-L308 HydrophobicContact SD-CD1 3.94Å; L308-D310 VanDerWaalsContact C-N 3.27Å; L308-D310 PolarHBondContact O-N 2.88Å; L308-A311 WeakPolarHBondContact O-CA 3.5Å; L308-A311 PolarHBondContact O-N 3.3Å; L308-S312 PolarHBondContact N-O 2.65Å; L308-R314 HydrophobicContact CD1-CB 3.86Å; L308-R314 HydrophobicContact CD1-CG 3.81Å
309	A	98.2	Very high	97.8	Very high	27 Å²	27	33.1 Å²	33.1	22%	0.223	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-38.1	-174.9	0	0	0	0	0	113.7	Y271 I285 A286 K287 A311	Y271-A309 PolarHBondContact OH-O 3.07Å; I285-A309 HydrophobicContact CG2-CB 3.9Å; A286-A309 PolarHBondContact O-N 3.19Å; K287-A309 HydrophobicContact CG-CB 4.02Å; A309-A311 PolarHBondContact O-N 2.83Å; A309-A311 VanDerWaalsContact O-N 3.09Å
310	D	97.6	Very high	97.7	Very high	24 Å²	24	30 Å²	30	13%	0.128	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	3.1	176.5	71.7	-19.4	0	0	0	114	V288 L308 S312 R314	V288-D310 HydrophobicContact CG2-CB 4.46Å; V288-D310 VanDerWaalsContact CG2-OD2 3.3Å; V288-D310 WeakPolarHBondContact CG2-OD2 3.45Å; L308-D310 VanDerWaalsContact C-N 3.27Å; L308-D310 PolarHBondContact O-N 2.88Å; D310-S312 PolarHBondContact O-N 2.78Å; D310-S312 WeakPolarHBondContact OD1-CB 3.28Å; D310-S312 PolarHBondContact OD1-N 3.14Å; D310-S312 PolarHBondContact OD1-OG 3.44Å; D310-S312 WeakPolarHBondContact OD2-CB 3.29Å; D310-S312 PolarHBondContact OD2-OG 3.36Å; D310-R314 IonicContact OD2-NH2 3.12Å; D310-R314 PolarHBondContact OD2-NH2 2.91Å; D310-R314 VanDerWaalsContact OD2-NH2 3.16Å
311	A	97.6	Very high	97.6	Very high	4 Å²	4	31.9 Å²	31.9	3%	0.033	16%	0.161	C	C	.	.	S	Bend	trans	60.1	20.7	-171	0	0	0	0	0	114.3	Y271 W307 L308 A309	Y271-A311 HydrophobicContact CD2-CB 3.72Å; Y271-A311 HydrophobicContact CE2-CB 3.51Å; Y271-A311 HydrophobicContact CG-CB 4.38Å; W307-A311 WeakPolarHBondContact CZ3-O 3.35Å; L308-A311 WeakPolarHBondContact O-CA 3.5Å; L308-A311 PolarHBondContact O-N 3.3Å; A309-A311 PolarHBondContact O-N 2.83Å; A309-A311 VanDerWaalsContact O-N 3.09Å
312	S	98.3	Very high	97.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.19	C	C	.	.			trans	-78	159.9	161.7	69.9	0	0	0	0	110.7	L308 D310 R314 G335	L308-S312 PolarHBondContact N-O 2.65Å; D310-S312 PolarHBondContact O-N 2.78Å; D310-S312 WeakPolarHBondContact OD1-CB 3.28Å; D310-S312 PolarHBondContact OD1-N 3.14Å; D310-S312 PolarHBondContact OD1-OG 3.44Å; D310-S312 WeakPolarHBondContact OD2-CB 3.29Å; D310-S312 PolarHBondContact OD2-OG 3.36Å; S312-R314 PolarHBondContact OG-NE 2.01Å; S312-G335 WeakPolarHBondContact CA-O 3.4Å
313	V	98.4	Very high	97	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	124.6	169	175.2	0	0	0	0	108.7	A305 G306 W307 N334 G335 P337 Y344	A305-V313 HydrophobicContact CB-CG1 3.74Å; G306-V313 WeakPolarHBondContact O-CA 3.27Å; W307-V313 HydrophobicContact CD2-CG2 3.82Å; W307-V313 HydrophobicContact CE3-CG2 3.48Å; W307-V313 VanDerWaalsContact CE3-CG2 3.48Å; W307-V313 HydrophobicContact CH2-CG2 4.2Å; W307-V313 HydrophobicContact CZ2-CG2 4.46Å; W307-V313 HydrophobicContact CZ3-CG2 3.7Å; V313-N334 HydrophobicContact CB-CB 4.14Å; V313-N334 HydrophobicContact CG1-CB 3.97Å; V313-N334 WeakPolarHBondContact O-CB 3.28Å; V313-N334 PolarHBondContact O-N 2.82Å; V313-G335 PolarHBondContact N-O 2.88Å; V313-P337 HydrophobicContact CB-CG 4.29Å; V313-P337 HydrophobicContact CG2-CG 3.51Å; V313-Y344 HydrophobicContact CB-CD2 4.46Å; V313-Y344 HydrophobicContact CB-CG 4.43Å; V313-Y344 HydrophobicContact CG1-CD1 3.54Å; V313-Y344 HydrophobicContact CG1-CD2 4.2Å; V313-Y344 HydrophobicContact CG1-CE1 3.81Å; V313-Y344 HydrophobicContact CG1-CE2 4.44Å; V313-Y344 HydrophobicContact CG1-CG 3.73Å; V313-Y344 HydrophobicContact CG2-CD1 4.41Å; V313-Y344 HydrophobicContact CG2-CD2 3.55Å; V313-Y344 HydrophobicContact CG2-CE2 3.87Å; V313-Y344 HydrophobicContact CG2-CG 3.83Å
