A0A096M661_POEFO Loading...

Adenylosuccinate synthetase

Plays an important role in the de novo pathway and in the salvage pathway of purine nucleotide biosynthesis. Catalyzes the first commited step in the biosynthesis of AMP from IMP. Plays an important role in the de novo pathway of purine nucleotide biosynthesis.

AlphaFold DB , UniProt , Accession A0A096M661, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 459 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.1	Very low	30.4	Very low	245 Å²	245	157.8 Å²	157.8	100%	1.207	79%	0.792	S	S	*	*				0	105.8	0	-66.4	174.3	-171.1	0	0	104.8
2	S	30.2	Very low	30.3	Very low	107 Å²	107	154.8 Å²	154.8	75%	0.748	79%	0.788	S	S	*	*				175.2	157.7	64.7	55.2	0	0	0	0	103.9
3	L	28.8	Very low	30.3	Very low	166 Å²	166	158.4 Å²	158.4	87%	0.869	80%	0.8	S	S	*	*			cis	-159	155.7	18.1	-111.8	136.8	0	0	0	107.1
4	N	28.7	Very low	30.6	Very low	130 Å²	130	158.4 Å²	158.4	70%	0.695	80%	0.804	S	S	*	*			trans	-91.2	151.6	-175.5	-119.3	-8.1	0	0	0	110.5
5	W	27.3	Very low	30.7	Very low	226 Å²	226	159.8 Å²	159.8	86%	0.856	81%	0.806	S	S	*	*			trans	77.1	150.8	148.8	-67.2	40	0	0	0	117.6
6	S	30.7	Very low	31.2	Very low	84 Å²	84	157.9 Å²	157.9	59%	0.587	81%	0.808	S	S	*	*			cis	-171.6	145	-9.7	170.5	0	0	0	0	107.2
7	S	33.6	Very low	31.4	Very low	102 Å²	102	156.7 Å²	156.7	71%	0.713	81%	0.81	S	S	*	*			trans	50.3	115.6	145.1	64.2	0	0	0	0	122.1
8	K	31	Very low	31.9	Very low	187 Å²	187	153.3 Å²	153.3	81%	0.813	81%	0.809	S	S	*	*			trans	-156.2	120.3	130.7	-107.8	173.9	-178	-177.3	0	110.7
9	E	29.6	Very low	32.5	Very low	162 Å²	162	150.1 Å²	150.1	76%	0.757	81%	0.807	S	S	*	*			trans	36.9	143.7	133.9	-69.2	172	154.2	0	0	119.8
10	Q	27.9	Very low	32.9	Very low	150 Å²	150	146.3 Å²	146.3	70%	0.701	80%	0.804	S	S	*	*			cis	176.5	152.3	-12	-133.4	-176.3	18.7	0	0	103.7
11	K	28.5	Very low	33.5	Very low	177 Å²	177	148.1 Å²	148.1	77%	0.77	81%	0.807	S	S	*	*			trans	74.7	134.3	164.3	-58.8	173.6	-177.9	178	0	115.7
12	T	29.8	Very low	33.7	Very low	121 Å²	121	146.1 Å²	146.1	74%	0.742	79%	0.792	S	S	*	*			cis	-173.3	131.8	5.4	8.3	0	0	0	0	105.1
13	Q	30.1	Very low	34.5	Very low	202 Å²	202	152.5 Å²	152.5	94%	0.944	80%	0.799	S	S	*	*			trans	-155.7	114.3	146.9	-112.9	171.9	18.4	0	0	109.7
14	N	33.8	Very low	35.2	Very low	159 Å²	159	149 Å²	149	85%	0.85	79%	0.794	S	S	*	*			trans	-59.9	128.2	177.3	-78.1	-27.1	0	0	0	111.9
15	Q	32.8	Very low	36.2	Very low	179 Å²	179	152.5 Å²	152.5	84%	0.836	80%	0.797	S	S	*	*			trans	-139.3	132.2	137.4	-76.1	-170.1	-9.1	0	0	108.3	T17	Q15-T17 PolarHBondContact O-N 3.27Å; Q15-T17 VanDerWaalsContact O-N 3.15Å
16	P	37.9	Very low	37.1	Very low	130 Å²	130	146.1 Å²	146.1	84%	0.844	79%	0.788	S	S	*	*			trans	-72.7	111.1	-179.5	29	-29.8	0	0	0	108.5	A18	P16-A18 PolarHBondContact O-N 3.15Å
17	T	36	Very low	38	Very low	137 Å²	137	150.1 Å²	150.1	84%	0.84	80%	0.802	S	S	*	*			trans	-63.1	123.1	165.9	38.3	0	0	0	0	108	Q15 A19	Q15-T17 PolarHBondContact O-N 3.27Å; Q15-T17 VanDerWaalsContact O-N 3.15Å; T17-A19 PolarHBondContact O-N 2.89Å; T17-A19 VanDerWaalsContact O-N 3.1Å
18	A	40.5	Very low	38.8	Very low	95 Å²	95	149.1 Å²	149.1	79%	0.785	80%	0.8	S	S	*	*			trans	-42.3	118.5	176.6	0	0	0	0	0	110	P16 G20	P16-A18 PolarHBondContact O-N 3.15Å; A18-G20 PolarHBondContact O-N 2.82Å
19	A	41.8	Very low	40.4	Very low	93 Å²	93	143.8 Å²	143.8	77%	0.769	78%	0.778	S	S	*	*			trans	-50.9	113.9	168.7	0	0	0	0	0	107.3	T17 Q21	T17-A19 PolarHBondContact O-N 2.89Å; T17-A19 VanDerWaalsContact O-N 3.1Å; A19-Q21 VanDerWaalsContact C-N 3.34Å; A19-Q21 PolarHBondContact O-N 3.1Å
20	G	41.2	Very low	42.9	Very low	73 Å²	73	137.1 Å²	137.1	75%	0.753	75%	0.747	S	S	*	*			trans	-56.3	102.4	171.9	0	0	0	0	0	107.8	A18 K22	A18-G20 PolarHBondContact O-N 2.82Å; G20-K22 VanDerWaalsContact C-N 3.33Å; G20-K22 PolarHBondContact O-N 2.97Å
21	Q	44.8	Very low	45.8	Very low	185 Å²	185	136.6 Å²	136.6	86%	0.864	74%	0.743	S	S	*	*			trans	-56.1	105.4	163.3	-79.7	-179.9	-27	0	0	105.7	A19 R23	A19-Q21 VanDerWaalsContact C-N 3.34Å; A19-Q21 PolarHBondContact O-N 3.1Å; Q21-R23 VanDerWaalsContact C-N 3.32Å; Q21-R23 PolarHBondContact O-N 2.92Å
22	K	43.4	Very low	48.8	Very low	204 Å²	204	128.1 Å²	128.1	89%	0.887	71%	0.706	S	S	*	*			trans	-54.2	106.4	160.2	-81.9	-178.7	175.3	178.4	0	105	G20 A24	G20-K22 VanDerWaalsContact C-N 3.33Å; G20-K22 PolarHBondContact O-N 2.97Å; K22-A24 PolarHBondContact O-N 2.88Å
23	R	47.4	Very low	51.9	Low	241 Å²	241	124.1 Å²	124.1	91%	0.909	68%	0.681	S	S	*	*			trans	-52.9	109.5	170.7	-79.8	-179.4	174	177.8	-2.5	106.2	Q21 R25	Q21-R23 VanDerWaalsContact C-N 3.32Å; Q21-R23 PolarHBondContact O-N 2.92Å; R23-R25 PolarHBondContact O-N 2.83Å
24	A	43.3	Very low	54.9	Low	91 Å²	91	114.5 Å²	114.5	75%	0.752	64%	0.636	S	S	*	*			trans	-56.4	128.4	167	0	0	0	0	0	106.4	K22 S26	K22-A24 PolarHBondContact O-N 2.88Å; A24-S26 PolarHBondContact O-N 3.09Å
25	R	48.5	Very low	57.8	Low	204 Å²	204	106.9 Å²	106.9	77%	0.77	60%	0.596	S	S	*	*			trans	-55	124.7	163.9	-94.1	179.9	169.8	169.7	-4.3	105.4	R23 D27	R23-R25 PolarHBondContact O-N 2.83Å; R25-D27 PolarHBondContact O-N 2.99Å
26	S	46.6	Very low	60.7	Low	93 Å²	93	98.5 Å²	98.5	65%	0.65	56%	0.557	S	S	*	*			trans	-61.4	106.6	174	50.5	0	0	0	0	107.6	A24 A28	A24-S26 PolarHBondContact O-N 3.09Å; S26-A28 PolarHBondContact O-N 3Å
27	D	50	Low	63.2	Low	168 Å²	168	92.3 Å²	92.3	90%	0.898	52%	0.517	S	S	*	.	S	Bend	trans	-67.5	15	-177.9	-78	-34.4	0	0	0	114.3	R25	R25-D27 PolarHBondContact O-N 2.99Å
28	A	50.8	Low	65.9	Low	80 Å²	80	85.9 Å²	85.9	66%	0.661	48%	0.477	S	S	*	.			trans	-112.2	56.5	178.9	0	0	0	0	0	110.6	S26	S26-A28 PolarHBondContact O-N 3Å
29	E	64.7	Low	68.3	Low	75 Å²	75	81.3 Å²	81.3	35%	0.35	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-88.9	125.2	160.5	-76.1	179.4	-163.6	0	0	107.9	K31 H245 N292	E29-K31 PolarHBondContact O-N 3.22Å; E29-H245 IonicContact OE1-NE2 2.86Å; E29-N292 PolarHBondContact OE2-ND2 3.02Å
30	N	80.9	Confident	70.4	Confident	22 Å²	22	77.2 Å²	77.2	12%	0.118	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-56.9	135.9	174.4	-71.3	-40.7	0	0	0	109.3	A243 L244 P247 P248 K249	N30-A243 PolarHBondContact ND2-O 3.24Å; N30-L244 HydrophobicContact CB-CD2 4.44Å; N30-L244 PolarHBondContact N-O 2.8Å; N30-L244 VanDerWaalsContact O-CD2 3.26Å; N30-L244 WeakPolarHBondContact O-CD2 3.34Å; N30-P247 PolarHBondContact ND2-O 3.27Å; N30-P248 VanDerWaalsContact OD1-CA 3.24Å; N30-P248 WeakPolarHBondContact OD1-CA 3.01Å; N30-K249 PolarHBondContact ND2-N 3.09Å; N30-K249 PolarHBondContact OD1-N 3.32Å; N30-K249 VanDerWaalsContact OD1-N 3.17Å
31	K	88.3	Confident	72.4	Confident	139 Å²	139	74 Å²	74	60%	0.604	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-97.3	143.4	175.6	-66.8	-170.7	179.2	-175.6	0	110.6	E29 N292	E29-K31 PolarHBondContact O-N 3.22Å; K31-N292 CarbonylContact C-O 3.56Å; K31-N292 WeakPolarHBondContact CA-O 3.41Å
32	V	91.9	Very high	74.2	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.8	178.8	-177.9	0	0	0	0	109.4	V34 L244 I251 V253 I288 N292 G294	V32-V34 HydrophobicContact CG1-CG2 4.28Å; V32-L244 HydrophobicContact CG2-CD2 3.65Å; V32-I251 HydrophobicContact CG1-CG2 4.09Å; V32-I251 HydrophobicContact CG2-CB 4.27Å; V32-I251 HydrophobicContact CG2-CD1 4.44Å; V32-I251 HydrophobicContact CG2-CG2 4.19Å; V32-V253 HydrophobicContact CG1-CB 4.31Å; V32-V253 HydrophobicContact CG1-CG2 3.25Å; V32-I288 HydrophobicContact CB-CD1 4.3Å; V32-I288 HydrophobicContact CG1-CD1 4.47Å; V32-I288 HydrophobicContact CG2-CD1 3.86Å; V32-N292 PolarHBondContact N-O 2.72Å; V32-G294 PolarHBondContact O-N 3.48Å
33	T	94.5	Very high	76.2	Confident	36 Å²	36	58.4 Å²	58.4	22%	0.221	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	131.1	171	-60.9	0	0	0	0	109.3	L52 I251 L252 V253 D295 F297	T33-L52 HydrophobicContact CG2-CD1 4.41Å; T33-I251 PolarHBondContact N-O 3.29Å; T33-L252 HydrophobicContact CG2-CD1 4.05Å; T33-L252 CarbonylContact O-C 3.58Å; T33-L252 WeakPolarHBondContact O-CA 3.39Å; T33-V253 PolarHBondContact O-N 2.73Å; T33-D295 CarbonylContact C-O 3.55Å; T33-D295 WeakPolarHBondContact CA-O 3.5Å; T33-D295 HydrophobicContact CG2-CB 4.41Å; T33-F297 HydrophobicContact CG2-CD2 3.69Å; T33-F297 HydrophobicContact CG2-CE2 3.37Å; T33-F297 HydrophobicContact CG2-CZ 4.42Å
34	V	94.4	Very high	77.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	136.5	-176.6	-171.9	0	0	0	0	110.1	V32 L36 V253 V282 I293 D295 V296 F297	V32-V34 HydrophobicContact CG1-CG2 4.28Å; V34-L36 HydrophobicContact CG1-CD1 4.19Å; V34-L36 HydrophobicContact CG1-CD2 3.65Å; V34-L36 HydrophobicContact CG1-CG 3.66Å; V34-V253 HydrophobicContact CG1-CB 4.31Å; V34-V253 HydrophobicContact CG1-CG1 4.45Å; V34-V253 HydrophobicContact CG2-CB 4.3Å; V34-V282 HydrophobicContact CG1-CG2 3.61Å; V34-V282 HydrophobicContact CG2-CG1 4.19Å; V34-V282 HydrophobicContact CG2-CG2 4.13Å; V34-I293 HydrophobicContact CG2-CG2 4.15Å; V34-D295 PolarHBondContact N-O 2.83Å; V34-V296 HydrophobicContact CB-CG1 4.31Å; V34-V296 HydrophobicContact CB-CG2 4.43Å; V34-F297 PolarHBondContact O-N 2.88Å
35	V	94	Very high	79.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	116.1	171.6	-177.3	0	0	0	0	109.4	K45 V48 V49 L52 L252 V253 G255 F297 V299	V35-K45 HydrophobicContact CG1-CB 4.45Å; V35-K45 HydrophobicContact CG1-CG 4.49Å; V35-V48 HydrophobicContact CG1-CB 4.25Å; V35-V48 HydrophobicContact CG1-CG1 4.09Å; V35-V48 HydrophobicContact CG2-CG1 4.23Å; V35-V49 HydrophobicContact CB-CG2 3.93Å; V35-V49 HydrophobicContact CG1-CG2 3.94Å; V35-V49 HydrophobicContact CG2-CG2 4.17Å; V35-L52 HydrophobicContact CG2-CD1 3.72Å; V35-L252 HydrophobicContact CG2-CD1 3.87Å; V35-V253 PolarHBondContact N-O 2.92Å; V35-G255 VanDerWaalsContact O-CA 3.31Å; V35-G255 WeakPolarHBondContact O-CA 3.39Å; V35-G255 PolarHBondContact O-N 2.85Å; V35-F297 HydrophobicContact CG2-CD2 4.43Å; V35-V299 HydrophobicContact CG1-CG2 3.47Å; V35-V299 VanDerWaalsContact CG1-CG2 3.47Å
36	L	93	Very high	81.2	Confident	2 Å²	2	36 Å²	36	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	154	-178.1	-58.8	177.7	0	0	0	111.3	V34 V279 V296 F297 V299 N356 F358	V34-L36 HydrophobicContact CG1-CD1 4.19Å; V34-L36 HydrophobicContact CG1-CD2 3.65Å; V34-L36 HydrophobicContact CG1-CG 3.66Å; L36-V279 HydrophobicContact CD1-CB 4.11Å; L36-V296 HydrophobicContact CD1-CG1 3.94Å; L36-V296 HydrophobicContact CG-CG1 4.44Å; L36-F297 PolarHBondContact N-O 3.31Å; L36-V299 PolarHBondContact O-N 2.96Å; L36-N356 HydrophobicContact CD1-CB 4.21Å; L36-N356 WeakPolarHBondContact CD1-OD1 3.42Å; L36-F358 HydrophobicContact CB-CE1 4.16Å; L36-F358 HydrophobicContact CD1-CE1 4.44Å
37	G	92.3	Very high	82.9	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	131.3	174.6	0	0	0	0	0	109.6	A259	G37-A259 WeakPolarHBondContact O-CB 3.47Å; G37-A259 PolarHBondContact O-N 3.22Å
38	A	90.9	Very high	84.6	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.008	15%	0.15	C	C	.	.	S	Bend	trans	-89.3	-7.5	-177.8	0	0	0	0	0	113.7	V299 A352 F358	A38-V299 WeakPolarHBondContact CB-O 3.47Å; A38-V299 PolarHBondContact N-O 3.25Å; A38-A352 WeakPolarHBondContact O-CB 3.39Å; A38-F358 HydrophobicContact CB-CE2 4Å; A38-F358 HydrophobicContact CB-CZ 4.14Å