314	R	98.5	Very high	96.9	Very high	13 Å²	13	47.7 Å²	47.7	5%	0.049	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	165.2	-177.5	-55.3	-170.9	-164.3	-144.1	3.6	111.6	M291 G306 L308 D310 S312 V331 R332 F333 Y347	M291-R314 HydrophobicContact CE-CB 4.12Å; M291-R314 HydrophobicContact SD-CB 3.6Å; G306-R314 PolarHBondContact N-O 2.96Å; G306-R314 VanDerWaalsContact N-O 3.07Å; G306-R314 PolarHBondContact O-N 2.89Å; G306-R314 VanDerWaalsContact O-N 3.08Å; L308-R314 HydrophobicContact CD1-CB 3.86Å; L308-R314 HydrophobicContact CD1-CG 3.81Å; D310-R314 IonicContact OD2-NH2 3.12Å; D310-R314 PolarHBondContact OD2-NH2 2.91Å; D310-R314 VanDerWaalsContact OD2-NH2 3.16Å; S312-R314 PolarHBondContact OG-NE 2.01Å; R314-V331 HydrophobicContact CB-CG1 4.13Å; R314-R332 CarbonylContact C-O 3.38Å; R314-R332 WeakPolarHBondContact CA-O 3.12Å; R314-R332 VanDerWaalsContact CB-O 3.28Å; R314-R332 WeakPolarHBondContact CB-O 3.44Å; R314-F333 HydrophobicContact CG-CD2 4.08Å; R314-Y347 WeakPolarHBondContact O-CE2 3.43Å
315	Y	98.2	Very high	96.7	Very high	39 Å²	39	45.2 Å²	45.2	15%	0.153	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	136.1	166.8	62.1	-85	0	0	0	111.6	D304 A305 I317 C324 R332 N334	D304-Y315 VanDerWaalsContact O-CB 3.27Å; D304-Y315 WeakPolarHBondContact O-CB 3.21Å; A305-Y315 HydrophobicContact CB-CD1 4.14Å; Y315-I317 HydrophobicContact CD2-CD1 3.91Å; Y315-I317 HydrophobicContact CD2-CG1 3.83Å; Y315-I317 HydrophobicContact CE2-CD1 4.14Å; Y315-I317 HydrophobicContact CE2-CG1 3.82Å; Y315-C324 PolarHBondContact OH-O 2.81Å; Y315-R332 HydrophobicContact CD1-CB 3.81Å; Y315-R332 HydrophobicContact CD2-CB 4Å; Y315-R332 HydrophobicContact CD2-CG 4.13Å; Y315-R332 HydrophobicContact CE1-CB 3.41Å; Y315-R332 VanDerWaalsContact CE1-CB 3.41Å; Y315-R332 HydrophobicContact CE1-CG 4.14Å; Y315-R332 HydrophobicContact CE2-CB 3.63Å; Y315-R332 HydrophobicContact CE2-CG 3.47Å; Y315-R332 VanDerWaalsContact CE2-CG 3.47Å; Y315-R332 HydrophobicContact CG-CB 4.08Å; Y315-R332 VanDerWaalsContact CZ-CG 3.48Å; Y315-R332 PolarHBondContact N-O 2.77Å; Y315-R332 PolarHBondContact O-N 3.49Å; Y315-N334 VanDerWaalsContact CE1-OD1 3.31Å; Y315-N334 WeakPolarHBondContact CE1-OD1 3.48Å
316	P	97.9	Very high	96.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	127.7	-177.7	33.5	-31.9	0	0	0	112.3	M291 W295 Y300 R302 V331 Y347	M291-P316 HydrophobicContact CG-CB 4.28Å; M291-P316 HydrophobicContact CG-CG 4.3Å; M291-P316 HydrophobicContact SD-CG 4.5Å; W295-P316 HydrophobicContact CB-CB 3.78Å; W295-P316 HydrophobicContact CG-CB 4.03Å; Y300-P316 HydrophobicContact CD1-CB 4.44Å; Y300-P316 HydrophobicContact CD1-CG 3.5Å; Y300-P316 VanDerWaalsContact CD1-CG 3.5Å; Y300-P316 HydrophobicContact CE1-CG 3.79Å; R302-P316 CarbonylContact C-O 3.43Å; R302-P316 HydrophobicContact CB-CG 4.47Å; R302-P316 PolarHBondContact N-O 3.24Å; P316-V331 HydrophobicContact CB-CG2 4.25Å; P316-Y347 WeakPolarHBondContact CD-OH 3.45Å
317	I	98.1	Very high	96.2	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	114.8	171.8	-57.5	-62	0	0	0	109	W295 C303 Y315 H319 C324 A329 A330	W295-I317 PolarHBondContact NE1-O 2.65Å; C303-I317 HydrophobicContact CB-CD1 3.81Å; Y315-I317 HydrophobicContact CD2-CD1 3.91Å; Y315-I317 HydrophobicContact CD2-CG1 3.83Å; Y315-I317 HydrophobicContact CE2-CD1 4.14Å; Y315-I317 HydrophobicContact CE2-CG1 3.82Å; I317-H319 VanDerWaalsContact CG2-O 3.26Å; I317-H319 WeakPolarHBondContact CG2-O 3.16Å; I317-C324 HydrophobicContact CD1-CB 3.61Å; I317-C324 HydrophobicContact CG1-CB 4.06Å; I317-A329 CarbonylContact O-C 3.51Å; I317-A329 WeakPolarHBondContact O-CA 3.39Å; I317-A330 PolarHBondContact N-O 2Å; I317-A330 PolarHBondContact O-N 2.93Å
318	Y	97.1	Very high	95.9	Very high	66 Å²	66	58.6 Å²	58.6	26%	0.259	27%	0.274	S	S	.	.	S	Bend	trans	-93	-37.6	174.3	-177.7	-94.8	0	0	0	111.2	W295 K299 D301 P320 A329	W295-Y318 WeakPolarHBondContact O-CD2 3.26Å; K299-Y318 HydrophobicContact CB-CD1 3.87Å; K299-Y318 HydrophobicContact CB-CD2 3.96Å; K299-Y318 HydrophobicContact CB-CE1 3.78Å; K299-Y318 HydrophobicContact CB-CE2 3.87Å; K299-Y318 HydrophobicContact CB-CG 3.96Å; K299-Y318 HydrophobicContact CD-CE1 3.83Å; K299-Y318 HydrophobicContact CD-CE2 4.32Å; K299-Y318 WeakPolarHBondContact CD-OH 3.44Å; K299-Y318 WeakPolarHBondContact CE-OH 3.35Å; K299-Y318 HydrophobicContact CG-CD1 4.47Å; K299-Y318 HydrophobicContact CG-CD2 4.27Å; K299-Y318 HydrophobicContact CG-CE1 3.9Å; K299-Y318 HydrophobicContact CG-CE2 3.67Å; K299-Y318 VanDerWaalsContact CG-CZ 3.47Å; D301-Y318 PolarHBondContact OD2-N 2.78Å; Y318-P320 WeakPolarHBondContact O-CD 3.4Å; Y318-A329 VanDerWaalsContact O-CB 3.28Å; Y318-A329 WeakPolarHBondContact O-CB 3.45Å
319	H	96.7	Very high	95.7	Very high	119 Å²	119	60.7 Å²	60.7	55%	0.551	29%	0.292	S	S	*	.	S	Bend	trans	-105.1	105.6	175.4	-63.5	111.3	0	0	0	110.5	D301 I317 R321	D301-H319 PolarHBondContact OD2-N 3.5Å; I317-H319 VanDerWaalsContact CG2-O 3.26Å; I317-H319 WeakPolarHBondContact CG2-O 3.16Å; H319-R321 PolarHBondContact O-N 3.2Å; H319-R321 PolarHBondContact O-NH1 2.82Å
320	P	96.3	Very high	95.6	Very high	64 Å²	64	60.3 Å²	60.3	42%	0.416	29%	0.288	S	S	.	.			trans	-54.6	137.2	179.7	-25.2	34.4	0	0	0	112.7	Y318 S325	Y318-P320 WeakPolarHBondContact O-CD 3.4Å; P320-S325 CarbonylContact C-O 3.34Å; P320-S325 WeakPolarHBondContact CA-O 2.93Å; P320-S325 WeakPolarHBondContact CB-O 2.9Å
321	R	95.8	Very high	95.6	Very high	86 Å²	86	60.1 Å²	60.1	33%	0.325	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-159.9	148.7	179.1	61	-169.6	177	-89	12.3	112.9	D301 C303 H319 R323 C324 S325	D301-R321 VanDerWaalsContact CG-NH1 3.26Å; D301-R321 IonicContact OD1-CZ 3.03Å; D301-R321 IonicContact OD1-NH1 2.67Å; D301-R321 PolarHBondContact OD1-NH1 2.64Å; D301-R321 IonicContact OD1-NH2 2.93Å; D301-R321 PolarHBondContact OD1-NH2 2.66Å; D301-R321 IonicContact OD2-NH1 3.89Å; D301-R321 PolarHBondContact OD2-NH1 3.3Å; C303-R321 VanDerWaalsContact CB-NH2 3.34Å; H319-R321 PolarHBondContact O-N 3.2Å; H319-R321 PolarHBondContact O-NH1 2.82Å; R321-R323 PolarHBondContact O-N 2.76Å; R321-R323 VanDerWaalsContact O-N 3.11Å; R321-C324 HydrophobicContact CG-CB 3.83Å; R321-C324 PolarHBondContact NE-SG 2.55Å; R321-C324 VanDerWaalsContact NE-SG 3.36Å; R321-C324 PolarHBondContact O-N 2.84Å; R321-S325 PolarHBondContact N-O 2.87Å; R321-S325 CarbonylContact O-C 3.21Å; R321-S325 PolarHBondContact O-N 2.88Å
322	R	90.8	Very high	95.6	Very high	230 Å²	230	62.8 Å²	62.8	87%	0.868	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	-40.5	-167.4	-172.5	177.8	174.8	-174.8	0	116.4
323	R	91.7	Very high	95.5	Very high	242 Å²	242	66.3 Å²	66.3	91%	0.913	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-2	-175.5	-67.5	-173.6	-177.3	177.8	1.4	114.4	R321	R321-R323 PolarHBondContact O-N 2.76Å; R321-R323 VanDerWaalsContact O-N 3.11Å
324	C	93.4	Very high	95.3	Very high	15 Å²	15	69.7 Å²	69.7	10%	0.101	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.9	-59.9	-168.6	-54.1	0	0	0	0	111.1	C303 Y315 I317 R321	C303-C324 HydrophobicContact CB-CB 3.76Å; C303-C324 WeakPolarHBondContact CB-SG 3.32Å; C303-C324 VanDerWaalsContact SG-CA 3.58Å; C303-C324 WeakPolarHBondContact SG-CB 3.36Å; C303-C324 CovalentContact SG-SG 2.01Å; C303-C324 PolarHBondContact SG-SG 3.17Å; Y315-C324 PolarHBondContact OH-O 2.81Å; I317-C324 HydrophobicContact CD1-CB 3.61Å; I317-C324 HydrophobicContact CG1-CB 4.06Å; R321-C324 HydrophobicContact CG-CB 3.83Å; R321-C324 PolarHBondContact NE-SG 2.55Å; R321-C324 VanDerWaalsContact NE-SG 3.36Å; R321-C324 PolarHBondContact O-N 2.84Å