39	Q	91	Very high	86.3	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.119	C	C	.	.	S	Bend	trans	-124.1	-138.1	-172.5	-62.5	169.3	-35.2	0	0	111.2	E43 A258 L260 S300 K301 I348 L349	Q39-E43 VanDerWaalsContact C-OE1 3.32Å; Q39-E43 WeakPolarHBondContact CA-OE1 3.49Å; Q39-E43 HydrophobicContact CB-CG 4.06Å; Q39-E43 WeakPolarHBondContact CB-OE1 3.48Å; Q39-E43 PolarHBondContact N-OE1 2.89Å; Q39-A258 WeakPolarHBondContact O-CB 3.03Å; Q39-L260 VanDerWaalsContact C-CD1 3.46Å; Q39-L260 HydrophobicContact CB-CD1 4.42Å; Q39-L260 VanDerWaalsContact O-CB 3.28Å; Q39-L260 WeakPolarHBondContact O-CB 3.35Å; Q39-L260 PolarHBondContact O-N 2.82Å; Q39-S300 PolarHBondContact NE2-OG 3.42Å; Q39-S300 VanDerWaalsContact NE2-OG 3.15Å; Q39-K301 PolarHBondContact NE2-O 2.96Å; Q39-K301 VanDerWaalsContact NE2-O 3.08Å; Q39-K301 VanDerWaalsContact OE1-CB 3.29Å; Q39-I348 HydrophobicContact CG-CD1 4.39Å; Q39-L349 HydrophobicContact CG-CD1 4.14Å
40	W	86.8	Confident	87.3	Confident	7 Å²	7	19.9 Å²	19.9	3%	0.027	11%	0.107	C	C	.	.	S	Bend	trans	-100.6	25.9	-179.8	-80.5	-77.8	0	0	0	113	L260 L261 T268 T305 R306 F312 I348	W40-L260 VanDerWaalsContact CD1-CB 3.47Å; W40-L260 HydrophobicContact CD2-CB 3.8Å; W40-L260 HydrophobicContact CD2-CD1 3.43Å; W40-L260 VanDerWaalsContact CD2-CD1 3.43Å; W40-L260 HydrophobicContact CD2-CG 4.17Å; W40-L260 HydrophobicContact CE3-CD1 3.44Å; W40-L260 VanDerWaalsContact CE3-CD1 3.44Å; W40-L260 HydrophobicContact CG-CB 3.74Å; W40-L260 HydrophobicContact CG-CD1 4.08Å; W40-L260 HydrophobicContact CH2-CD1 3.77Å; W40-L260 HydrophobicContact CH2-CD2 4.37Å; W40-L260 HydrophobicContact CZ2-CB 4.17Å; W40-L260 HydrophobicContact CZ2-CD1 3.75Å; W40-L260 HydrophobicContact CZ2-CD2 3.92Å; W40-L260 HydrophobicContact CZ2-CG 4.18Å; W40-L260 HydrophobicContact CZ3-CD1 3.63Å; W40-L260 VanDerWaalsContact NE1-CB 3.34Å; W40-L261 WeakPolarHBondContact O-CD1 3.41Å; W40-T268 HydrophobicContact CZ2-CG2 3.56Å; W40-T268 PolarHBondContact NE1-OG1 2.64Å; W40-T305 WeakPolarHBondContact CB-O 3.34Å; W40-R306 HydrophobicContact CB-CB 4.39Å; W40-R306 HydrophobicContact CB-CG 4.42Å; W40-R306 HydrophobicContact CG-CB 4.49Å; W40-R306 HydrophobicContact CG-CG 4.25Å; W40-F312 HydrophobicContact CZ3-CD2 4.27Å; W40-F312 HydrophobicContact CZ3-CE2 4.26Å; W40-I348 HydrophobicContact CE3-CD1 4.07Å; W40-I348 HydrophobicContact CH2-CD1 4.07Å; W40-I348 HydrophobicContact CH2-CG2 3.88Å; W40-I348 HydrophobicContact CZ3-CD1 3.44Å; W40-I348 VanDerWaalsContact CZ3-CD1 3.44Å; W40-I348 HydrophobicContact CZ3-CG2 4.35Å
41	G	83.4	Confident	87.5	Confident	6 Å²	6	20.8 Å²	20.8	6%	0.062	11%	0.112	C	C	.	.	S	Bend	trans	94.7	175.1	179.3	0	0	0	0	0	113.2	E43	G41-E43 VanDerWaalsContact CA-CD 3.47Å; G41-E43 WeakPolarHBondContact CA-OE1 3.4Å; G41-E43 VanDerWaalsContact CA-OE2 3.22Å; G41-E43 WeakPolarHBondContact CA-OE2 3.46Å; G41-E43 PolarHBondContact N-OE1 3.06Å; G41-E43 PolarHBondContact O-N 3.44Å; G41-E43 VanDerWaalsContact O-N 3.15Å
42	D	81.3	Confident	87.4	Confident	61 Å²	61	16 Å²	16	33%	0.326	9%	0.092	S	C	.	.			trans	57.3	25.5	179.5	-59.1	-52.3	0	0	0	115.2	G44 K301 R339	D42-G44 PolarHBondContact O-N 3.46Å; D42-K301 WeakPolarHBondContact O-CE 3.43Å; D42-K301 PolarHBondContact O-NZ 2.96Å; D42-R339 IonicContact OD1-CZ 2.71Å; D42-R339 IonicContact OD1-NH2 2.7Å; D42-R339 PolarHBondContact OD1-NH2 2.76Å; D42-R339 IonicContact OD2-CZ 3.88Å; D42-R339 IonicContact OD2-NE 2.76Å; D42-R339 PolarHBondContact OD2-NE 3.36Å; D42-R339 IonicContact OD2-NH2 2.79Å; D42-R339 PolarHBondContact OD2-NH2 3.36Å
43	E	85.3	Confident	87.2	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.093	C	C	.	.	S	Bend	trans	-74.9	-1.2	178.3	-50.2	90	161.5	0	0	112.8	Q39 G41 K45 A258 V299 K301 T364	Q39-E43 VanDerWaalsContact C-OE1 3.32Å; Q39-E43 WeakPolarHBondContact CA-OE1 3.49Å; Q39-E43 HydrophobicContact CB-CG 4.06Å; Q39-E43 WeakPolarHBondContact CB-OE1 3.48Å; Q39-E43 PolarHBondContact N-OE1 2.89Å; G41-E43 VanDerWaalsContact CA-CD 3.47Å; G41-E43 WeakPolarHBondContact CA-OE1 3.4Å; G41-E43 VanDerWaalsContact CA-OE2 3.22Å; G41-E43 WeakPolarHBondContact CA-OE2 3.46Å; G41-E43 PolarHBondContact N-OE1 3.06Å; G41-E43 PolarHBondContact O-N 3.44Å; G41-E43 VanDerWaalsContact O-N 3.15Å; E43-K45 IonicContact OE2-NZ 3.62Å; E43-K45 PolarHBondContact OE2-NZ 3.31Å; E43-A258 WeakPolarHBondContact OE1-CB 3.04Å; E43-V299 HydrophobicContact CB-CB 4.34Å; E43-V299 HydrophobicContact CB-CG1 3.84Å; E43-V299 WeakPolarHBondContact O-CG1 3.33Å; E43-K301 HydrophobicContact CB-CB 4.49Å; E43-T364 WeakPolarHBondContact O-CB 3.48Å; E43-T364 WeakPolarHBondContact O-CG2 3.4Å; E43-T364 PolarHBondContact O-OG1 3Å
44	G	81.3	Confident	86.6	Confident	26 Å²	26	17.8 Å²	17.8	27%	0.268	10%	0.104	S	C	.	.			trans	81.4	27.3	-178.1	0	0	0	0	0	114.1	D42 G46 K47	D42-G44 PolarHBondContact O-N 3.46Å; G44-G46 PolarHBondContact O-N 2.97Å; G44-G46 VanDerWaalsContact O-N 3.13Å; G44-K47 PolarHBondContact O-N 3.48Å
45	K	83.8	Confident	86.2	Confident	27 Å²	27	23.8 Å²	23.8	12%	0.117	13%	0.132	C	C	.	.	H	α-helix	trans	-47.6	-39.4	174.4	-69.8	179.3	-71.2	-74.7	0	113.4	V35 E43 K47 V48 V49 N257 V299	V35-K45 HydrophobicContact CG1-CB 4.45Å; V35-K45 HydrophobicContact CG1-CG 4.49Å; E43-K45 IonicContact OE2-NZ 3.62Å; E43-K45 PolarHBondContact OE2-NZ 3.31Å; K45-K47 PolarHBondContact O-N 3.41Å; K45-K47 VanDerWaalsContact O-N 3.1Å; K45-V48 PolarHBondContact O-N 2.92Å; K45-V49 WeakPolarHBondContact O-CG2 3.34Å; K45-V49 PolarHBondContact O-N 2.76Å; K45-N257 WeakPolarHBondContact CE-O 3.08Å; K45-N257 PolarHBondContact NZ-O 3.47Å; K45-V299 HydrophobicContact CB-CG2 4.4Å; K45-V299 HydrophobicContact CG-CB 3.78Å; K45-V299 HydrophobicContact CG-CG1 4.19Å; K45-V299 HydrophobicContact CG-CG2 3.8Å
46	G	79.9	Confident	85.9	Confident	11 Å²	11	24 Å²	24	11%	0.113	13%	0.134	C	C	.	.	H	α-helix	trans	-53.6	-32.3	-179.9	0	0	0	0	0	113.7	G44 D50	G44-G46 PolarHBondContact O-N 2.97Å; G44-G46 VanDerWaalsContact O-N 3.13Å; G46-D50 VanDerWaalsContact O-CB 3.23Å; G46-D50 WeakPolarHBondContact O-CB 3.45Å; G46-D50 PolarHBondContact O-N 2.93Å
47	K	81.6	Confident	85.9	Confident	59 Å²	59	27.3 Å²	27.3	26%	0.257	15%	0.151	S	C	.	.	H	α-helix	trans	-72.2	-40.6	176.2	-65.6	-177.9	-175.8	167.6	0	112.9	G44 K45 V49 D50 L51 G449 K450 M455	G44-K47 PolarHBondContact O-N 3.48Å; K45-K47 PolarHBondContact O-N 3.41Å; K45-K47 VanDerWaalsContact O-N 3.1Å; K47-V49 VanDerWaalsContact C-N 3.33Å; K47-D50 PolarHBondContact O-N 3.41Å; K47-L51 WeakPolarHBondContact O-CB 3.32Å; K47-L51 PolarHBondContact O-N 3.17Å; K47-G449 PolarHBondContact NZ-O 3.46Å; K47-K450 VanDerWaalsContact CE-O 3.28Å; K47-K450 WeakPolarHBondContact CE-O 3.26Å; K47-M455 HydrophobicContact CB-CE 3.86Å; K47-M455 HydrophobicContact CD-CE 4.33Å
48	V	86.6	Confident	85.9	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.7	-41.2	177.1	-178.2	0	0	0	0	109.3	V35 K45 L51 L52 V299 A362 W445 M455	V35-V48 HydrophobicContact CG1-CB 4.25Å; V35-V48 HydrophobicContact CG1-CG1 4.09Å; V35-V48 HydrophobicContact CG2-CG1 4.23Å; K45-V48 PolarHBondContact O-N 2.92Å; V48-L51 PolarHBondContact O-N 2.96Å; V48-L52 HydrophobicContact CG1-CD1 4.04Å; V48-L52 WeakPolarHBondContact O-CB 3.49Å; V48-L52 VanDerWaalsContact O-CG 3.29Å; V48-L52 WeakPolarHBondContact O-CG 3.47Å; V48-L52 PolarHBondContact O-N 3.28Å; V48-V299 HydrophobicContact CB-CG2 4.27Å; V48-V299 HydrophobicContact CG1-CG2 4.49Å; V48-V299 HydrophobicContact CG2-CG1 4.31Å; V48-V299 HydrophobicContact CG2-CG2 4.01Å; V48-A362 HydrophobicContact CG1-CB 4.47Å; V48-A362 HydrophobicContact CG2-CB 3.68Å; V48-W445 HydrophobicContact CG1-CE3 4.43Å; V48-W445 HydrophobicContact CG1-CZ3 4.42Å; V48-M455 HydrophobicContact CG2-CE 4.3Å
49	V	87.3	Confident	85.9	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.006	15%	0.151	C	C	.	.	H	α-helix	trans	-64.1	-45.5	175	177.8	0	0	0	0	110.7	V35 K45 K47 L51 L52 A53 S86 L252 E254	V35-V49 HydrophobicContact CB-CG2 3.93Å; V35-V49 HydrophobicContact CG1-CG2 3.94Å; V35-V49 HydrophobicContact CG2-CG2 4.17Å; K45-V49 WeakPolarHBondContact O-CG2 3.34Å; K45-V49 PolarHBondContact O-N 2.76Å; K47-V49 VanDerWaalsContact C-N 3.33Å; V49-L51 PolarHBondContact O-N 3.21Å; V49-L52 PolarHBondContact O-N 3.41Å; V49-A53 WeakPolarHBondContact O-CA 3.12Å; V49-A53 WeakPolarHBondContact O-CB 3.2Å; V49-A53 PolarHBondContact O-N 3.48Å; V49-S86 WeakPolarHBondContact CG1-OG 3.4Å; V49-L252 HydrophobicContact CG1-CD2 3.98Å; V49-E254 HydrophobicContact CG1-CB 4.33Å; V49-E254 HydrophobicContact CG1-CG 4.42Å; V49-E254 HydrophobicContact CG2-CB 4.39Å; V49-E254 HydrophobicContact CG2-CG 4.12Å
50	D	84.8	Confident	86	Confident	19 Å²	19	27.3 Å²	27.3	10%	0.102	15%	0.151	C	C	.	.	H	α-helix	trans	-60.1	-43.2	176.7	179.5	58.4	0	0	0	112.6	G46 K47 L52 A53 T54 V72	G46-D50 VanDerWaalsContact O-CB 3.23Å; G46-D50 WeakPolarHBondContact O-CB 3.45Å; G46-D50 PolarHBondContact O-N 2.93Å; K47-D50 PolarHBondContact O-N 3.41Å; D50-L52 PolarHBondContact O-N 3.47Å; D50-A53 PolarHBondContact O-N 2.89Å; D50-T54 PolarHBondContact O-OG1 3.28Å; D50-V72 HydrophobicContact CB-CG1 4.07Å
51	L	85.5	Confident	86.2	Confident	41 Å²	41	27 Å²	27	22%	0.215	15%	0.15	C	C	.	.	H	α-helix	trans	-58.2	-48.2	175.5	-178.7	65.5	0	0	0	111.4	K47 V48 V49 R452 M455	K47-L51 WeakPolarHBondContact O-CB 3.32Å; K47-L51 PolarHBondContact O-N 3.17Å; V48-L51 PolarHBondContact O-N 2.96Å; V49-L51 PolarHBondContact O-N 3.21Å; L51-R452 HydrophobicContact CD1-CG 4.27Å; L51-R452 PolarHBondContact O-NH2 2.85Å; L51-M455 HydrophobicContact CD2-CG 4.27Å
52	L	86.6	Confident	86.5	Confident	37 Å²	37	26.9 Å²	26.9	19%	0.194	15%	0.148	C	C	.	.	H	α-helix	trans	-76	-29.2	-178.5	-65.8	174.4	0	0	0	112.9	T33 V35 V48 V49 D50 T54 E55 A56 L252 F297 W445	T33-L52 HydrophobicContact CG2-CD1 4.41Å; V35-L52 HydrophobicContact CG2-CD1 3.72Å; V48-L52 HydrophobicContact CG1-CD1 4.04Å; V48-L52 WeakPolarHBondContact O-CB 3.49Å; V48-L52 VanDerWaalsContact O-CG 3.29Å; V48-L52 WeakPolarHBondContact O-CG 3.47Å; V48-L52 PolarHBondContact O-N 3.28Å; V49-L52 PolarHBondContact O-N 3.41Å; D50-L52 PolarHBondContact O-N 3.47Å; L52-T54 PolarHBondContact O-N 2.9Å; L52-E55 PolarHBondContact O-N 3.24Å; L52-A56 PolarHBondContact O-N 3.5Å; L52-L252 HydrophobicContact CB-CD1 4Å; L52-L252 HydrophobicContact CB-CD2 3.69Å; L52-L252 HydrophobicContact CB-CG 4.5Å; L52-L252 HydrophobicContact CD1-CD1 3.94Å; L52-F297 HydrophobicContact CD1-CD2 3.83Å; L52-F297 HydrophobicContact CD1-CE2 4.01Å; L52-W445 HydrophobicContact CD1-CH2 4.32Å; L52-W445 HydrophobicContact CD2-CH2 3.98Å; L52-W445 HydrophobicContact CD2-CZ2 3.98Å
53	A	86.1	Confident	86.9	Confident	3 Å²	3	24.4 Å²	24.4	3%	0.025	13%	0.134	C	C	.	.	H	α-helix	trans	-67.7	-19.7	-177.3	0	0	0	0	0	113	V49 D50 E55 A56 I59 N90 L252	V49-A53 WeakPolarHBondContact O-CA 3.12Å; V49-A53 WeakPolarHBondContact O-CB 3.2Å; V49-A53 PolarHBondContact O-N 3.48Å; D50-A53 PolarHBondContact O-N 2.89Å; A53-E55 VanDerWaalsContact C-N 3.27Å; A53-E55 PolarHBondContact O-N 2.97Å; A53-A56 PolarHBondContact O-N 3.17Å; A53-I59 HydrophobicContact CB-CG1 4.14Å; A53-N90 PolarHBondContact O-ND2 2.87Å; A53-L252 HydrophobicContact CB-CD2 4.13Å
54	T	83.4	Confident	86.8	Confident	72 Å²	72	24.4 Å²	24.4	44%	0.442	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-31.2	176.2	-59.5	0	0	0	0	112.4	D50 L52 R452	D50-T54 PolarHBondContact O-OG1 3.28Å; L52-T54 PolarHBondContact O-N 2.9Å; T54-R452 VanDerWaalsContact CB-NH2 3.28Å; T54-R452 PolarHBondContact OG1-NH1 3.36Å; T54-R452 PolarHBondContact OG1-NH2 3.08Å
55	E	84.9	Confident	86.8	Confident	126 Å²	126	23.1 Å²	23.1	59%	0.589	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-6.3	177.9	-60.8	-173	-169.9	0	0	113	L52 A53 K250	L52-E55 PolarHBondContact O-N 3.24Å; A53-E55 VanDerWaalsContact C-N 3.27Å; A53-E55 PolarHBondContact O-N 2.97Å; E55-K250 HydrophobicContact CB-CD 4.19Å; E55-K250 WeakPolarHBondContact O-CD 3.28Å; E55-K250 IonicContact OE2-NZ 2.73Å; E55-K250 PolarHBondContact OE2-NZ 2.75Å
56	A	89.1	Confident	86.4	Confident	5 Å²	5	22.7 Å²	22.7	4%	0.041	12%	0.12	C	C	.	.			trans	-83.8	134.4	-177	0	0	0	0	0	111.6	L52 A53 I59 L252	L52-A56 PolarHBondContact O-N 3.5Å; A53-A56 PolarHBondContact O-N 3.17Å; A56-I59 HydrophobicContact CB-CD1 4.09Å; A56-I59 HydrophobicContact CB-CG1 3.93Å; A56-L252 HydrophobicContact CB-CB 3.83Å; A56-L252 HydrophobicContact CB-CD2 4.41Å
57	D	91.3	Very high	86	Confident	71 Å²	71	23.2 Å²	23.2	38%	0.38	12%	0.121	S	C	.	.	S	Bend	trans	-81.7	-33.4	172.7	-59.4	-63.2	0	0	0	111.2	G93 I94 K249 K250	D57-G93 CarbonylContact O-C 3.5Å; D57-G93 WeakPolarHBondContact O-CA 3.29Å; D57-I94 PolarHBondContact O-N 3.09Å; D57-K249 HydrophobicContact CB-CB 4.39Å; D57-K249 HydrophobicContact CB-CG 4.46Å; D57-K249 WeakPolarHBondContact OD2-CA 3.27Å; D57-K250 PolarHBondContact N-O 3.44Å; D57-K250 PolarHBondContact OD2-N 3.07Å
58	I	92.1	Very high	85.1	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.005	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	128.5	179.7	-50.2	179.8	0	0	0	109.3	C60 I94 L96 Y239 A243 K249 K250 I251 L252	I58-C60 WeakPolarHBondContact CG2-SG 3.2Å; I58-I94 CarbonylContact C-O 3.52Å; I58-I94 VanDerWaalsContact CA-O 3.28Å; I58-I94 WeakPolarHBondContact CA-O 3.18Å; I58-L96 HydrophobicContact CG2-CB 4.46Å; I58-Y239 HydrophobicContact CD1-CE1 4.16Å; I58-Y239 HydrophobicContact CG2-CE1 4.49Å; I58-A243 HydrophobicContact CD1-CB 3.5Å; I58-K249 HydrophobicContact CD1-CD 4.18Å; I58-K250 PolarHBondContact N-O 3.4Å; I58-I251 HydrophobicContact CB-CG1 4.34Å; I58-I251 HydrophobicContact CB-CG2 4.39Å; I58-I251 HydrophobicContact CD1-CG1 4.35Å; I58-I251 WeakPolarHBondContact O-CA 3.43Å; I58-L252 PolarHBondContact O-N 2.85Å
59	I	92.6	Very high	84.2	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	115.9	175.3	-55.1	92.7	0	0	0	108.8	A53 A56 P85 I94 S95 L96 L252	A53-I59 HydrophobicContact CB-CG1 4.14Å; A56-I59 HydrophobicContact CB-CD1 4.09Å; A56-I59 HydrophobicContact CB-CG1 3.93Å; I59-P85 HydrophobicContact CB-CB 4.41Å; I59-P85 HydrophobicContact CG2-CB 3.82Å; I59-I94 PolarHBondContact N-O 3.39Å; I59-S95 CarbonylContact O-C 3.6Å; I59-S95 WeakPolarHBondContact O-CA 3.47Å; I59-L96 PolarHBondContact O-N 3.4Å; I59-L252 CarbonylContact C-O 3.56Å; I59-L252 WeakPolarHBondContact CA-O 3.43Å; I59-L252 HydrophobicContact CG1-CB 4.42Å; I59-L252 HydrophobicContact CG1-CD2 4.42Å; I59-L252 HydrophobicContact CG2-CD2 4.49Å
60	C	92.3	Very high	83.4	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	144.4	-172.3	-54.6	0	0	0	0	111.5	I58 L96 L252 V253 E254 L286	I58-C60 WeakPolarHBondContact CG2-SG 3.2Å; C60-L96 CarbonylContact C-O 3.56Å; C60-L96 VanDerWaalsContact CA-O 3.28Å; C60-L96 WeakPolarHBondContact CA-O 3.36Å; C60-L96 HydrophobicContact CB-CB 4.31Å; C60-L252 PolarHBondContact N-O 3.02Å; C60-V253 HydrophobicContact CB-CG2 4.19Å; C60-V253 WeakPolarHBondContact O-CA 3.4Å; C60-E254 PolarHBondContact O-N 2.74Å; C60-L286 HydrophobicContact CB-CD1 3.98Å; C60-L286 HydrophobicContact CB-CD2 3.91Å
61	R	92.1	Very high	82.8	Confident	1 Å²	1	26.3 Å²	26.3	0%	0.004	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	121.8	165	-73.9	-99.3	-65.6	-108.4	0.3	108.5	G65 H82 L83 L84 P85 L96 G98 V101 E254	R61-G65 PolarHBondContact NH2-O 2.77Å; R61-H82 PolarHBondContact NH1-O 2.86Å; R61-H82 PolarHBondContact NH2-O 2.9Å; R61-L83 PolarHBondContact NH1-O 3.41Å; R61-L83 PolarHBondContact NH2-O 2.87Å; R61-L84 PolarHBondContact NH1-O 3Å; R61-L84 VanDerWaalsContact NH1-O 3.07Å; R61-P85 HydrophobicContact CB-CG 4.47Å; R61-P85 HydrophobicContact CG-CB 3.9Å; R61-P85 HydrophobicContact CG-CG 3.68Å; R61-L96 PolarHBondContact N-O 3.33Å; R61-G98 WeakPolarHBondContact O-CA 3.5Å; R61-G98 PolarHBondContact O-N 3.02Å; R61-V101 HydrophobicContact CB-CG2 4.32Å; R61-V101 WeakPolarHBondContact O-CG2 3.45Å; R61-E254 HydrophobicContact CG-CB 4.38Å
62	C	89.3	Confident	82.2	Confident	4 Å²	4	24.7 Å²	24.7	3%	0.027	15%	0.147	C	C	.	.			trans	-94.1	-32	-174.2	58.6	0	0	0	0	113.9	G100 V253 G285 L286	C62-G100 CarbonylContact O-C 3.56Å; C62-G100 WeakPolarHBondContact O-CA 3.44Å; C62-G100 PolarHBondContact O-N 3.45Å; C62-V253 HydrophobicContact CB-CG1 4.07Å; C62-G285 VanDerWaalsContact O-CA 3.26Å; C62-G285 WeakPolarHBondContact O-CA 3.28Å; C62-L286 HydrophobicContact CB-CD1 4.2Å; C62-L286 HydrophobicContact CB-CD2 4.27Å; C62-L286 HydrophobicContact CB-CG 3.83Å
63	Q	88.5	Confident	81.5	Confident	8 Å²	8	26.7 Å²	26.7	4%	0.037	16%	0.161	C	C	.	.	S	Bend	trans	-146.1	172.5	-168.6	-63.4	-68	-10.9	0	0	111.9	G100 A256 N276 G281 T284 G285	Q63-G100 PolarHBondContact OE1-O 3.15Å; Q63-G100 VanDerWaalsContact OE1-O 3.07Å; Q63-A256 VanDerWaalsContact O-CB 3.3Å; Q63-A256 WeakPolarHBondContact O-CB 3.35Å; Q63-N276 WeakPolarHBondContact CG-O 3.42Å; Q63-G281 WeakPolarHBondContact CG-O 3.15Å; Q63-G281 PolarHBondContact NE2-O 3.28Å; Q63-T284 PolarHBondContact NE2-OG1 2.81Å; Q63-T284 VanDerWaalsContact NE2-OG1 3.15Å; Q63-G285 VanDerWaalsContact NE2-CA 3.33Å
64	G	84.3	Confident	80.6	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	82.7	-156.3	176.4	0	0	0	0	0	112.7	V101 V102 Y172	G64-V101 WeakPolarHBondContact O-CA 3.34Å; G64-V101 WeakPolarHBondContact O-CG1 3.5Å; G64-V102 WeakPolarHBondContact O-CG2 3.03Å; G64-V102 PolarHBondContact O-N 3.25Å; G64-Y172 PolarHBondContact N-OH 2.98Å
65	G	81.7	Confident	79.8	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.19	C	C	.	.			trans	-155.5	-140.7	175.9	0	0	0	0	0	111	R61 N67 V102	R61-G65 PolarHBondContact NH2-O 2.77Å; G65-N67 PolarHBondContact N-OD1 3.39Å; G65-N67 PolarHBondContact O-N 3.21Å; G65-N67 PolarHBondContact O-OD1 3.46Å; G65-V102 WeakPolarHBondContact CA-O 3.39Å
66	N	74.5	Confident	79.1	Confident	17 Å²	17	29.9 Å²	29.9	9%	0.091	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	10.9	177.3	64.2	-10.2	0	0	0	113.4	H82 K166	N66-H82 HydrophobicContact CB-CB 4.33Å; N66-K166 HydrophobicContact CB-CD 4.44Å; N66-K166 WeakPolarHBondContact O-CD 3.34Å; N66-K166 WeakPolarHBondContact O-CE 3.4Å; N66-K166 PolarHBondContact O-NZ 2.81Å; N66-K166 WeakPolarHBondContact OD1-CB 3.36Å; N66-K166 WeakPolarHBondContact OD1-CD 3.24Å
67	N	70.9	Confident	78.5	Confident	23 Å²	23	34 Å²	34	12%	0.123	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-23.5	-178.8	62.7	-37.1	0	0	0	114.2	G65 T164 I168 N257	G65-N67 PolarHBondContact N-OD1 3.39Å; G65-N67 PolarHBondContact O-N 3.21Å; G65-N67 PolarHBondContact O-OD1 3.46Å; N67-T164 HydrophobicContact CB-CG2 4.22Å; N67-I168 HydrophobicContact CB-CG1 3.94Å; N67-N257 PolarHBondContact ND2-OD1 3.34Å
68	A	64.1	Low	77.8	Confident	20 Å²	20	36.6 Å²	36.6	17%	0.165	22%	0.224	C	C	.	.			trans	-89.1	131.9	167.7	0	0	0	0	0	108.6	H82	A68-H82 CarbonylContact O-C 3.37Å; A68-H82 VanDerWaalsContact O-CA 3.28Å; A68-H82 WeakPolarHBondContact O-CA 3.38Å; A68-H82 VanDerWaalsContact O-O 3.07Å
69	G	66.3	Low	77.2	Confident	47 Å²	47	36.9 Å²	36.9	49%	0.485	23%	0.225	S	C	.	.			trans	-125.7	136.2	174.3	0	0	0	0	0	109.6	F81	G69-F81 CarbonylContact C-O 3.53Å; G69-F81 VanDerWaalsContact CA-O 3.3Å; G69-F81 WeakPolarHBondContact CA-O 3.44Å
70	H	71.9	Confident	76.7	Confident	18 Å²	18	39.2 Å²	39.2	8%	0.083	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	134.4	173.9	61.7	-95.7	0	0	0	110.1	F81 S86 E254	H70-F81 AromaticContact CD2-CD2 3.71Å; H70-F81 WeakPolarHBondContact CE1-CB 3.5Å; H70-F81 PolarHBondContact N-O 3.24Å; H70-F81 WeakPolarHBondContact NE2-CB 3.24Å; H70-F81 AromaticContact NE2-CD2 3.42Å; H70-F81 WeakPolarHBondContact NE2-CD2 3.26Å; H70-F81 AromaticContact NE2-CG 3.62Å; H70-F81 PolarHBondContact O-N 3.05Å; H70-S86 PolarHBondContact CE1-OG 3.36Å; H70-S86 WeakPolarHBondContact NE2-CA 3.42Å; H70-S86 WeakPolarHBondContact NE2-CB 3.3Å; H70-S86 PolarHBondContact NE2-N 3.12Å; H70-S86 PolarHBondContact NE2-OG 2.9Å; H70-E254 IonicContact CE1-OE1 2.81Å; H70-E254 PolarHBondContact CE1-OE1 2.82Å; H70-E254 IonicContact CE1-OE2 3.98Å; H70-E254 IonicContact CG-OE1 2.7Å; H70-E254 IonicContact ND1-OE1 3.67Å; H70-E254 PolarHBondContact ND1-OE1 2.87Å; H70-E254 IonicContact NE2-OE1 2.65Å
71	T	71.8	Confident	76.2	Confident	59 Å²	59	39.2 Å²	39.2	36%	0.362	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	126.2	175.2	-55.1	0	0	0	0	108.4	E78 Y79 D80	T71-E78 HydrophobicContact CG2-CB 4.14Å; T71-Y79 CarbonylContact C-O 3.56Å; T71-Y79 VanDerWaalsContact CA-O 3.28Å; T71-Y79 WeakPolarHBondContact CA-O 3.49Å; T71-D80 WeakPolarHBondContact CB-OD1 3.32Å; T71-D80 VanDerWaalsContact CG2-OD1 3.31Å; T71-D80 WeakPolarHBondContact CG2-OD1 3.36Å; T71-D80 PolarHBondContact OG1-OD1 2.86Å
72	V	73.3	Confident	75.8	Confident	6 Å²	6	41.4 Å²	41.4	4%	0.036	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	136.6	174.6	-170.3	0	0	0	0	108.5	D50 V74 Y79 F81 I89	D50-V72 HydrophobicContact CB-CG1 4.07Å; V72-V74 HydrophobicContact CG1-CG2 3.87Å; V72-Y79 PolarHBondContact N-O 2.94Å; V72-Y79 PolarHBondContact O-N 2.8Å; V72-F81 HydrophobicContact CB-CE2 4.2Å; V72-F81 HydrophobicContact CG2-CD2 4Å; V72-F81 HydrophobicContact CG2-CE2 4.01Å; V72-I89 HydrophobicContact CB-CD1 3.84Å; V72-I89 HydrophobicContact CG1-CD1 3.74Å; V72-I89 HydrophobicContact CG2-CD1 4.39Å
73	V	71.1	Confident	75.6	Confident	79 Å²	79	41.3 Å²	41.3	48%	0.479	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	114.1	177.1	-170.8	0	0	0	0	108.8	K77 E78	V73-K77 WeakPolarHBondContact CA-O 3.47Å; V73-E78 HydrophobicContact CG1-CG 4.49Å; V73-E78 HydrophobicContact CG2-CG 3.98Å
74	V	67.8	Low	75.6	Confident	34 Å²	34	40.9 Å²	40.9	21%	0.206	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129.3	177.4	-179.2	0	0	0	0	109.1	V72 G76 K77 Y79 I89	V72-V74 HydrophobicContact CG1-CG2 3.87Å; V74-G76 PolarHBondContact O-N 3.05Å; V74-K77 PolarHBondContact N-O 2.81Å; V74-K77 PolarHBondContact O-N 3.17Å; V74-Y79 HydrophobicContact CB-CE2 4.4Å; V74-I89 HydrophobicContact CB-CG2 4.34Å; V74-I89 HydrophobicContact CG1-CG2 4.18Å; V74-I89 HydrophobicContact CG2-CD1 3.8Å; V74-I89 HydrophobicContact CG2-CG2 4Å