325	S	93.8	Very high	95.2	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-155.6	92.3	179	-172.9	0	0	0	0	107.3	P320 R321 T327 E328 R332	P320-S325 CarbonylContact C-O 3.34Å; P320-S325 WeakPolarHBondContact CA-O 2.93Å; P320-S325 WeakPolarHBondContact CB-O 2.9Å; R321-S325 PolarHBondContact N-O 2.87Å; R321-S325 CarbonylContact O-C 3.21Å; R321-S325 PolarHBondContact O-N 2.88Å; S325-T327 VanDerWaalsContact C-N 3.31Å; S325-T327 PolarHBondContact O-N 2.93Å; S325-E328 WeakPolarHBondContact CB-O 3.26Å; S325-E328 PolarHBondContact OG-O 3.02Å; S325-R332 VanDerWaalsContact OG-CZ 3.3Å; S325-R332 PolarHBondContact OG-NE 2.99Å; S325-R332 PolarHBondContact OG-NH2 2.94Å
326	P	92.2	Very high	95.2	Very high	84 Å²	84	70.2 Å²	70.2	55%	0.545	34%	0.34	S	S	.	.	S	Bend	trans	-62.7	-34.4	-167	-24.6	33.2	0	0	0	114.5
327	T	91.6	Very high	95.1	Very high	122 Å²	122	71.8 Å²	71.8	75%	0.748	35%	0.349	S	S	*	.	S	Bend	trans	-118	-22.8	-165.5	50	0	0	0	0	114.6	S325	S325-T327 VanDerWaalsContact C-N 3.31Å; S325-T327 PolarHBondContact O-N 2.93Å
328	E	92.8	Very high	95	Very high	95 Å²	95	75.8 Å²	75.8	44%	0.444	37%	0.371	S	S	.	.			trans	-138.1	145.6	-168	65.3	-173.1	164.2	0	0	113	S325 A330 R332	S325-E328 WeakPolarHBondContact CB-O 3.26Å; S325-E328 PolarHBondContact OG-O 3.02Å; E328-A330 HydrophobicContact CG-CB 4.24Å; E328-R332 IonicContact OE1-CZ 2.62Å; E328-R332 IonicContact OE1-NH1 2.68Å; E328-R332 PolarHBondContact OE1-NH1 3.49Å; E328-R332 IonicContact OE1-NH2 3.26Å; E328-R332 PolarHBondContact OE1-NH2 2.69Å
329	A	95.4	Very high	95	Very high	45 Å²	45	75.9 Å²	75.9	37%	0.372	37%	0.373	S	S	.	.			trans	-80.7	121.3	166.6	0	0	0	0	0	107.3	W295 I317 Y318	W295-A329 HydrophobicContact CZ2-CB 4.21Å; W295-A329 WeakPolarHBondContact CZ2-O 3.38Å; I317-A329 CarbonylContact O-C 3.51Å; I317-A329 WeakPolarHBondContact O-CA 3.39Å; Y318-A329 VanDerWaalsContact O-CB 3.28Å; Y318-A329 WeakPolarHBondContact O-CB 3.45Å
330	A	95.4	Very high	94.9	Very high	18 Å²	18	78.2 Å²	78.2	15%	0.149	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	154.7	-176.9	0	0	0	0	0	111.8	I317 E328 R332	I317-A330 PolarHBondContact N-O 2Å; I317-A330 PolarHBondContact O-N 2.93Å; E328-A330 HydrophobicContact CG-CB 4.24Å; A330-R332 PolarHBondContact O-N 3.49Å
331	V	97.6	Very high	94.7	Very high	20 Å²	20	80.1 Å²	80.1	12%	0.121	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	111.6	159.1	179.7	0	0	0	0	108.2	M291 F292 W295 R314 P316	M291-V331 HydrophobicContact CG-CG1 4.21Å; M291-V331 HydrophobicContact CG-CG2 4.38Å; M291-V331 HydrophobicContact SD-CG1 3.54Å; M291-V331 VanDerWaalsContact SD-CG1 3.54Å; F292-V331 HydrophobicContact CD1-CB 4.21Å; F292-V331 HydrophobicContact CD1-CG2 3.65Å; F292-V331 HydrophobicContact CD2-CG2 4.45Å; F292-V331 HydrophobicContact CE1-CB 3.65Å; F292-V331 HydrophobicContact CE1-CG1 4.47Å; F292-V331 HydrophobicContact CE1-CG2 3.62Å; F292-V331 HydrophobicContact CE2-CB 4.22Å; F292-V331 HydrophobicContact CE2-CG1 4.16Å; F292-V331 HydrophobicContact CE2-CG2 4.42Å; F292-V331 HydrophobicContact CG-CG2 4.09Å; F292-V331 HydrophobicContact CZ-CB 3.66Å; F292-V331 HydrophobicContact CZ-CG1 4.04Å; F292-V331 HydrophobicContact CZ-CG2 4.03Å; W295-V331 HydrophobicContact CB-CG2 3.93Å; W295-V331 HydrophobicContact CD2-CG2 3.8Å; W295-V331 HydrophobicContact CE3-CG2 3.94Å; W295-V331 HydrophobicContact CG-CG2 3.78Å; R314-V331 HydrophobicContact CB-CG1 4.13Å; P316-V331 HydrophobicContact CB-CG2 4.25Å