75	D	67.1	Low	75.7	Confident	162 Å²	162	40.9 Å²	40.9	87%	0.866	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	38.4	-177.5	-55.6	-37.3	0	0	0	113.5	K77	D75-K77 VanDerWaalsContact C-N 3.27Å; D75-K77 PolarHBondContact O-N 3.25Å
76	G	68.8	Low	75.6	Confident	73 Å²	73	40.9 Å²	40.9	75%	0.753	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.5	6.7	-178.8	0	0	0	0	0	115.3	V74	V74-G76 PolarHBondContact O-N 3.05Å
77	K	76.6	Confident	75.8	Confident	91 Å²	91	40.1 Å²	40.1	40%	0.396	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	133.1	176.7	-65	-176.5	172.4	-165.2	0	111.8	V73 V74 D75 Y79 K118	V73-K77 WeakPolarHBondContact CA-O 3.47Å; V74-K77 PolarHBondContact N-O 2.81Å; V74-K77 PolarHBondContact O-N 3.17Å; D75-K77 VanDerWaalsContact C-N 3.27Å; D75-K77 PolarHBondContact O-N 3.25Å; K77-Y79 HydrophobicContact CB-CE2 3.89Å; K77-K118 WeakPolarHBondContact CD-O 3.48Å; K77-K118 PolarHBondContact NZ-O 3.49Å
78	E	77.7	Confident	76.4	Confident	125 Å²	125	39 Å²	39	58%	0.584	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	114.6	179.1	-53.5	-166.5	151.6	0	0	111.3	T71 V73 K118	T71-E78 HydrophobicContact CG2-CB 4.14Å; V73-E78 HydrophobicContact CG1-CG 4.49Å; V73-E78 HydrophobicContact CG2-CG 3.98Å; E78-K118 VanDerWaalsContact O-CD 3.28Å; E78-K118 WeakPolarHBondContact O-CD 3.4Å; E78-K118 PolarHBondContact O-NZ 2.83Å
79	Y	79	Confident	77.1	Confident	8 Å²	8	39.2 Å²	39.2	3%	0.031	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	134.6	173.6	-61.5	-85.7	0	0	0	109.8	T71 V72 V74 K77 F81 I89 N115 K118 G119 L122	T71-Y79 CarbonylContact C-O 3.56Å; T71-Y79 VanDerWaalsContact CA-O 3.28Å; T71-Y79 WeakPolarHBondContact CA-O 3.49Å; V72-Y79 PolarHBondContact N-O 2.94Å; V72-Y79 PolarHBondContact O-N 2.8Å; V74-Y79 HydrophobicContact CB-CE2 4.4Å; K77-Y79 HydrophobicContact CB-CE2 3.89Å; Y79-F81 HydrophobicContact CG-CZ 4.24Å; Y79-I89 HydrophobicContact CD2-CD1 4.29Å; Y79-N115 HydrophobicContact CD1-CB 4.25Å; Y79-K118 HydrophobicContact CD1-CB 4.34Å; Y79-K118 HydrophobicContact CE1-CB 4.01Å; Y79-G119 WeakPolarHBondContact OH-CA 3.38Å; Y79-L122 HydrophobicContact CD1-CD1 3.79Å; Y79-L122 HydrophobicContact CE1-CD1 3.98Å
80	D	81	Confident	77.8	Confident	49 Å²	49	38.7 Å²	38.7	26%	0.262	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	111.4	-178	-59.5	-58.8	0	0	0	108.8	T71 N115 K118	T71-D80 WeakPolarHBondContact CB-OD1 3.32Å; T71-D80 VanDerWaalsContact CG2-OD1 3.31Å; T71-D80 WeakPolarHBondContact CG2-OD1 3.36Å; T71-D80 PolarHBondContact OG1-OD1 2.86Å; D80-N115 PolarHBondContact N-OD1 2.97Å; D80-N115 PolarHBondContact O-ND2 3.48Å; D80-K118 IonicContact OD2-NZ 2.97Å; D80-K118 PolarHBondContact OD2-NZ 2.85Å
81	F	83.3	Confident	78.2	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	135.8	-179.2	-59.4	-69.8	0	0	0	110	G69 H70 V72 Y79 L84 I88 I89 E111 L122	G69-F81 CarbonylContact C-O 3.53Å; G69-F81 VanDerWaalsContact CA-O 3.3Å; G69-F81 WeakPolarHBondContact CA-O 3.44Å; H70-F81 AromaticContact CD2-CD2 3.71Å; H70-F81 WeakPolarHBondContact CE1-CB 3.5Å; H70-F81 PolarHBondContact N-O 3.24Å; H70-F81 WeakPolarHBondContact NE2-CB 3.24Å; H70-F81 AromaticContact NE2-CD2 3.42Å; H70-F81 WeakPolarHBondContact NE2-CD2 3.26Å; H70-F81 AromaticContact NE2-CG 3.62Å; H70-F81 PolarHBondContact O-N 3.05Å; V72-F81 HydrophobicContact CB-CE2 4.2Å; V72-F81 HydrophobicContact CG2-CD2 4Å; V72-F81 HydrophobicContact CG2-CE2 4.01Å; Y79-F81 HydrophobicContact CG-CZ 4.24Å; F81-L84 HydrophobicContact CD1-CB 3.98Å; F81-L84 HydrophobicContact CD1-CD1 4.44Å; F81-I88 HydrophobicContact CD1-CG2 4.11Å; F81-I88 HydrophobicContact CE1-CG2 3.43Å; F81-I88 VanDerWaalsContact CE1-CG2 3.43Å; F81-I88 HydrophobicContact CZ-CG2 3.86Å; F81-I89 HydrophobicContact CE2-CD1 3.53Å; F81-I89 HydrophobicContact CE2-CG1 3.92Å; F81-I89 HydrophobicContact CZ-CD1 3.75Å; F81-I89 HydrophobicContact CZ-CG1 3.6Å; F81-E111 VanDerWaalsContact CA-OE1 3.24Å; F81-E111 WeakPolarHBondContact CA-OE1 3.41Å; F81-L122 HydrophobicContact CE1-CD1 3.96Å; F81-L122 HydrophobicContact CE1-CD2 4.39Å; F81-L122 HydrophobicContact CZ-CD1 4.01Å
82	H	83.6	Confident	78.7	Confident	46 Å²	46	48.4 Å²	48.4	21%	0.213	27%	0.265	C	S	.	.	S	Bend	trans	-117.2	-62.1	174.9	-66	81.3	0	0	0	110	R61 N66 A68 E111	R61-H82 PolarHBondContact NH1-O 2.86Å; R61-H82 PolarHBondContact NH2-O 2.9Å; N66-H82 HydrophobicContact CB-CB 4.33Å; A68-H82 CarbonylContact O-C 3.37Å; A68-H82 VanDerWaalsContact O-CA 3.28Å; A68-H82 WeakPolarHBondContact O-CA 3.38Å; A68-H82 VanDerWaalsContact O-O 3.07Å; H82-E111 WeakPolarHBondContact CB-OE2 3.29Å; H82-E111 PolarHBondContact N-OE1 3.07Å; H82-E111 PolarHBondContact N-OE2 3.04Å
83	L	85.2	Confident	79.2	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	26%	0.263	C	S	.	.	S	Bend	trans	-95.4	-33.2	-179.6	-161.6	62.4	0	0	0	112.9	R61 I97 V101 I103 L108 E111	R61-L83 PolarHBondContact NH1-O 3.41Å; R61-L83 PolarHBondContact NH2-O 2.87Å; L83-I97 HydrophobicContact CG-CD1 4.27Å; L83-V101 HydrophobicContact CD1-CG1 3.67Å; L83-I103 HydrophobicContact CD2-CB 4.14Å; L83-I103 HydrophobicContact CD2-CG1 4.2Å; L83-I103 HydrophobicContact CD2-CG2 3.76Å; L83-L108 HydrophobicContact CB-CD1 4.2Å; L83-L108 HydrophobicContact CD2-CB 3.97Å; L83-L108 HydrophobicContact CD2-CD1 3.98Å; L83-L108 HydrophobicContact CD2-CG 4.36Å; L83-L108 HydrophobicContact CG-CD1 4.29Å; L83-E111 PolarHBondContact N-OE1 2.65Å; L83-E111 PolarHBondContact N-OE2 2.9Å
84	L	87.2	Confident	80.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.254	C	S	.	.	S	Bend	trans	-69.7	139	178.2	-62	171.5	0	0	0	110.1	R61 F81 I88 L108 E111 L122 W125 L129	R61-L84 PolarHBondContact NH1-O 3Å; R61-L84 VanDerWaalsContact NH1-O 3.07Å; F81-L84 HydrophobicContact CD1-CB 3.98Å; F81-L84 HydrophobicContact CD1-CD1 4.44Å; L84-I88 HydrophobicContact CB-CD1 4.42Å; L84-I88 HydrophobicContact CB-CG2 4.42Å; L84-I88 HydrophobicContact CD1-CD1 4.28Å; L84-I88 HydrophobicContact CD2-CD1 3.89Å; L84-I88 HydrophobicContact CG-CD1 4.43Å; L84-L108 HydrophobicContact CD2-CD1 3.55Å; L84-L108 HydrophobicContact CG-CD1 4.06Å; L84-E111 WeakPolarHBondContact CB-OE1 3.49Å; L84-E111 HydrophobicContact CD1-CG 4.18Å; L84-E111 WeakPolarHBondContact CG-OE1 3.32Å; L84-E111 PolarHBondContact N-OE1 2.81Å; L84-E111 VanDerWaalsContact N-OE1 3.09Å; L84-L122 HydrophobicContact CD1-CD2 4.2Å; L84-W125 HydrophobicContact CD2-CE3 4.1Å; L84-W125 HydrophobicContact CD2-CZ3 4Å; L84-L129 HydrophobicContact CD2-CD1 4.17Å; L84-L129 HydrophobicContact CD2-CD2 3.75Å
85	P	86.2	Confident	81.3	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.244	C	C	.	.			trans	-61.7	142.9	170	-16.9	28.2	0	0	0	111.2	I59 R61 G87 I88 E254	I59-P85 HydrophobicContact CB-CB 4.41Å; I59-P85 HydrophobicContact CG2-CB 3.82Å; R61-P85 HydrophobicContact CB-CG 4.47Å; R61-P85 HydrophobicContact CG-CB 3.9Å; R61-P85 HydrophobicContact CG-CG 3.68Å; P85-G87 PolarHBondContact O-N 3.37Å; P85-G87 VanDerWaalsContact O-N 3.12Å; P85-I88 WeakPolarHBondContact O-CB 3.07Å; P85-I88 WeakPolarHBondContact O-CG2 3.37Å; P85-I88 PolarHBondContact O-N 3.38Å; P85-E254 WeakPolarHBondContact CA-OE2 3.15Å
86	S	80.8	Confident	82.5	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-57.1	-33.3	-179.4	-2.3	0	0	0	0	112.6	V49 H70 I88 I89 E254	V49-S86 WeakPolarHBondContact CG1-OG 3.4Å; H70-S86 PolarHBondContact CE1-OG 3.36Å; H70-S86 WeakPolarHBondContact NE2-CA 3.42Å; H70-S86 WeakPolarHBondContact NE2-CB 3.3Å; H70-S86 PolarHBondContact NE2-N 3.12Å; H70-S86 PolarHBondContact NE2-OG 2.9Å; S86-I88 PolarHBondContact O-N 3.17Å; S86-I89 PolarHBondContact O-N 3.15Å; S86-E254 PolarHBondContact N-OE2 3.32Å; S86-E254 PolarHBondContact OG-OE2 2.99Å; S86-E254 VanDerWaalsContact OG-OE2 3.06Å
87	G	78.2	Confident	83.7	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.01	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-65.4	-5.6	-179.4	0	0	0	0	0	114.7	P85 I89 N90	P85-G87 PolarHBondContact O-N 3.37Å; P85-G87 VanDerWaalsContact O-N 3.12Å; G87-I89 PolarHBondContact O-N 2.88Å; G87-N90 WeakPolarHBondContact O-CB 3.44Å; G87-N90 PolarHBondContact O-N 3.34Å
88	I	82.7	Confident	84.5	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-63.7	-11.3	175.5	-155	164.2	0	0	0	113.1	F81 L84 P85 S86 N90 S95 L122 W125 R128	F81-I88 HydrophobicContact CD1-CG2 4.11Å; F81-I88 HydrophobicContact CE1-CG2 3.43Å; F81-I88 VanDerWaalsContact CE1-CG2 3.43Å; F81-I88 HydrophobicContact CZ-CG2 3.86Å; L84-I88 HydrophobicContact CB-CD1 4.42Å; L84-I88 HydrophobicContact CB-CG2 4.42Å; L84-I88 HydrophobicContact CD1-CD1 4.28Å; L84-I88 HydrophobicContact CD2-CD1 3.89Å; L84-I88 HydrophobicContact CG-CD1 4.43Å; P85-I88 WeakPolarHBondContact O-CB 3.07Å; P85-I88 WeakPolarHBondContact O-CG2 3.37Å; P85-I88 PolarHBondContact O-N 3.38Å; S86-I88 PolarHBondContact O-N 3.17Å; I88-N90 VanDerWaalsContact C-N 3.32Å; I88-S95 WeakPolarHBondContact CA-OG 3.36Å; I88-S95 WeakPolarHBondContact CB-OG 3.15Å; I88-L122 HydrophobicContact CG2-CD2 4.39Å; I88-L122 HydrophobicContact CG2-CG 4.45Å; I88-W125 HydrophobicContact CD1-CB 3.83Å; I88-W125 HydrophobicContact CD1-CE3 4.21Å; I88-W125 HydrophobicContact CG1-CB 4.21Å; I88-R128 PolarHBondContact O-NH1 2.92Å; I88-R128 PolarHBondContact O-NH2 2.92Å; I88-R128 VanDerWaalsContact O-NH2 3.15Å
89	I	79.9	Confident	85.2	Confident	24 Å²	24	25.5 Å²	25.5	12%	0.123	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-71.1	-31.2	170.6	-60.9	163.6	0	0	0	111.2	V72 V74 Y79 F81 S86 G87 T91	V72-I89 HydrophobicContact CB-CD1 3.84Å; V72-I89 HydrophobicContact CG1-CD1 3.74Å; V72-I89 HydrophobicContact CG2-CD1 4.39Å; V74-I89 HydrophobicContact CB-CG2 4.34Å; V74-I89 HydrophobicContact CG1-CG2 4.18Å; V74-I89 HydrophobicContact CG2-CD1 3.8Å; V74-I89 HydrophobicContact CG2-CG2 4Å; Y79-I89 HydrophobicContact CD2-CD1 4.29Å; F81-I89 HydrophobicContact CE2-CD1 3.53Å; F81-I89 HydrophobicContact CE2-CG1 3.92Å; F81-I89 HydrophobicContact CZ-CD1 3.75Å; F81-I89 HydrophobicContact CZ-CG1 3.6Å; S86-I89 PolarHBondContact O-N 3.15Å; G87-I89 PolarHBondContact O-N 2.88Å; I89-T91 PolarHBondContact O-N 3.29Å
90	N	80.4	Confident	85.7	Confident	36 Å²	36	25.1 Å²	25.1	19%	0.193	13%	0.128	C	C	.	.			trans	-71.8	111.6	175.8	-173.9	-3.6	0	0	0	109.7	A53 G87 I88 K92 G93 R128	A53-N90 PolarHBondContact O-ND2 2.87Å; G87-N90 WeakPolarHBondContact O-CB 3.44Å; G87-N90 PolarHBondContact O-N 3.34Å; I88-N90 VanDerWaalsContact C-N 3.32Å; N90-K92 PolarHBondContact O-N 2.82Å; N90-K92 PolarHBondContact OD1-N 3.43Å; N90-K92 VanDerWaalsContact OD1-N 3.07Å; N90-G93 PolarHBondContact O-N 3.04Å; N90-R128 PolarHBondContact O-NH1 2.89Å
91	T	79.8	Confident	86.3	Confident	96 Å²	96	22.9 Å²	22.9	59%	0.589	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-19.9	-178.7	54.3	0	0	0	0	113.4	I89 R128	I89-T91 PolarHBondContact O-N 3.29Å; T91-R128 WeakPolarHBondContact O-CD 3.44Å
92	K	82	Confident	86.7	Confident	185 Å²	185	22.9 Å²	22.9	80%	0.804	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-24.7	176.9	-61.9	-179.4	-179.9	178.1	0	112.9	N90	N90-K92 PolarHBondContact O-N 2.82Å; N90-K92 PolarHBondContact OD1-N 3.43Å; N90-K92 VanDerWaalsContact OD1-N 3.07Å
93	G	84.4	Confident	87.1	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.01	11%	0.105	C	C	.	.	S	Bend	trans	-82.7	148.3	-178	0	0	0	0	0	112.8	D57 N90	D57-G93 CarbonylContact O-C 3.5Å; D57-G93 WeakPolarHBondContact O-CA 3.29Å; N90-G93 PolarHBondContact O-N 3.04Å
94	I	90.7	Very high	87.5	Confident	56 Å²	56	21.3 Å²	21.3	29%	0.287	11%	0.108	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	128.2	172	-60.8	170.4	0	0	0	108.8	D57 I58 I59 I130 Y239	D57-I94 PolarHBondContact O-N 3.09Å; I58-I94 CarbonylContact C-O 3.52Å; I58-I94 VanDerWaalsContact CA-O 3.28Å; I58-I94 WeakPolarHBondContact CA-O 3.18Å; I59-I94 PolarHBondContact N-O 3.39Å; I94-I130 HydrophobicContact CG2-CD1 3.52Å; I94-I130 HydrophobicContact CG2-CG1 3.93Å; I94-Y239 VanDerWaalsContact CD1-OH 3.27Å; I94-Y239 WeakPolarHBondContact CD1-OH 3.28Å; I94-Y239 WeakPolarHBondContact CG2-OH 2.95Å
95	S	92.4	Very high	87.5	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	130	175.5	-69.8	0	0	0	0	110.2	I59 I88 R128 L129 I130	I59-S95 CarbonylContact O-C 3.6Å; I59-S95 WeakPolarHBondContact O-CA 3.47Å; I88-S95 WeakPolarHBondContact CA-OG 3.36Å; I88-S95 WeakPolarHBondContact CB-OG 3.15Å; S95-R128 PolarHBondContact N-O 3Å; S95-L129 CarbonylContact O-C 3.55Å; S95-L129 WeakPolarHBondContact O-CA 3.21Å; S95-I130 PolarHBondContact O-N 3.04Å
96	L	92.9	Very high	87.7	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.005	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	129.5	178.2	178	68.9	0	0	0	111.2	I58 I59 C60 R61 I130 Y239 M240 L286	I58-L96 HydrophobicContact CG2-CB 4.46Å; I59-L96 PolarHBondContact O-N 3.4Å; C60-L96 CarbonylContact C-O 3.56Å; C60-L96 VanDerWaalsContact CA-O 3.28Å; C60-L96 WeakPolarHBondContact CA-O 3.36Å; C60-L96 HydrophobicContact CB-CB 4.31Å; R61-L96 PolarHBondContact N-O 3.33Å; L96-I130 CarbonylContact C-O 3.6Å; L96-I130 WeakPolarHBondContact CA-O 3.42Å; L96-I130 HydrophobicContact CD1-CB 3.79Å; L96-I130 HydrophobicContact CD1-CG2 3.54Å; L96-Y239 HydrophobicContact CD1-CD1 4.33Å; L96-Y239 HydrophobicContact CD2-CD1 4.16Å; L96-M240 HydrophobicContact CD2-CG 3.6Å; L96-M240 HydrophobicContact CD2-SD 3.31Å; L96-M240 WeakPolarHBondContact CD2-SD 3.19Å; L96-L286 HydrophobicContact CD2-CD2 4.31Å
97	I	94.1	Very high	88	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	113.1	166	-60.7	177.6	0	0	0	108.3	L83 V101 I103 L108 L129 I130 V131 S132	L83-I97 HydrophobicContact CG-CD1 4.27Å; I97-V101 HydrophobicContact CG2-CB 3.68Å; I97-V101 HydrophobicContact CG2-CG1 3.74Å; I97-V101 HydrophobicContact CG2-CG2 3.9Å; I97-I103 HydrophobicContact CG2-CD1 3.75Å; I97-I103 HydrophobicContact CG2-CG1 4.12Å; I97-L108 HydrophobicContact CD1-CD1 4.32Å; I97-L129 HydrophobicContact CD1-CD1 4.07Å; I97-L129 HydrophobicContact CD1-CD2 4.28Å; I97-L129 HydrophobicContact CG1-CD1 4.03Å; I97-I130 PolarHBondContact N-O 2.92Å; I97-V131 HydrophobicContact CD1-CG2 4.27Å; I97-S132 VanDerWaalsContact O-CB 3.31Å; I97-S132 WeakPolarHBondContact O-CB 3.43Å; I97-S132 PolarHBondContact O-N 3.5Å
98	G	93	Very high	88.5	Confident	2 Å²	2	24 Å²	24	2%	0.021	13%	0.128	C	C	.	.			trans	-72.6	168.4	-178.2	0	0	0	0	0	114.2	R61 G100 V101 G285	R61-G98 WeakPolarHBondContact O-CA 3.5Å; R61-G98 PolarHBondContact O-N 3.02Å; G98-G100 PolarHBondContact O-N 3.48Å; G98-V101 PolarHBondContact O-N 2.7Å; G98-G285 CarbonylContact C-O 3.57Å; G98-G285 WeakPolarHBondContact CA-O 3.49Å
99	N	93.2	Very high	88.8	Confident	29 Å²	29	24.2 Å²	24.2	16%	0.155	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-19.3	-179.5	64.5	-88.4	0	0	0	113.9	V101 R134 T284 G285	N99-V101 VanDerWaalsContact C-N 3.26Å; N99-R134 HydrophobicContact CB-CB 3.65Å; N99-T284 PolarHBondContact ND2-O 3.45Å; N99-G285 PolarHBondContact N-O 3.4Å; N99-G285 PolarHBondContact OD1-O 3.43Å
100	G	89.1	Confident	89.2	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-15.2	177.4	0	0	0	0	0	113.7	C62 Q63 G98 Y172 G285	C62-G100 CarbonylContact O-C 3.56Å; C62-G100 WeakPolarHBondContact O-CA 3.44Å; C62-G100 PolarHBondContact O-N 3.45Å; Q63-G100 PolarHBondContact OE1-O 3.15Å; Q63-G100 VanDerWaalsContact OE1-O 3.07Å; G98-G100 PolarHBondContact O-N 3.48Å; G100-Y172 PolarHBondContact O-OH 3.23Å; G100-G285 PolarHBondContact N-O 2.84Å; G100-G285 VanDerWaalsContact N-O 3.16Å
101	V	92.8	Very high	89.5	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.006	14%	0.14	C	C	.	.	B	Isolated β-bridge	trans	-79.5	144	-177.9	-177.1	0	0	0	0	111.3	R61 G64 L83 I97 G98 N99 I103 H136	R61-V101 HydrophobicContact CB-CG2 4.32Å; R61-V101 WeakPolarHBondContact O-CG2 3.45Å; G64-V101 WeakPolarHBondContact O-CA 3.34Å; G64-V101 WeakPolarHBondContact O-CG1 3.5Å; L83-V101 HydrophobicContact CD1-CG1 3.67Å; I97-V101 HydrophobicContact CG2-CB 3.68Å; I97-V101 HydrophobicContact CG2-CG1 3.74Å; I97-V101 HydrophobicContact CG2-CG2 3.9Å; G98-V101 PolarHBondContact O-N 2.7Å; N99-V101 VanDerWaalsContact C-N 3.26Å; V101-I103 HydrophobicContact CG1-CG1 4.12Å; V101-H136 PolarHBondContact O-N 2.9Å
102	V	92.3	Very high	89.7	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	123.9	166.7	-61	0	0	0	0	109.7	G64 G65 H136 V138 I168 A171 Y172	G64-V102 WeakPolarHBondContact O-CG2 3.03Å; G64-V102 PolarHBondContact O-N 3.25Å; G65-V102 WeakPolarHBondContact CA-O 3.39Å; V102-H136 CarbonylContact C-O 3.55Å; V102-H136 WeakPolarHBondContact CA-O 3.44Å; V102-H136 HydrophobicContact CG1-CB 4.15Å; V102-V138 HydrophobicContact CB-CG2 3.61Å; V102-V138 HydrophobicContact CG2-CG2 3.78Å; V102-I168 HydrophobicContact CG2-CD1 3.6Å; V102-I168 HydrophobicContact CG2-CG2 4.14Å; V102-A171 HydrophobicContact CB-CB 4.33Å; V102-A171 HydrophobicContact CG1-CB 4.19Å; V102-Y172 HydrophobicContact CG1-CD1 4.39Å; V102-Y172 HydrophobicContact CG1-CD2 4.07Å; V102-Y172 HydrophobicContact CG1-CE1 4.14Å; V102-Y172 HydrophobicContact CG1-CE2 3.82Å; V102-Y172 HydrophobicContact CG1-CG 4.35Å; V102-Y172 HydrophobicContact CG2-CD2 4.44Å; V102-Y172 HydrophobicContact CG2-CE2 3.95Å
103	I	92.5	Very high	89.8	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	118.9	-168	-61	177.5	0	0	0	109.9	L83 I97 V101 L105 L108 V131 A135 H136 L137 V138 V183	L83-I103 HydrophobicContact CD2-CB 4.14Å; L83-I103 HydrophobicContact CD2-CG1 4.2Å; L83-I103 HydrophobicContact CD2-CG2 3.76Å; I97-I103 HydrophobicContact CG2-CD1 3.75Å; I97-I103 HydrophobicContact CG2-CG1 4.12Å; V101-I103 HydrophobicContact CG1-CG1 4.12Å; I103-L105 HydrophobicContact CG2-CD2 3.86Å; I103-L105 HydrophobicContact CG2-CG 4.49Å; I103-L108 HydrophobicContact CG2-CD2 4.22Å; I103-V131 HydrophobicContact CD1-CG1 3.44Å; I103-V131 VanDerWaalsContact CD1-CG1 3.44Å; I103-A135 HydrophobicContact CD1-CB 3.5Å; I103-A135 VanDerWaalsContact CD1-CB 3.5Å; I103-A135 HydrophobicContact CG1-CB 4.12Å; I103-H136 PolarHBondContact N-O 2.87Å; I103-L137 CarbonylContact O-C 3.59Å; I103-L137 WeakPolarHBondContact O-CA 2.88Å; I103-V138 PolarHBondContact O-N 3.27Å; I103-V183 HydrophobicContact CD1-CG2 4.24Å
104	H	92.1	Very high	89.9	Confident	15 Å²	15	21.5 Å²	21.5	7%	0.069	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	108.8	165	-176.4	-120.2	0	0	0	108.6	G107 L108 V138 D140 Q143	H104-G107 PolarHBondContact ND1-N 3.41Å; H104-G107 PolarHBondContact O-N 2.78Å; H104-L108 PolarHBondContact O-N 3.45Å; H104-V138 HydrophobicContact CB-CB 3.99Å; H104-V138 HydrophobicContact CB-CG1 4.41Å; H104-V138 PolarHBondContact CD2-O 3.11Å; H104-D140 IonicContact CD2-OD1 3.5Å; H104-D140 IonicContact CE1-OD1 3.63Å; H104-D140 IonicContact NE2-OD1 3.02Å; H104-D140 PolarHBondContact NE2-OD1 3.12Å; H104-Q143 PolarHBondContact CD2-NE2 3.07Å; H104-Q143 PolarHBondContact CE1-NE2 2.78Å; H104-Q143 VanDerWaalsContact CE1-NE2 3.3Å; H104-Q143 PolarHBondContact ND1-NE2 2.91Å; H104-Q143 PolarHBondContact NE2-NE2 3.31Å
105	L	89.2	Confident	89.4	Confident	3 Å²	3	19 Å²	19	2%	0.016	10%	0.098	C	C	.	.	H	α-helix	trans	-61.6	-47.7	-174	-64.9	172	0	0	0	113.3	I103 G107 L108 F109 L137 L186 L222 F225 L229	I103-L105 HydrophobicContact CG2-CD2 3.86Å; I103-L105 HydrophobicContact CG2-CG 4.49Å; L105-G107 VanDerWaalsContact C-N 3.3Å; L105-G107 PolarHBondContact O-N 3.39Å; L105-L108 PolarHBondContact O-N 3.39Å; L105-F109 WeakPolarHBondContact O-CD2 3.39Å; L105-F109 PolarHBondContact O-N 2.87Å; L105-L137 HydrophobicContact CD1-CD2 3.95Å; L105-L137 HydrophobicContact CD2-CD2 4.15Å; L105-L137 HydrophobicContact CG-CD2 3.93Å; L105-L186 HydrophobicContact CD1-CD2 3.52Å; L105-L222 HydrophobicContact CD1-CD2 3.88Å; L105-F225 HydrophobicContact CB-CB 4.38Å; L105-F225 HydrophobicContact CB-CD2 4.4Å; L105-F225 HydrophobicContact CB-CG 4.35Å; L105-F225 HydrophobicContact CD1-CB 4.22Å; L105-L229 HydrophobicContact CD2-CD1 4.41Å; L105-L229 HydrophobicContact CD2-CD2 3.74Å
106	P	89.3	Confident	89	Confident	39 Å²	39	22.5 Å²	22.5	25%	0.253	11%	0.114	S	C	.	.	H	α-helix	trans	-58.3	-43.9	176.9	-21.7	31.9	0	0	0	111.8	L108 F109 E110 F225	P106-L108 PolarHBondContact O-N 3.23Å; P106-F109 PolarHBondContact O-N 2.95Å; P106-E110 VanDerWaalsContact O-CB 3.26Å; P106-E110 WeakPolarHBondContact O-CB 3.46Å; P106-E110 PolarHBondContact O-N 2.87Å; P106-F225 HydrophobicContact CB-CE2 4.34Å; P106-F225 HydrophobicContact CB-CZ 4.25Å; P106-F225 HydrophobicContact CG-CE2 3.91Å; P106-F225 HydrophobicContact CG-CZ 4.32Å
107	G	86.4	Confident	88.4	Confident	16 Å²	16	31.3 Å²	31.3	17%	0.165	15%	0.153	C	C	.	.	H	α-helix	trans	-64.7	-36.9	178.9	0	0	0	0	0	113.8	H104 L105 E111	H104-G107 PolarHBondContact ND1-N 3.41Å; H104-G107 PolarHBondContact O-N 2.78Å; L105-G107 VanDerWaalsContact C-N 3.3Å; L105-G107 PolarHBondContact O-N 3.39Å; G107-E111 VanDerWaalsContact O-CB 3.22Å; G107-E111 WeakPolarHBondContact O-CB 3.08Å; G107-E111 PolarHBondContact O-N 2.67Å
108	L	89.3	Confident	87.7	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.8	-49.6	176	177.8	61	0	0	0	111.6	L83 L84 I97 I103 H104 L105 P106 E111 G112 L129 L229	L83-L108 HydrophobicContact CB-CD1 4.2Å; L83-L108 HydrophobicContact CD2-CB 3.97Å; L83-L108 HydrophobicContact CD2-CD1 3.98Å; L83-L108 HydrophobicContact CD2-CG 4.36Å; L83-L108 HydrophobicContact CG-CD1 4.29Å; L84-L108 HydrophobicContact CD2-CD1 3.55Å; L84-L108 HydrophobicContact CG-CD1 4.06Å; I97-L108 HydrophobicContact CD1-CD1 4.32Å; I103-L108 HydrophobicContact CG2-CD2 4.22Å; H104-L108 PolarHBondContact O-N 3.45Å; L105-L108 PolarHBondContact O-N 3.39Å; P106-L108 PolarHBondContact O-N 3.23Å; L108-E111 PolarHBondContact O-N 3.46Å; L108-G112 PolarHBondContact O-N 2.85Å; L108-L129 HydrophobicContact CD1-CD2 4.39Å; L108-L229 HydrophobicContact CD2-CD1 4.44Å