332	R	96.8	Very high	94.6	Very high	60 Å²	60	81.4 Å²	81.4	23%	0.226	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	137.1	179.6	-63.7	-60.9	-168	-177.7	0.8	110.4	R314 Y315 S325 E328 A330	R314-R332 CarbonylContact C-O 3.38Å; R314-R332 WeakPolarHBondContact CA-O 3.12Å; R314-R332 VanDerWaalsContact CB-O 3.28Å; R314-R332 WeakPolarHBondContact CB-O 3.44Å; Y315-R332 HydrophobicContact CD1-CB 3.81Å; Y315-R332 HydrophobicContact CD2-CB 4Å; Y315-R332 HydrophobicContact CD2-CG 4.13Å; Y315-R332 HydrophobicContact CE1-CB 3.41Å; Y315-R332 VanDerWaalsContact CE1-CB 3.41Å; Y315-R332 HydrophobicContact CE1-CG 4.14Å; Y315-R332 HydrophobicContact CE2-CB 3.63Å; Y315-R332 HydrophobicContact CE2-CG 3.47Å; Y315-R332 VanDerWaalsContact CE2-CG 3.47Å; Y315-R332 HydrophobicContact CG-CB 4.08Å; Y315-R332 VanDerWaalsContact CZ-CG 3.48Å; Y315-R332 PolarHBondContact N-O 2.77Å; Y315-R332 PolarHBondContact O-N 3.49Å; S325-R332 VanDerWaalsContact OG-CZ 3.3Å; S325-R332 PolarHBondContact OG-NE 2.99Å; S325-R332 PolarHBondContact OG-NH2 2.94Å; E328-R332 IonicContact OE1-CZ 2.62Å; E328-R332 IonicContact OE1-NH1 2.68Å; E328-R332 PolarHBondContact OE1-NH1 3.49Å; E328-R332 IonicContact OE1-NH2 3.26Å; E328-R332 PolarHBondContact OE1-NH2 2.69Å; A330-R332 PolarHBondContact O-N 3.49Å
333	F	96.4	Very high	94.7	Very high	74 Å²	74	74.9 Å²	74.9	33%	0.325	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	120.5	-179.4	173.9	-107.1	0	0	0	110.2	F163 R314 G335 F336	F163-F333 HydrophobicContact CE1-CE1 4.33Å; F163-F333 HydrophobicContact CE2-CE1 4.02Å; F163-F333 AromaticContact CE2-CZ 3.99Å; F163-F333 HydrophobicContact CE2-CZ 3.99Å; F163-F333 HydrophobicContact CZ-CD1 4.08Å; F163-F333 AromaticContact CZ-CE1 3.4Å; F163-F333 HydrophobicContact CZ-CE1 3.4Å; F163-F333 AromaticContact CZ-CZ 3.73Å; F163-F333 HydrophobicContact CZ-CZ 3.73Å; R314-F333 HydrophobicContact CG-CD2 4.08Å; F333-G335 VanDerWaalsContact CE1-CA 3.49Å; F333-F336 HydrophobicContact CE2-CD2 4.29Å; F333-F336 AromaticContact CE2-CE2 3.92Å; F333-F336 HydrophobicContact CE2-CE2 3.92Å; F333-F336 HydrophobicContact CE2-CZ 4.21Å; F333-F336 AromaticContact CZ-CD2 3.73Å; F333-F336 HydrophobicContact CZ-CD2 3.73Å; F333-F336 AromaticContact CZ-CE2 3.52Å; F333-F336 HydrophobicContact CZ-CE2 3.52Å; F333-F336 HydrophobicContact CZ-CZ 4.26Å
334	N	95.6	Very high	94.9	Very high	71 Å²	71	65.6 Å²	65.6	38%	0.38	34%	0.339	S	S	.	.			trans	-100.3	7	-178.3	-72.5	19.9	0	0	0	113	V313 Y315	V313-N334 HydrophobicContact CB-CB 4.14Å; V313-N334 HydrophobicContact CG1-CB 3.97Å; V313-N334 WeakPolarHBondContact O-CB 3.28Å; V313-N334 PolarHBondContact O-N 2.82Å; Y315-N334 VanDerWaalsContact CE1-OD1 3.31Å; Y315-N334 WeakPolarHBondContact CE1-OD1 3.48Å
335	G	96.5	Very high	95.1	Very high	18 Å²	18	65 Å²	65	19%	0.186	34%	0.336	C	S	.	.			trans	97	-167	-179.7	0	0	0	0	0	114.3	S312 V313 F333 P337	S312-G335 WeakPolarHBondContact CA-O 3.4Å; V313-G335 PolarHBondContact N-O 2.88Å; F333-G335 VanDerWaalsContact CE1-CA 3.49Å; G335-P337 VanDerWaalsContact C-CD 3.46Å; G335-P337 VanDerWaalsContact O-CD 3.29Å; G335-P337 WeakPolarHBondContact O-CD 3.31Å
336	F	96.9	Very high	95.4	Very high	46 Å²	46	65 Å²	65	20%	0.202	34%	0.336	C	S	.	.			trans	-114	78.6	174	-64.6	-84.9	0	0	0	109.1	F163 R165 F333	F163-F336 HydrophobicContact CD2-CE2 4.37Å; F163-F336 HydrophobicContact CE2-CE2 4.03Å; R165-F336 HydrophobicContact CB-CB 4.43Å; R165-F336 HydrophobicContact CB-CD1 3.7Å; R165-F336 HydrophobicContact CB-CD2 4.18Å; R165-F336 HydrophobicContact CB-CE1 3.89Å; R165-F336 HydrophobicContact CB-CE2 4.35Å; R165-F336 HydrophobicContact CB-CG 3.86Å; R165-F336 HydrophobicContact CB-CZ 4.22Å; R165-F336 HydrophobicContact CG-CB 3.86Å; R165-F336 HydrophobicContact CG-CD1 4.02Å; R165-F336 HydrophobicContact CG-CD2 4.38Å; R165-F336 HydrophobicContact CG-CG 3.84Å; F333-F336 HydrophobicContact CE2-CD2 4.29Å; F333-F336 AromaticContact CE2-CE2 3.92Å; F333-F336 HydrophobicContact CE2-CE2 3.92Å; F333-F336 HydrophobicContact CE2-CZ 4.21Å; F333-F336 AromaticContact CZ-CD2 3.73Å; F333-F336 HydrophobicContact CZ-CD2 3.73Å; F333-F336 AromaticContact CZ-CE2 3.52Å; F333-F336 HydrophobicContact CZ-CE2 3.52Å; F333-F336 HydrophobicContact CZ-CZ 4.26Å