109	F	88.7	Confident	86.5	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.018	17%	0.172	C	C	.	.	H	α-helix	trans	-72.1	-38.6	-178.6	-70.8	-64.4	0	0	0	112	L105 P106 E111 G112 D113 W125 F225 R228 L229 M232	L105-F109 WeakPolarHBondContact O-CD2 3.39Å; L105-F109 PolarHBondContact O-N 2.87Å; P106-F109 PolarHBondContact O-N 2.95Å; F109-E111 VanDerWaalsContact C-N 3.31Å; F109-E111 PolarHBondContact O-N 3.08Å; F109-G112 PolarHBondContact O-N 2.87Å; F109-D113 WeakPolarHBondContact O-CB 3.48Å; F109-D113 PolarHBondContact O-N 3.27Å; F109-W125 HydrophobicContact CD1-CH2 4.01Å; F109-W125 HydrophobicContact CD1-CZ2 4.34Å; F109-W125 HydrophobicContact CE1-CH2 4.27Å; F109-F225 HydrophobicContact CB-CE1 4.28Å; F109-F225 AromaticContact CD2-CD1 3.23Å; F109-F225 HydrophobicContact CD2-CD1 3.23Å; F109-F225 AromaticContact CD2-CE1 3.56Å; F109-F225 HydrophobicContact CD2-CE1 3.56Å; F109-F225 HydrophobicContact CD2-CG 4.15Å; F109-F225 HydrophobicContact CE2-CB 4.08Å; F109-F225 AromaticContact CE2-CD1 3.47Å; F109-F225 HydrophobicContact CE2-CD1 3.47Å; F109-F225 VanDerWaalsContact CE2-CD1 3.47Å; F109-F225 HydrophobicContact CE2-CE1 4.27Å; F109-F225 HydrophobicContact CE2-CG 4.11Å; F109-F225 HydrophobicContact CG-CD1 4.18Å; F109-F225 HydrophobicContact CG-CE1 4.21Å; F109-R228 HydrophobicContact CD1-CG 4.35Å; F109-R228 HydrophobicContact CE1-CB 4.24Å; F109-R228 VanDerWaalsContact CE1-CD 3.41Å; F109-R228 HydrophobicContact CE1-CG 3.59Å; F109-R228 HydrophobicContact CZ-CB 3.98Å; F109-R228 HydrophobicContact CZ-CG 3.87Å; F109-L229 HydrophobicContact CZ-CB 4.31Å; F109-L229 HydrophobicContact CZ-CD1 4.32Å; F109-M232 HydrophobicContact CE1-CE 3.98Å; F109-M232 HydrophobicContact CZ-CE 4.25Å
110	E	88.4	Confident	85	Confident	103 Å²	103	38.1 Å²	38.1	48%	0.481	19%	0.192	S	C	.	.	H	α-helix	trans	-61.1	-40.8	174.4	-173.5	-175.5	178.1	0	0	111.6	P106 K114	P106-E110 VanDerWaalsContact O-CB 3.26Å; P106-E110 WeakPolarHBondContact O-CB 3.46Å; P106-E110 PolarHBondContact O-N 2.87Å; E110-K114 HydrophobicContact CG-CD 4.16Å; E110-K114 VanDerWaalsContact O-CB 3.28Å; E110-K114 WeakPolarHBondContact O-CB 3.49Å; E110-K114 WeakPolarHBondContact O-CG 3.33Å; E110-K114 PolarHBondContact O-N 3.26Å; E110-K114 WeakPolarHBondContact OE1-CE 3.47Å; E110-K114 IonicContact OE1-NZ 3.34Å; E110-K114 PolarHBondContact OE1-NZ 3.45Å
111	E	86.7	Confident	83.6	Confident	12 Å²	12	39 Å²	39	6%	0.056	20%	0.2	C	C	.	.	H	α-helix	trans	-63	-47.1	174.1	-179.7	-173.5	157.2	0	0	112	F81 H82 L83 L84 G107 L108 F109 K114 N115	F81-E111 VanDerWaalsContact CA-OE1 3.24Å; F81-E111 WeakPolarHBondContact CA-OE1 3.41Å; H82-E111 WeakPolarHBondContact CB-OE2 3.29Å; H82-E111 PolarHBondContact N-OE1 3.07Å; H82-E111 PolarHBondContact N-OE2 3.04Å; L83-E111 PolarHBondContact N-OE1 2.65Å; L83-E111 PolarHBondContact N-OE2 2.9Å; L84-E111 WeakPolarHBondContact CB-OE1 3.49Å; L84-E111 HydrophobicContact CD1-CG 4.18Å; L84-E111 WeakPolarHBondContact CG-OE1 3.32Å; L84-E111 PolarHBondContact N-OE1 2.81Å; L84-E111 VanDerWaalsContact N-OE1 3.09Å; G107-E111 VanDerWaalsContact O-CB 3.22Å; G107-E111 WeakPolarHBondContact O-CB 3.08Å; G107-E111 PolarHBondContact O-N 2.67Å; L108-E111 PolarHBondContact O-N 3.46Å; F109-E111 VanDerWaalsContact C-N 3.31Å; F109-E111 PolarHBondContact O-N 3.08Å; E111-K114 PolarHBondContact O-N 3.44Å; E111-N115 WeakPolarHBondContact O-CB 3.42Å; E111-N115 PolarHBondContact O-N 2.99Å; E111-N115 PolarHBondContact O-ND2 2.76Å
112	G	83.8	Confident	82.4	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.7	-50.8	176.4	0	0	0	0	0	112.1	L108 F109 K114 N115 E116	L108-G112 PolarHBondContact O-N 2.85Å; F109-G112 PolarHBondContact O-N 2.87Å; G112-K114 PolarHBondContact O-N 3.06Å; G112-N115 PolarHBondContact O-N 3.41Å; G112-E116 WeakPolarHBondContact O-CB 3.26Å; G112-E116 PolarHBondContact O-N 3.1Å
113	D	85.3	Confident	81.2	Confident	56 Å²	56	45.8 Å²	45.8	30%	0.299	23%	0.23	S	C	.	.	H	α-helix	trans	-66.5	-35.8	-177.5	-64.1	-13.9	0	0	0	111.7	F109 K117 R228	F109-D113 WeakPolarHBondContact O-CB 3.48Å; F109-D113 PolarHBondContact O-N 3.27Å; D113-K117 VanDerWaalsContact O-CG 3.31Å; D113-K117 WeakPolarHBondContact O-CG 3.36Å; D113-K117 PolarHBondContact O-N 2.98Å; D113-R228 IonicContact OD1-CZ 2.61Å; D113-R228 IonicContact OD1-NH1 3.36Å; D113-R228 IonicContact OD1-NH2 3.62Å; D113-R228 PolarHBondContact OD1-NH2 3.23Å; D113-R228 IonicContact OD2-NH1 2.9Å; D113-R228 PolarHBondContact OD2-NH1 2.72Å
114	K	84.9	Confident	80.2	Confident	115 Å²	115	47.4 Å²	47.4	50%	0.5	25%	0.247	S	C	.	.	H	α-helix	trans	-65.4	-46.9	173.7	-80.5	174.9	-177.1	170.9	0	111.7	E110 E111 G112 K117 K118	E110-K114 HydrophobicContact CG-CD 4.16Å; E110-K114 VanDerWaalsContact O-CB 3.28Å; E110-K114 WeakPolarHBondContact O-CB 3.49Å; E110-K114 WeakPolarHBondContact O-CG 3.33Å; E110-K114 PolarHBondContact O-N 3.26Å; E110-K114 WeakPolarHBondContact OE1-CE 3.47Å; E110-K114 IonicContact OE1-NZ 3.34Å; E110-K114 PolarHBondContact OE1-NZ 3.45Å; E111-K114 PolarHBondContact O-N 3.44Å; G112-K114 PolarHBondContact O-N 3.06Å; K114-K117 PolarHBondContact O-N 3.13Å; K114-K118 PolarHBondContact O-N 3.41Å
115	N	81.8	Confident	79.7	Confident	3 Å²	3	46.8 Å²	46.8	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-73.7	-31.6	-176.9	-77.1	-37.9	0	0	0	112.3	Y79 D80 E111 G112 K117 K118 L122	Y79-N115 HydrophobicContact CD1-CB 4.25Å; D80-N115 PolarHBondContact N-OD1 2.97Å; D80-N115 PolarHBondContact O-ND2 3.48Å; E111-N115 WeakPolarHBondContact O-CB 3.42Å; E111-N115 PolarHBondContact O-N 2.99Å; E111-N115 PolarHBondContact O-ND2 2.76Å; G112-N115 PolarHBondContact O-N 3.41Å; N115-K117 VanDerWaalsContact C-N 3.32Å; N115-K117 PolarHBondContact O-N 2.82Å; N115-K118 PolarHBondContact O-N 3.2Å; N115-L122 HydrophobicContact CB-CD1 3.87Å; N115-L122 HydrophobicContact CB-CD2 3.79Å; N115-L122 HydrophobicContact CB-CG 4.34Å
116	E	83	Confident	79.3	Confident	73 Å²	73	49.8 Å²	49.8	34%	0.341	26%	0.258	S	S	.	.	H	α-helix	trans	-64	-36.3	172.7	-174.5	168.7	-149.5	0	0	112.3	G112 K118 L122	G112-E116 WeakPolarHBondContact O-CB 3.26Å; G112-E116 PolarHBondContact O-N 3.1Å; E116-K118 VanDerWaalsContact C-N 3.29Å; E116-K118 PolarHBondContact O-N 3.46Å; E116-L122 HydrophobicContact CB-CB 4.41Å
117	K	81.6	Confident	79.1	Confident	186 Å²	186	57.2 Å²	57.2	81%	0.809	29%	0.286	S	S	*	.	H	α-helix	trans	-66.2	-28.7	174.6	-73	171.7	-175.9	176.8	0	113.3	D113 K114 N115	D113-K117 VanDerWaalsContact O-CG 3.31Å; D113-K117 WeakPolarHBondContact O-CG 3.36Å; D113-K117 PolarHBondContact O-N 2.98Å; K114-K117 PolarHBondContact O-N 3.13Å; N115-K117 VanDerWaalsContact C-N 3.32Å; N115-K117 PolarHBondContact O-N 2.82Å
118	K	77.9	Confident	79.2	Confident	78 Å²	78	58 Å²	58	34%	0.339	28%	0.284	S	S	.	.	H	α-helix	trans	-73.3	-32.1	-178.3	-70	-179.8	174.5	-174.7	0	112.5	K77 E78 Y79 D80 K114 N115 E116	K77-K118 WeakPolarHBondContact CD-O 3.48Å; K77-K118 PolarHBondContact NZ-O 3.49Å; E78-K118 VanDerWaalsContact O-CD 3.28Å; E78-K118 WeakPolarHBondContact O-CD 3.4Å; E78-K118 PolarHBondContact O-NZ 2.83Å; Y79-K118 HydrophobicContact CD1-CB 4.34Å; Y79-K118 HydrophobicContact CE1-CB 4.01Å; D80-K118 IonicContact OD2-NZ 2.97Å; D80-K118 PolarHBondContact OD2-NZ 2.85Å; K114-K118 PolarHBondContact O-N 3.41Å; N115-K118 PolarHBondContact O-N 3.2Å; E116-K118 VanDerWaalsContact C-N 3.29Å; E116-K118 PolarHBondContact O-N 3.46Å
119	G	67.6	Low	79.2	Confident	8 Å²	8	58.1 Å²	58.1	8%	0.082	29%	0.285	C	S	.	.			trans	-176.3	170.8	179.6	0	0	0	0	0	116.6	Y79 G121	Y79-G119 WeakPolarHBondContact OH-CA 3.38Å; G119-G121 PolarHBondContact O-N 2.83Å
120	P	61.6	Low	79.5	Confident	88 Å²	88	58.4 Å²	58.4	57%	0.571	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-68.1	-14.7	-175.4	28.9	-34.9	0	0	0	113.9	L122 K123	P120-L122 PolarHBondContact O-N 2.89Å; P120-K123 HydrophobicContact CB-CD 4.32Å; P120-K123 WeakPolarHBondContact O-CB 3.36Å; P120-K123 PolarHBondContact O-N 2.99Å; P120-K123 VanDerWaalsContact O-N 3.08Å
121	G	59.9	Low	79.7	Confident	18 Å²	18	53.5 Å²	53.5	19%	0.186	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-63.4	-23.4	-176.7	0	0	0	0	0	114.7	G119 R128	G119-G121 PolarHBondContact O-N 2.83Å; G121-R128 PolarHBondContact O-NH2 2.78Å
122	L	67.6	Low	80.1	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-100.8	2.7	174	-93.8	99.5	0	0	0	114.6	Y79 F81 L84 I88 N115 E116 P120 G124 W125	Y79-L122 HydrophobicContact CD1-CD1 3.79Å; Y79-L122 HydrophobicContact CE1-CD1 3.98Å; F81-L122 HydrophobicContact CE1-CD1 3.96Å; F81-L122 HydrophobicContact CE1-CD2 4.39Å; F81-L122 HydrophobicContact CZ-CD1 4.01Å; L84-L122 HydrophobicContact CD1-CD2 4.2Å; I88-L122 HydrophobicContact CG2-CD2 4.39Å; I88-L122 HydrophobicContact CG2-CG 4.45Å; N115-L122 HydrophobicContact CB-CD1 3.87Å; N115-L122 HydrophobicContact CB-CD2 3.79Å; N115-L122 HydrophobicContact CB-CG 4.34Å; E116-L122 HydrophobicContact CB-CB 4.41Å; P120-L122 PolarHBondContact O-N 2.89Å; L122-G124 PolarHBondContact O-N 2.98Å; L122-G124 VanDerWaalsContact O-N 3.12Å; L122-W125 HydrophobicContact CB-CB 4.46Å; L122-W125 HydrophobicContact CD2-CB 4.06Å; L122-W125 HydrophobicContact CD2-CG 4.06Å; L122-W125 HydrophobicContact CG-CB 4.38Å; L122-W125 VanDerWaalsContact O-CB 3.3Å; L122-W125 WeakPolarHBondContact O-CB 3.35Å; L122-W125 PolarHBondContact O-N 2.86Å
123	K	67.6	Low	80.6	Confident	145 Å²	145	54.4 Å²	54.4	63%	0.63	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	124.8	177.9	-76.5	-176.7	176.1	-172.8	0	110.4	P120 W125	P120-K123 HydrophobicContact CB-CD 4.32Å; P120-K123 WeakPolarHBondContact O-CB 3.36Å; P120-K123 PolarHBondContact O-N 2.99Å; P120-K123 VanDerWaalsContact O-N 3.08Å; K123-W125 VanDerWaalsContact C-N 3.34Å
124	G	72.4	Confident	81	Confident	34 Å²	34	57.1 Å²	57.1	35%	0.351	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	27.8	-177.9	0	0	0	0	0	114.6	L122 E126 K127	L122-G124 PolarHBondContact O-N 2.98Å; L122-G124 VanDerWaalsContact O-N 3.12Å; G124-E126 PolarHBondContact O-N 3.27Å; G124-K127 PolarHBondContact O-N 2.9Å; G124-K127 VanDerWaalsContact O-N 3.08Å
125	W	80.6	Confident	81.4	Confident	1 Å²	1	51.6 Å²	51.6	0%	0.004	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-54.8	-33.4	173.9	67.8	-90.4	0	0	0	112.7	L84 I88 F109 L122 K123 K127 R128 L129 M232	L84-W125 HydrophobicContact CD2-CE3 4.1Å; L84-W125 HydrophobicContact CD2-CZ3 4Å; I88-W125 HydrophobicContact CD1-CB 3.83Å; I88-W125 HydrophobicContact CD1-CE3 4.21Å; I88-W125 HydrophobicContact CG1-CB 4.21Å; F109-W125 HydrophobicContact CD1-CH2 4.01Å; F109-W125 HydrophobicContact CD1-CZ2 4.34Å; F109-W125 HydrophobicContact CE1-CH2 4.27Å; L122-W125 HydrophobicContact CB-CB 4.46Å; L122-W125 HydrophobicContact CD2-CB 4.06Å; L122-W125 HydrophobicContact CD2-CG 4.06Å; L122-W125 HydrophobicContact CG-CB 4.38Å; L122-W125 VanDerWaalsContact O-CB 3.3Å; L122-W125 WeakPolarHBondContact O-CB 3.35Å; L122-W125 PolarHBondContact O-N 2.86Å; K123-W125 VanDerWaalsContact C-N 3.34Å; W125-K127 PolarHBondContact O-N 2.84Å; W125-K127 VanDerWaalsContact O-N 3.16Å; W125-R128 CarbonylContact O-C 3.51Å; W125-R128 PolarHBondContact O-N 2.78Å; W125-L129 HydrophobicContact CE3-CB 4.3Å; W125-L129 HydrophobicContact CE3-CD2 4.08Å; W125-L129 HydrophobicContact CZ3-CD2 3.61Å; W125-L129 PolarHBondContact O-N 3.41Å; W125-M232 HydrophobicContact CZ3-SD 4.2Å