337	P	96.5	Very high	95.7	Very high	32 Å²	32	61 Å²	61	21%	0.208	31%	0.31	C	S	.	.			trans	-69.7	166.9	-177.2	24.3	-26.8	0	0	0	112.3	W307 V313 G335 K339 Y344	W307-P337 HydrophobicContact CH2-CB 4.34Å; W307-P337 HydrophobicContact CH2-CG 3.61Å; W307-P337 HydrophobicContact CZ2-CG 4.37Å; W307-P337 HydrophobicContact CZ3-CG 3.87Å; V313-P337 HydrophobicContact CB-CG 4.29Å; V313-P337 HydrophobicContact CG2-CG 3.51Å; G335-P337 VanDerWaalsContact C-CD 3.46Å; G335-P337 VanDerWaalsContact O-CD 3.29Å; G335-P337 WeakPolarHBondContact O-CD 3.31Å; P337-K339 PolarHBondContact O-N 2.91Å; P337-Y344 HydrophobicContact CB-CE2 3.92Å; P337-Y344 HydrophobicContact CG-CD2 4.12Å; P337-Y344 HydrophobicContact CG-CE2 3.43Å; P337-Y344 VanDerWaalsContact CG-CE2 3.43Å
338	D	95.9	Very high	96	Very high	85 Å²	85	55.2 Å²	55.2	46%	0.455	27%	0.274	S	S	.	.			trans	-59.4	124	174.7	-169.1	-28.3	0	0	0	110.3	K340 H341	D338-K340 PolarHBondContact O-N 3.11Å; D338-K340 VanDerWaalsContact O-N 3.1Å; D338-K340 WeakPolarHBondContact OD1-CB 3.18Å; D338-K340 WeakPolarHBondContact OD1-CG 3.44Å; D338-K340 PolarHBondContact OD1-N 2.75Å; D338-H341 PolarHBondContact O-N 2.9Å
339	K	96.3	Very high	96.3	Very high	68 Å²	68	51.4 Å²	51.4	30%	0.296	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-22.5	-179.1	-69.7	-171	174.7	-160.4	0	113.3	T270 Y271 P337	T270-K339 VanDerWaalsContact CB-O 3.26Å; T270-K339 WeakPolarHBondContact CB-O 3.36Å; Y271-K339 HydrophobicContact CD1-CD 3.78Å; Y271-K339 HydrophobicContact CD1-CG 4.37Å; Y271-K339 HydrophobicContact CE1-CD 4.42Å; Y271-K339 HydrophobicContact CG-CD 4.03Å; Y271-K339 HydrophobicContact CG-CG 4.13Å; Y271-K339 PolarHBondContact N-O 3.5Å; Y271-K339 VanDerWaalsContact N-O 3.07Å; P337-K339 PolarHBondContact O-N 2.91Å
340	K	95.4	Very high	96.3	Very high	167 Å²	167	53.6 Å²	53.6	73%	0.726	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-16	-176.7	-63.1	177.9	-177.9	177.6	0	113.8	T270 D338	T270-K340 VanDerWaalsContact CG2-O 3.27Å; T270-K340 WeakPolarHBondContact CG2-O 3.4Å; D338-K340 PolarHBondContact O-N 3.11Å; D338-K340 VanDerWaalsContact O-N 3.1Å; D338-K340 WeakPolarHBondContact OD1-CB 3.18Å; D338-K340 WeakPolarHBondContact OD1-CG 3.44Å; D338-K340 PolarHBondContact OD1-N 2.75Å
341	H	92.7	Very high	96.1	Very high	104 Å²	104	58.5 Å²	58.5	48%	0.481	28%	0.277	S	S	.	.			trans	-87.5	133.7	-176.6	-65.2	165	0	0	0	112.4	D338 L343	D338-H341 PolarHBondContact O-N 2.9Å; H341-L343 HydrophobicContact CB-CD1 3.81Å; H341-L343 HydrophobicContact CB-CG 3.93Å; H341-L343 PolarHBondContact O-N 3.3Å; H341-L343 VanDerWaalsContact O-N 3.13Å
342	K	93.2	Very high	95.3	Very high	113 Å²	113	62.9 Å²	62.9	49%	0.491	30%	0.3	S	S	.	.			trans	-86.1	70.1	178.1	-64.7	-171	178.7	-153.3	0	111.7	K268 T270 E273	K268-K342 WeakPolarHBondContact CB-O 2.94Å; T270-K342 HydrophobicContact CG2-CD 4.42Å; T270-K342 HydrophobicContact CG2-CG 3.51Å; E273-K342 WeakPolarHBondContact OE1-CE 3.38Å; E273-K342 IonicContact OE1-NZ 2.87Å; E273-K342 PolarHBondContact OE1-NZ 3.22Å; E273-K342 WeakPolarHBondContact OE2-CE 3.34Å; E273-K342 IonicContact OE2-NZ 3.58Å; E273-K342 PolarHBondContact OE2-NZ 3.04Å
343	L	91.9	Very high	93.3	Very high	93 Å²	93	70.9 Å²	70.9	49%	0.487	35%	0.347	S	S	.	.			trans	-113.1	-22.1	-172.3	-65.4	174.2	0	0	0	114.3	K268 H341	K268-L343 WeakPolarHBondContact CG-O 3.47Å; H341-L343 HydrophobicContact CB-CD1 3.81Å; H341-L343 HydrophobicContact CB-CG 3.93Å; H341-L343 PolarHBondContact O-N 3.3Å; H341-L343 VanDerWaalsContact O-N 3.13Å
344	Y	96.9	Very high	93.1	Very high	47 Å²	47	70.7 Å²	70.7	18%	0.184	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-126.2	160.2	-167.1	-53	-69.3	0	0	0	112.5	L269 A305 W307 V313 P337	L269-Y344 PolarHBondContact N-O 3.44Å; A305-Y344 HydrophobicContact CB-CD1 3.74Å; A305-Y344 HydrophobicContact CB-CE1 4.16Å; W307-Y344 AromaticContact CE2-CD2 3.96Å; W307-Y344 AromaticContact CZ2-CD2 3.88Å; W307-Y344 HydrophobicContact CZ2-CD2 3.88Å; V313-Y344 HydrophobicContact CB-CD2 4.46Å; V313-Y344 HydrophobicContact CB-CG 4.43Å; V313-Y344 HydrophobicContact CG1-CD1 3.54Å; V313-Y344 HydrophobicContact CG1-CD2 4.2Å; V313-Y344 HydrophobicContact CG1-CE1 3.81Å; V313-Y344 HydrophobicContact CG1-CE2 4.44Å; V313-Y344 HydrophobicContact CG1-CG 3.73Å; V313-Y344 HydrophobicContact CG2-CD1 4.41Å; V313-Y344 HydrophobicContact CG2-CD2 3.55Å; V313-Y344 HydrophobicContact CG2-CE2 3.87Å; V313-Y344 HydrophobicContact CG2-CG 3.83Å; P337-Y344 HydrophobicContact CB-CE2 3.92Å; P337-Y344 HydrophobicContact CG-CD2 4.12Å; P337-Y344 HydrophobicContact CG-CE2 3.43Å; P337-Y344 VanDerWaalsContact CG-CE2 3.43Å
345	G	98.1	Very high	93	Very high	3 Å²	3	70.7 Å²	70.7	3%	0.031	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-157.5	167.4	0	0	0	0	0	111.5	Y262 A305 G306 W307	Y262-G345 WeakPolarHBondContact OH-CA 2.91Å; A305-G345 PolarHBondContact O-N 2.72Å; A305-G345 VanDerWaalsContact O-N 3.1Å; G306-G345 CarbonylContact C-O 3.55Å; G306-G345 VanDerWaalsContact CA-O 3.28Å; G306-G345 WeakPolarHBondContact CA-O 3.14Å; W307-G345 PolarHBondContact N-O 3.18Å
346	V	98.7	Very high	92.8	Very high	0 Å²	0	73.6 Å²	73.6	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	141.2	177.3	65.4	0	0	0	0	111.2	L263 L269 A274 C278 I285 W307	L263-V346 HydrophobicContact CB-CG1 3.86Å; L263-V346 HydrophobicContact CD2-CG1 4.15Å; L263-V346 PolarHBondContact N-O 2.74Å; L269-V346 HydrophobicContact CD1-CB 4.23Å; L269-V346 HydrophobicContact CD1-CG1 3.84Å; A274-V346 HydrophobicContact CB-CB 3.66Å; A274-V346 HydrophobicContact CB-CG1 4.4Å; A274-V346 HydrophobicContact CB-CG2 3.65Å; C278-V346 WeakPolarHBondContact SG-CG2 3.27Å; I285-V346 HydrophobicContact CD1-CG2 3.88Å; I285-V346 HydrophobicContact CG1-CG2 3.85Å; W307-V346 HydrophobicContact CB-CG2 4.43Å
347	Y	98.8	Very high	92.6	Very high	0 Å²	0	75.2 Å²	75.2	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	130.8	166	-69.1	-87	0	0	0	109.1	F260 Y261 Y262 A286 M291 Y300 R302 D304 W307 R314 P316	F260-Y347 AromaticContact CE1-CD1 3.59Å; F260-Y347 HydrophobicContact CE1-CD1 3.59Å; F260-Y347 HydrophobicContact CE1-CE1 4.06Å; F260-Y347 HydrophobicContact CE1-CG 4.44Å; F260-Y347 HydrophobicContact CE2-CD1 4.27Å; F260-Y347 HydrophobicContact CE2-CG 4.38Å; F260-Y347 AromaticContact CZ-CD1 3.35Å; F260-Y347 HydrophobicContact CZ-CD1 3.35Å; F260-Y347 HydrophobicContact CZ-CE1 4.07Å; F260-Y347 AromaticContact CZ-CG 3.76Å; F260-Y347 HydrophobicContact CZ-CG 3.76Å; Y261-Y347 CarbonylContact O-C 3.56Å; Y261-Y347 WeakPolarHBondContact O-CA 3.32Å; Y262-Y347 HydrophobicContact CD2-CD1 4.16Å; Y262-Y347 HydrophobicContact CD2-CD2 4.26Å; Y262-Y347 AromaticContact CD2-CE1 3.79Å; Y262-Y347 HydrophobicContact CD2-CE1 3.79Å; Y262-Y347 AromaticContact CD2-CE2 3.86Å; Y262-Y347 HydrophobicContact CD2-CE2 3.86Å; Y262-Y347 HydrophobicContact CD2-CG 4.39Å; Y262-Y347 AromaticContact CD2-CZ 3.62Å; Y262-Y347 HydrophobicContact CE2-CE2 4.39Å; Y262-Y347 HydrophobicContact CG-CE1 4.27Å; A286-Y347 WeakPolarHBondContact CB-O 3.33Å; A286-Y347 PolarHBondContact N-O 