126	E	81.3	Confident	82	Confident	67 Å²	67	52.5 Å²	52.5	31%	0.313	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-57.9	-28.5	176.3	-61.1	-178	164.8	0	0	113	G124 R128 R228 M232	G124-E126 PolarHBondContact O-N 3.27Å; E126-R128 VanDerWaalsContact C-N 3.3Å; E126-R128 PolarHBondContact O-N 2.79Å; E126-R228 IonicContact OE1-CZ 2.82Å; E126-R228 VanDerWaalsContact OE1-CZ 3.27Å; E126-R228 IonicContact OE1-NE 2.9Å; E126-R228 PolarHBondContact OE1-NE 2.93Å; E126-R228 IonicContact OE1-NH2 3.21Å; E126-R228 PolarHBondContact OE1-NH2 3.25Å; E126-M232 HydrophobicContact CB-CE 4.48Å; E126-M232 HydrophobicContact CB-SD 4.08Å; E126-M232 HydrophobicContact CG-CE 4.42Å; E126-M232 HydrophobicContact CG-SD 4.33Å; E126-M232 WeakPolarHBondContact O-CG 3.42Å
127	K	84.7	Confident	82.5	Confident	195 Å²	195	49.2 Å²	49.2	85%	0.848	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-79.1	-15.9	177.6	-62.9	-176	-179.5	-179.1	0	113.3	G124 W125	G124-K127 PolarHBondContact O-N 2.9Å; G124-K127 VanDerWaalsContact O-N 3.08Å; W125-K127 PolarHBondContact O-N 2.84Å; W125-K127 VanDerWaalsContact O-N 3.16Å
128	R	87.9	Confident	83	Confident	31 Å²	31	40.5 Å²	40.5	12%	0.117	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-9.9	-173.2	-60.5	-179.5	-68.2	127.5	-2.8	112.2	I88 N90 T91 S95 G121 W125 E126	I88-R128 PolarHBondContact O-NH1 2.92Å; I88-R128 PolarHBondContact O-NH2 2.92Å; I88-R128 VanDerWaalsContact O-NH2 3.15Å; N90-R128 PolarHBondContact O-NH1 2.89Å; T91-R128 WeakPolarHBondContact O-CD 3.44Å; S95-R128 PolarHBondContact N-O 3Å; G121-R128 PolarHBondContact O-NH2 2.78Å; W125-R128 CarbonylContact O-C 3.51Å; W125-R128 PolarHBondContact O-N 2.78Å; E126-R128 VanDerWaalsContact C-N 3.3Å; E126-R128 PolarHBondContact O-N 2.79Å
129	L	90.9	Very high	83.6	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.016	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	128.5	173.9	-173.3	67.7	0	0	0	109.9	L84 S95 I97 L108 W125 V131 M232	L84-L129 HydrophobicContact CD2-CD1 4.17Å; L84-L129 HydrophobicContact CD2-CD2 3.75Å; S95-L129 CarbonylContact O-C 3.55Å; S95-L129 WeakPolarHBondContact O-CA 3.21Å; I97-L129 HydrophobicContact CD1-CD1 4.07Å; I97-L129 HydrophobicContact CD1-CD2 4.28Å; I97-L129 HydrophobicContact CG1-CD1 4.03Å; L108-L129 HydrophobicContact CD1-CD2 4.39Å; W125-L129 HydrophobicContact CE3-CB 4.3Å; W125-L129 HydrophobicContact CE3-CD2 4.08Å; W125-L129 HydrophobicContact CZ3-CD2 3.61Å; W125-L129 PolarHBondContact O-N 3.41Å; L129-V131 HydrophobicContact CD2-CG2 3.99Å; L129-V131 HydrophobicContact CG-CG2 4.09Å; L129-M232 HydrophobicContact CB-SD 4.22Å; L129-M232 HydrophobicContact CD2-SD 4.07Å; L129-M232 WeakPolarHBondContact O-CG 3.28Å
130	I	93.3	Very high	84.6	Confident	10 Å²	10	39.3 Å²	39.3	5%	0.051	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	132.6	168	-59.8	175.9	0	0	0	107.4	I94 S95 L96 I97 M232 R234 Y239	I94-I130 HydrophobicContact CG2-CD1 3.52Å; I94-I130 HydrophobicContact CG2-CG1 3.93Å; S95-I130 PolarHBondContact O-N 3.04Å; L96-I130 CarbonylContact C-O 3.6Å; L96-I130 WeakPolarHBondContact CA-O 3.42Å; L96-I130 HydrophobicContact CD1-CB 3.79Å; L96-I130 HydrophobicContact CD1-CG2 3.54Å; I97-I130 PolarHBondContact N-O 2.92Å; I130-M232 CarbonylContact C-O 3.52Å; I130-M232 VanDerWaalsContact CA-O 3.31Å; I130-M232 WeakPolarHBondContact CA-O 3.33Å; I130-R234 HydrophobicContact CG2-CB 3.87Å; I130-R234 HydrophobicContact CG2-CG 4.04Å; I130-Y239 HydrophobicContact CD1-CD1 4.36Å; I130-Y239 HydrophobicContact CD1-CD2 4.01Å; I130-Y239 HydrophobicContact CD1-CE1 3.83Å; I130-Y239 HydrophobicContact CD1-CE2 3.42Å; I130-Y239 VanDerWaalsContact CD1-CE2 3.42Å; I130-Y239 HydrophobicContact CD1-CG 4.44Å
131	V	94.1	Very high	85.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	129.3	176.4	-178.8	0	0	0	0	108.5	I97 I103 L129 D133 V183 L229 M232 V233 R234	I97-V131 HydrophobicContact CD1-CG2 4.27Å; I103-V131 HydrophobicContact CD1-CG1 3.44Å; I103-V131 VanDerWaalsContact CD1-CG1 3.44Å; L129-V131 HydrophobicContact CD2-CG2 3.99Å; L129-V131 HydrophobicContact CG-CG2 4.09Å; V131-D133 PolarHBondContact O-N 3.16Å; V131-V183 HydrophobicContact CG1-CG2 4.24Å; V131-L229 HydrophobicContact CG2-CD1 4.19Å; V131-M232 HydrophobicContact CG2-CB 4.42Å; V131-M232 PolarHBondContact N-O 2.86Å; V131-V233 HydrophobicContact CB-CG2 4.37Å; V131-V233 WeakPolarHBondContact O-CA 3.39Å; V131-R234 PolarHBondContact O-N 2.86Å
132	S	95.1	Very high	87.3	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	127.5	172.8	178.3	0	0	0	0	110.2	I97 R134 A135	I97-S132 VanDerWaalsContact O-CB 3.31Å; I97-S132 WeakPolarHBondContact O-CB 3.43Å; I97-S132 PolarHBondContact O-N 3.5Å; S132-R134 PolarHBondContact O-N 2.76Å; S132-R134 VanDerWaalsContact O-N 3.14Å; S132-R134 PolarHBondContact OG-N 2.81Å; S132-A135 WeakPolarHBondContact O-CB 3.18Å; S132-A135 PolarHBondContact O-N 3.22Å; S132-A135 VanDerWaalsContact O-N 3.09Å
133	D	93.8	Very high	88.2	Confident	32 Å²	32	37 Å²	37	17%	0.171	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-27.5	168.1	67.6	-30.8	0	0	0	114	V131 V183 C184 V233 R234	V131-D133 PolarHBondContact O-N 3.16Å; D133-V183 CarbonylContact O-C 3.36Å; D133-V183 WeakPolarHBondContact O-CB 3.48Å; D133-V183 PolarHBondContact O-N 3.08Å; D133-C184 HydrophobicContact CB-CB 4.14Å; D133-C184 WeakPolarHBondContact O-CB 3.13Å; D133-C184 PolarHBondContact O-N 2.84Å; D133-V233 HydrophobicContact CB-CG1 3.72Å; D133-R234 PolarHBondContact N-O 3.23Å; D133-R234 VanDerWaalsContact N-O 3.08Å
134	R	93.4	Very high	89.1	Confident	112 Å²	112	33.7 Å²	33.7	42%	0.423	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-3.3	-179	-66.9	167.5	-166.9	-109.2	1.9	114.2	N99 S132 D235	N99-R134 HydrophobicContact CB-CB 3.65Å; S132-R134 PolarHBondContact O-N 2.76Å; S132-R134 VanDerWaalsContact O-N 3.14Å; S132-R134 PolarHBondContact OG-N 2.81Å; R134-D235 IonicContact NH2-OD2 3.42Å
135	A	93.8	Very high	89.7	Confident	0 Å²	0	32 Å²	32	0%	0	15%	0.149	C	C	.	.	P	Polyproline II helix	trans	-64.3	142.2	175.3	0	0	0	0	0	110.7	I103 S132 R182 V183	I103-A135 HydrophobicContact CD1-CB 3.5Å; I103-A135 VanDerWaalsContact CD1-CB 3.5Å; I103-A135 HydrophobicContact CG1-CB 4.12Å; S132-A135 WeakPolarHBondContact O-CB 3.18Å; S132-A135 PolarHBondContact O-N 3.22Å; S132-A135 VanDerWaalsContact O-N 3.09Å; A135-R182 CarbonylContact O-C 3.53Å; A135-R182 WeakPolarHBondContact O-CA 3.42Å; A135-R182 WeakPolarHBondContact O-CB 3.33Å; A135-V183 HydrophobicContact CB-CG2 4.14Å; A135-V183 PolarHBondContact O-N 3.19Å
136	H	94.8	Very high	89.9	Confident	22 Å²	22	32.3 Å²	32.3	10%	0.102	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	150.1	-179.5	-79.4	63.6	0	0	0	111	V101 V102 I103 K175	V101-H136 PolarHBondContact O-N 2.9Å; V102-H136 CarbonylContact C-O 3.55Å; V102-H136 WeakPolarHBondContact CA-O 3.44Å; V102-H136 HydrophobicContact CG1-CB 4.15Å; I103-H136 PolarHBondContact N-O 2.87Å; H136-K175 WeakPolarHBondContact NE2-CG 3.3Å
137	L	93.1	Very high	90	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.021	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	134.1	178.9	-62.5	175.6	0	0	0	111.1	I103 L105 F139 L181 V183 L186 F193	I103-L137 CarbonylContact O-C 3.59Å; I103-L137 WeakPolarHBondContact O-CA 2.88Å; L105-L137 HydrophobicContact CD1-CD2 3.95Å; L105-L137 HydrophobicContact CD2-CD2 4.15Å; L105-L137 HydrophobicContact CG-CD2 3.93Å; L137-F139 HydrophobicContact CB-CE1 4.06Å; L137-F139 HydrophobicContact CB-CE2 4.25Å; L137-F139 HydrophobicContact CB-CZ 3.79Å; L137-F139 HydrophobicContact CD1-CE1 4.24Å; L137-F139 HydrophobicContact CD1-CZ 4.09Å; L137-L181 PolarHBondContact N-O 3.36Å; L137-V183 HydrophobicContact CD2-CG2 3.88Å; L137-L186 HydrophobicContact CD1-CB 4.04Å; L137-L186 HydrophobicContact CD1-CD2 4.15Å; L137-F193 HydrophobicContact CD1-CE2 4.27Å
138	V	92.5	Very high	90	Very high	3 Å²	3	22.7 Å²	22.7	2%	0.018	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	124.1	165.9	-174.6	0	0	0	0	107.1	V102 I103 H104 H142 A171	V102-V138 HydrophobicContact CB-CG2 3.61Å; V102-V138 HydrophobicContact CG2-CG2 3.78Å; I103-V138 PolarHBondContact O-N 3.27Å; H104-V138 HydrophobicContact CB-CB 3.99Å; H104-V138 HydrophobicContact CB-CG1 4.41Å; H104-V138 PolarHBondContact CD2-O 3.11Å; V138-H142 HydrophobicContact CG1-CB 4.15Å; V138-A171 HydrophobicContact CG2-CB 3.88Å
139	F	90.8	Very high	89.6	Confident	6 Å²	6	23.3 Å²	23.3	3%	0.026	12%	0.118	C	C	.	.	P	Polyproline II helix	trans	-100.7	163.2	175.1	-60.1	-64.5	0	0	0	111	L137 F141 H142 L181 F193 F197 L200 L222	L137-F139 HydrophobicContact CB-CE1 4.06Å; L137-F139 HydrophobicContact CB-CE2 4.25Å; L137-F139 HydrophobicContact CB-CZ 3.79Å; L137-F139 HydrophobicContact CD1-CE1 4.24Å; L137-F139 HydrophobicContact CD1-CZ 4.09Å; F139-F141 VanDerWaalsContact C-N 3.26Å; F139-F141 HydrophobicContact CB-CD1 3.58Å; F139-F141 HydrophobicContact CB-CE1 3.26Å; F139-F141 HydrophobicContact CB-CE2 4.46Å; F139-F141 HydrophobicContact CB-CG 4.31Å; F139-F141 HydrophobicContact CB-CZ 3.76Å; F139-F141 AromaticContact CD2-CE1 3.66Å; F139-F141 HydrophobicContact CD2-CE1 3.66Å; F139-F141 AromaticContact CD2-CZ 3.52Å; F139-F141 HydrophobicContact CD2-CZ 3.52Å; F139-F141 HydrophobicContact CE2-CZ 4.48Å; F139-F141 HydrophobicContact CG-CD1 4.4Å; F139-F141 AromaticContact CG-CE1 3.63Å; F139-F141 HydrophobicContact CG-CE1 3.63Å; F139-F141 AromaticContact CG-CZ 3.96Å; F139-F141 HydrophobicContact CG-CZ 3.96Å; F139-F141 PolarHBondContact O-N 3.33Å; F139-H142 AromaticContact CD2-CE1 3.8Å; F139-H142 PolarHBondContact N-ND1 2.7Å; F139-H142 WeakPolarHBondContact O-CB 3.21Å; F139-H142 PolarHBondContact O-N 3.21Å; F139-L181 HydrophobicContact CE2-CB 3.98Å; F139-L181 HydrophobicContact CE2-CD1 3.85Å; F139-L181 HydrophobicContact CE2-CG 4.21Å; F139-L181 HydrophobicContact CZ-CB 3.89Å; F139-L181 HydrophobicContact CZ-CD1 3.7Å; F139-L181 HydrophobicContact CZ-CG 4.3Å; F139-F193 HydrophobicContact CE1-CZ 4.23Å; F139-F193 HydrophobicContact CZ-CE2 4.46Å; F139-F193 HydrophobicContact CZ-CZ 4.13Å; F139-F197 HydrophobicContact CB-CE2 4.47Å; F139-F197 HydrophobicContact CD1-CD2 4.32Å; F139-F197 AromaticContact CD1-CE2 3.63Å; F139-F197 HydrophobicContact CD1-CE2 3.63Å; F139-F197 HydrophobicContact CD2-CD2 4.45Å; F139-F197 HydrophobicContact CD2-CE2 4.09Å; F139-F197 AromaticContact CE1-CD2 4Å; F139-F197 HydrophobicContact CE1-CD2 4Å; F139-F197 AromaticContact CE1-CE2 3.75Å; F139-F197 HydrophobicContact CE1-CE2 3.75Å; F139-F197 HydrophobicContact CE2-CD2 4.14Å; F139-F197 HydrophobicContact CE2-CE2 4.2Å; F139-F197 AromaticContact CG-CE2 3.8Å; F139-F197 HydrophobicContact CG-CE2 3.8Å; F139-F197 AromaticContact CZ-CD2 3.9Å; F139-F197 HydrophobicContact CZ-CD2 3.9Å; F139-F197 HydrophobicContact CZ-CE2 4.04Å; F139-L200 HydrophobicContact CD2-CD2 4.22Å; F139-L200 HydrophobicContact CE2-CD2 4.04Å; F139-L222 HydrophobicContact CD1-CD1 3.99Å; F139-L222 HydrophobicContact CD1-CD2 4.28Å; F139-L222 HydrophobicContact CE1-CD1 3.68Å; F139-L222 HydrophobicContact CE1-CD2 4.03Å