2.9Å; M291-Y347 HydrophobicContact CE-CD1 4.01Å; M291-Y347 HydrophobicContact CE-CD2 3.33Å; M291-Y347 HydrophobicContact CE-CE1 4.08Å; M291-Y347 HydrophobicContact CE-CE2 3.44Å; M291-Y347 VanDerWaalsContact CE-CE2 3.44Å; M291-Y347 HydrophobicContact CE-CG 3.63Å; Y300-Y347 AromaticContact CE1-CE1 3.92Å; Y300-Y347 HydrophobicContact CE1-CE1 3.92Å; R302-Y347 HydrophobicContact CB-CE1 4.44Å; R302-Y347 HydrophobicContact CG-CE1 4.48Å; R302-Y347 WeakPolarHBondContact CG-OH 3.47Å; D304-Y347 PolarHBondContact O-OH 2.93Å; W307-Y347 PolarHBondContact O-N 3.22Å; R314-Y347 WeakPolarHBondContact O-CE2 3.43Å; P316-Y347 WeakPolarHBondContact CD-OH 3.45Å
348	C	98.6	Very high	92.3	Very high	0 Å²	0	77.9 Å²	77.9	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	155.7	177.7	-52.3	0	0	0	0	110.1	Y261 C278 A283 Q284	Y261-C348 HydrophobicContact CE1-CB 4.04Å; Y261-C348 HydrophobicContact CE2-CB 4.08Å; Y261-C348 PolarHBondContact N-O 2.94Å; Y261-C348 PolarHBondContact O-N 3.12Å; C278-C348 WeakPolarHBondContact CA-SG 3.47Å; C278-C348 HydrophobicContact CB-CB 3.81Å; C278-C348 WeakPolarHBondContact CB-SG 3.25Å; C278-C348 VanDerWaalsContact SG-CA 3.59Å; C278-C348 WeakPolarHBondContact SG-CB 3.24Å; C278-C348 CovalentContact SG-SG 2.04Å; C278-C348 PolarHBondContact SG-SG 2.94Å; A283-C348 HydrophobicContact CB-CB 3.99Å; Q284-C348 CarbonylContact O-C 3.56Å; Q284-C348 VanDerWaalsContact O-CA 3.24Å; Q284-C348 WeakPolarHBondContact O-CA 3.49Å
349	Y	98.1	Very high	92.1	Very high	15 Å²	15	77.5 Å²	77.5	6%	0.059	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	127.6	174.2	178.5	-97.3	0	0	0	109.3	H256 G258 K259 F260 A283 Q284 Q290 E351	H256-Y349 HydrophobicContact CB-CE2 4.02Å; H256-Y349 WeakPolarHBondContact CB-OH 3.05Å; G258-Y349 VanDerWaalsContact CA-OH 3.25Å; G258-Y349 WeakPolarHBondContact CA-OH 3.46Å; G258-Y349 PolarHBondContact N-OH 2.89Å; K259-Y349 WeakPolarHBondContact O-CA 2.98Å; F260-Y349 HydrophobicContact CB-CD2 4.29Å; A283-Y349 WeakPolarHBondContact CB-O 3.46Å; Q284-Y349 PolarHBondContact N-O 3.21Å; Q284-Y349 PolarHBondContact O-N 3.26Å; Q290-Y349 HydrophobicContact CB-CD2 4.4Å; Q290-Y349 HydrophobicContact CG-CD2 4.24Å; Q290-Y349 HydrophobicContact CG-CE2 4.43Å; Q290-Y349 HydrophobicContact CG-CG 4.45Å; Q290-Y349 VanDerWaalsContact OE1-CG 3.29Å; Y349-E351 HydrophobicContact CD1-CG 4.32Å; Y349-E351 HydrophobicContact CE1-CG 3.59Å
350	K	96.8	Very high	91.8	Very high	91 Å²	91	78.1 Å²	78.1	40%	0.396	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	118.4	179.1	-172.4	166.9	-170.9	162.4	0	109.2	G258 K259 Y261 D281 G282 A283	G258-K350 CarbonylContact C-O 3.55Å; G258-K350 WeakPolarHBondContact CA-O 3.2Å; K259-K350 PolarHBondContact N-O 3.24Å; K259-K350 PolarHBondContact O-N 2.81Å; Y261-K350 HydrophobicContact CE1-CB 4.12Å; D281-K350 PolarHBondContact O-NZ 3.45Å; G282-K350 WeakPolarHBondContact O-CE 3.27Å; A283-K350 HydrophobicContact CB-CB 4.01Å
351	E	90.3	Very high	91.5	Very high	121 Å²	121	71.3 Å²	71.3	57%	0.565	35%	0.347	S	S	*	.			trans	-64.5	140	173.3	-70.5	178.5	177.1	0	0	109.8	Y349 N353	Y349-E351 HydrophobicContact CD1-CG 4.32Å; Y349-E351 HydrophobicContact CE1-CG 3.59Å; E351-N353 PolarHBondContact O-N 3.05Å
352	N	81	Confident	91.4	Very high	112 Å²	112	68.6 Å²	68.6	60%	0.599	34%	0.336	S	S	*	.			trans	-82	109.8	169.3	-72.5	-13.9	0	0	0	106.2	K257	K257-N352 WeakPolarHBondContact O-CB 3.44Å; K257-N352 PolarHBondContact O-ND2 3.27Å
353	N	54.6	Low	91.2	Very high	228 Å²	228	64.5 Å²	64.5	100%	1.219	32%	0.322	S	S	*	.			trans	-63	0	172.2	-79.8	-2.7	0	0	0	111.3	E351	E351-N353 PolarHBondContact O-N 3.05Å

Retrieved 353 of 353 residues in 232.2 ms (Link to these results)

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