140	D	88.3	Confident	89	Confident	54 Å²	54	23.7 Å²	23.7	29%	0.289	12%	0.119	S	C	.	.	H	α-helix	trans	-62.5	-35.9	-177.4	-60.2	-26.6	0	0	0	111.7	H104 H142 Q143 V144	H104-D140 IonicContact CD2-OD1 3.5Å; H104-D140 IonicContact CE1-OD1 3.63Å; H104-D140 IonicContact NE2-OD1 3.02Å; H104-D140 PolarHBondContact NE2-OD1 3.12Å; D140-H142 VanDerWaalsContact C-N 3.27Å; D140-H142 PolarHBondContact O-N 3.17Å; D140-Q143 WeakPolarHBondContact O-CB 3.09Å; D140-Q143 PolarHBondContact O-N 2.8Å; D140-V144 PolarHBondContact O-N 3.37Å
141	F	87	Confident	88.3	Confident	2 Å²	2	27 Å²	27	1%	0.009	14%	0.14	C	C	.	.	H	α-helix	trans	-65	-28.7	175.4	66.5	-100.2	0	0	0	112.7	F139 Q143 V144 V145 F197 L200 V201 Y204 L211 V213	F139-F141 VanDerWaalsContact C-N 3.26Å; F139-F141 HydrophobicContact CB-CD1 3.58Å; F139-F141 HydrophobicContact CB-CE1 3.26Å; F139-F141 HydrophobicContact CB-CE2 4.46Å; F139-F141 HydrophobicContact CB-CG 4.31Å; F139-F141 HydrophobicContact CB-CZ 3.76Å; F139-F141 AromaticContact CD2-CE1 3.66Å; F139-F141 HydrophobicContact CD2-CE1 3.66Å; F139-F141 AromaticContact CD2-CZ 3.52Å; F139-F141 HydrophobicContact CD2-CZ 3.52Å; F139-F141 HydrophobicContact CE2-CZ 4.48Å; F139-F141 HydrophobicContact CG-CD1 4.4Å; F139-F141 AromaticContact CG-CE1 3.63Å; F139-F141 HydrophobicContact CG-CE1 3.63Å; F139-F141 AromaticContact CG-CZ 3.96Å; F139-F141 HydrophobicContact CG-CZ 3.96Å; F139-F141 PolarHBondContact O-N 3.33Å; F141-Q143 VanDerWaalsContact C-N 3.26Å; F141-Q143 PolarHBondContact O-N 3.17Å; F141-V144 PolarHBondContact O-N 2.91Å; F141-V145 WeakPolarHBondContact O-CB 3.08Å; F141-V145 VanDerWaalsContact O-CG2 3.24Å; F141-V145 WeakPolarHBondContact O-CG2 3.43Å; F141-V145 PolarHBondContact O-N 3.26Å; F141-F197 HydrophobicContact CD1-CZ 4.38Å; F141-F197 AromaticContact CE1-CE2 3.69Å; F141-F197 HydrophobicContact CE1-CE2 3.69Å; F141-F197 AromaticContact CE1-CZ 3.91Å; F141-F197 HydrophobicContact CE1-CZ 3.91Å; F141-L200 HydrophobicContact CE2-CD2 4.41Å; F141-L200 HydrophobicContact CE2-CG 4.3Å; F141-L200 HydrophobicContact CZ-CD2 3.77Å; F141-L200 HydrophobicContact CZ-CG 3.93Å; F141-V201 HydrophobicContact CD1-CG2 4.09Å; F141-V201 HydrophobicContact CE1-CG2 3.85Å; F141-V201 HydrophobicContact CZ-CG2 4.4Å; F141-Y204 HydrophobicContact CD2-CD2 4.06Å; F141-Y204 HydrophobicContact CD2-CG 4.33Å; F141-Y204 AromaticContact CE2-CD2 3.54Å; F141-Y204 HydrophobicContact CE2-CD2 3.54Å; F141-Y204 AromaticContact CE2-CE2 3.8Å; F141-Y204 HydrophobicContact CE2-CE2 3.8Å; F141-Y204 HydrophobicContact CE2-CG 4.26Å; F141-L211 HydrophobicContact CB-CD1 4.29Å; F141-L211 HydrophobicContact CB-CD2 4.13Å; F141-V213 HydrophobicContact CB-CG2 3.77Å; F141-V213 HydrophobicContact CD1-CG1 4.49Å
142	H	89.6	Confident	87.5	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-63.3	-35.2	172.4	-68.8	150.5	0	0	0	111.2	V138 F139 D140 D146 G167 P170 S174 Y204	V138-H142 HydrophobicContact CG1-CB 4.15Å; F139-H142 AromaticContact CD2-CE1 3.8Å; F139-H142 PolarHBondContact N-ND1 2.7Å; F139-H142 WeakPolarHBondContact O-CB 3.21Å; F139-H142 PolarHBondContact O-N 3.21Å; D140-H142 VanDerWaalsContact C-N 3.27Å; D140-H142 PolarHBondContact O-N 3.17Å; H142-D146 WeakPolarHBondContact O-CB 3.47Å; H142-D146 PolarHBondContact O-N 2.67Å; H142-G167 VanDerWaalsContact O-CA 3.29Å; H142-G167 WeakPolarHBondContact O-CA 3.48Å; H142-P170 HydrophobicContact CB-CB 4.09Å; H142-S174 PolarHBondContact NE2-OG 3.34Å; H142-Y204 AromaticContact CD2-CE2 3.8Å; H142-Y204 AromaticContact CD2-CZ 3.78Å; H142-Y204 AromaticContact NE2-CE2 3.52Å; H142-Y204 AromaticContact NE2-CZ 3.81Å
143	Q	87.3	Confident	86.5	Confident	54 Å²	54	36 Å²	36	25%	0.252	18%	0.178	S	C	.	.	H	α-helix	trans	-68.3	-41.2	176.7	-54.3	-171.7	-12.4	0	0	111.4	H104 D140 F141 D146 G147	H104-Q143 PolarHBondContact CD2-NE2 3.07Å; H104-Q143 PolarHBondContact CE1-NE2 2.78Å; H104-Q143 VanDerWaalsContact CE1-NE2 3.3Å; H104-Q143 PolarHBondContact ND1-NE2 2.91Å; H104-Q143 PolarHBondContact NE2-NE2 3.31Å; D140-Q143 WeakPolarHBondContact O-CB 3.09Å; D140-Q143 PolarHBondContact O-N 2.8Å; F141-Q143 VanDerWaalsContact C-N 3.26Å; F141-Q143 PolarHBondContact O-N 3.17Å; Q143-D146 PolarHBondContact O-N 2.98Å; Q143-G147 PolarHBondContact O-N 3.36Å; Q143-G147 VanDerWaalsContact O-N 3.17Å
144	V	86.6	Confident	85.4	Confident	76 Å²	76	39.4 Å²	39.4	46%	0.461	19%	0.193	S	C	.	.	H	α-helix	trans	-64	-47.4	176.1	-178.7	0	0	0	0	110.7	D140 F141 D146 G147 L148 L211	D140-V144 PolarHBondContact O-N 3.37Å; F141-V144 PolarHBondContact O-N 2.91Å; V144-D146 VanDerWaalsContact C-N 3.34Å; V144-D146 PolarHBondContact O-N 3.17Å; V144-G147 WeakPolarHBondContact O-CA 3.34Å; V144-G147 PolarHBondContact O-N 3.07Å; V144-G147 VanDerWaalsContact O-N 3.1Å; V144-L148 HydrophobicContact CG1-CD1 4.16Å; V144-L148 HydrophobicContact CG1-CG 4.42Å; V144-L148 WeakPolarHBondContact O-CG 3.45Å; V144-L148 PolarHBondContact O-N 2.92Å; V144-L211 HydrophobicContact CB-CD1 3.83Å; V144-L211 HydrophobicContact CG1-CD1 3.57Å
145	V	85.5	Confident	84.2	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.1	-40.7	178.3	171.5	0	0	0	0	111.7	F141 G147 L148 Q149 P170 Y204 Y208 L211	F141-V145 WeakPolarHBondContact O-CB 3.08Å; F141-V145 VanDerWaalsContact O-CG2 3.24Å; F141-V145 WeakPolarHBondContact O-CG2 3.43Å; F141-V145 PolarHBondContact O-N 3.26Å; V145-G147 VanDerWaalsContact C-N 3.29Å; V145-G147 PolarHBondContact O-N 2.68Å; V145-L148 PolarHBondContact O-N 3.12Å; V145-Q149 HydrophobicContact CG1-CG 4.21Å; V145-Q149 WeakPolarHBondContact O-CB 3.41Å; V145-Q149 WeakPolarHBondContact O-CG 2.91Å; V145-Q149 PolarHBondContact O-N 2.99Å; V145-P170 HydrophobicContact CB-CG 4.4Å; V145-P170 HydrophobicContact CG1-CB 4.39Å; V145-P170 HydrophobicContact CG1-CG 4.07Å; V145-Y204 HydrophobicContact CG1-CD1 4.21Å; V145-Y204 HydrophobicContact CG1-CE1 4.11Å; V145-Y204 HydrophobicContact CG2-CD1 3.92Å; V145-Y204 HydrophobicContact CG2-CE1 4.46Å; V145-Y208 HydrophobicContact CG1-CD2 3.97Å; V145-Y208 HydrophobicContact CG1-CE2 3.56Å; V145-Y208 HydrophobicContact CG2-CD2 4.09Å; V145-Y208 HydrophobicContact CG2-CE2 4.5Å; V145-L211 HydrophobicContact CG2-CD1 4.19Å; V145-L211 HydrophobicContact CG2-CD2 3.93Å
146	D	84.8	Confident	82.8	Confident	7 Å²	7	45.7 Å²	45.7	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-58.8	-41.5	174.6	-171.2	11.9	0	0	0	111.2	H142 Q143 V144 E150 T163 K165 K166 G167 P170	H142-D146 WeakPolarHBondContact O-CB 3.47Å; H142-D146 PolarHBondContact O-N 2.67Å; Q143-D146 PolarHBondContact O-N 2.98Å; V144-D146 VanDerWaalsContact C-N 3.34Å; V144-D146 PolarHBondContact O-N 3.17Å; D146-E150 PolarHBondContact O-N 2.92Å; D146-T163 VanDerWaalsContact OD1-CB 3.26Å; D146-T163 WeakPolarHBondContact OD1-CB 3.34Å; D146-T163 PolarHBondContact OD1-OG1 3.01Å; D146-K165 WeakPolarHBondContact OD2-CA 3.37Å; D146-K165 PolarHBondContact OD2-N 2.95Å; D146-K166 PolarHBondContact OD2-N 2.88Å; D146-G167 PolarHBondContact OD2-N 3.14Å; D146-P170 HydrophobicContact CB-CG 3.97Å
147	G	83.4	Confident	81.1	Confident	14 Å²	14	50.9 Å²	50.9	14%	0.144	27%	0.266	C	S	.	.	H	α-helix	trans	-67	-37.7	174.3	0	0	0	0	0	114.3	Q143 V144 V145 T151	Q143-G147 PolarHBondContact O-N 3.36Å; Q143-G147 VanDerWaalsContact O-N 3.17Å; V144-G147 WeakPolarHBondContact O-CA 3.34Å; V144-G147 PolarHBondContact O-N 3.07Å; V144-G147 VanDerWaalsContact O-N 3.1Å; V145-G147 VanDerWaalsContact C-N 3.29Å; V145-G147 PolarHBondContact O-N 2.68Å; G147-T151 PolarHBondContact O-N 3.06Å; G147-T151 PolarHBondContact O-OG1 3.45Å
148	L	83.3	Confident	79.6	Confident	45 Å²	45	53.8 Å²	53.8	24%	0.236	30%	0.297	C	S	.	.	H	α-helix	trans	-68.8	-47.1	177.5	-70.2	174.1	0	0	0	111.5	V144 V145 E150 T151 E152	V144-L148 HydrophobicContact CG1-CD1 4.16Å; V144-L148 HydrophobicContact CG1-CG 4.42Å; V144-L148 WeakPolarHBondContact O-CG 3.45Å; V144-L148 PolarHBondContact O-N 2.92Å; V145-L148 PolarHBondContact O-N 3.12Å; L148-E150 VanDerWaalsContact C-N 3.25Å; L148-E150 PolarHBondContact O-N 3.12Å; L148-T151 WeakPolarHBondContact O-CA 3.23Å; L148-T151 WeakPolarHBondContact O-CB 3.28Å; L148-T151 PolarHBondContact O-N 2.86Å; L148-E152 PolarHBondContact O-N 3.48Å
149	Q	80.5	Confident	78.1	Confident	45 Å²	45	59.4 Å²	59.4	21%	0.21	32%	0.321	C	S	.	.	H	α-helix	trans	-56.5	-40	177.7	-77.3	-178.2	-7.2	0	0	112.3	V145 T151 R153 Y208	V145-Q149 HydrophobicContact CG1-CG 4.21Å; V145-Q149 WeakPolarHBondContact O-CB 3.41Å; V145-Q149 WeakPolarHBondContact O-CG 2.91Å; V145-Q149 PolarHBondContact O-N 2.99Å; Q149-T151 VanDerWaalsContact C-N 3.34Å; Q149-R153 WeakPolarHBondContact O-CB 3.35Å; Q149-R153 VanDerWaalsContact O-CG 3.31Å; Q149-R153 WeakPolarHBondContact O-CG 3.43Å; Q149-R153 PolarHBondContact O-N 3.4Å; Q149-Y208 HydrophobicContact CG-CE1 4.23Å; Q149-Y208 VanDerWaalsContact CG-OH 3.27Å; Q149-Y208 WeakPolarHBondContact CG-OH 3.45Å; Q149-Y208 PolarHBondContact NE2-OH 2.85Å
150	E	78.4	Confident	76.9	Confident	10 Å²	10	61 Å²	61	5%	0.047	33%	0.33	C	S	.	.	H	α-helix	trans	-65.3	-38.9	176.1	-172.4	79.8	136.5	0	0	111.9	D146 L148 Q154 N160 I161 G162 T163	D146-E150 PolarHBondContact O-N 2.92Å; L148-E150 VanDerWaalsContact C-N 3.25Å; L148-E150 PolarHBondContact O-N 3.12Å; E150-Q154 VanDerWaalsContact O-CB 3.32Å; E150-Q154 WeakPolarHBondContact O-CB 3.4Å; E150-Q154 PolarHBondContact O-N 2.83Å; E150-N160 HydrophobicContact CG-CB 4.49Å; E150-I161 PolarHBondContact OE1-N 2.84Å; E150-I161 PolarHBondContact OE2-N 3.38Å; E150-G162 WeakPolarHBondContact OE1-CA 3.37Å; E150-G162 PolarHBondContact OE1-N 3.37Å; E150-T163 PolarHBondContact OE1-N 3.08Å; E150-T163 VanDerWaalsContact OE1-N 3.08Å
151	T	79.3	Confident	75.8	Confident	81 Å²	81	60.2 Å²	60.2	50%	0.497	33%	0.326	S	S	.	.	H	α-helix	trans	-69.6	-41.8	179.7	-52.3	0	0	0	0	111.2	G147 L148 Q149 Q154 A155	G147-T151 PolarHBondContact O-N 3.06Å; G147-T151 PolarHBondContact O-OG1 3.45Å; L148-T151 WeakPolarHBondContact O-CA 3.23Å; L148-T151 WeakPolarHBondContact O-CB 3.28Å; L148-T151 PolarHBondContact O-N 2.86Å; Q149-T151 VanDerWaalsContact C-N 3.34Å; T151-Q154 PolarHBondContact O-N 2.82Å; T151-A155 WeakPolarHBondContact O-CB 3.36Å; T151-A155 PolarHBondContact O-N 2.98Å
152	E	77.5	Confident	74.8	Confident	86 Å²	86	61.4 Å²	61.4	40%	0.402	34%	0.338	S	S	.	.	H	α-helix	trans	-65.1	-45.2	175.4	-72.1	178.5	168.7	0	0	111.9	L148 Q154 A155 Q156	L148-E152 PolarHBondContact O-N 3.48Å; E152-Q154 VanDerWaalsContact C-N 3.33Å; E152-Q154 PolarHBondContact O-N 3.48Å; E152-A155 PolarHBondContact O-N 3.1Å; E152-A155 VanDerWaalsContact O-N 3.14Å; E152-Q156 WeakPolarHBondContact O-CG 3.35Å; E152-Q156 PolarHBondContact O-N 3.05Å
153	R	72.7	Confident	73.6	Confident	103 Å²	103	63.1 Å²	63.1	39%	0.389	35%	0.349	S	S	.	.	H	α-helix	trans	-62.6	-40.3	176.1	-77.5	179.7	179.2	172.6	-0.3	112.3	Q149 A155 Q156 E157	Q149-R153 WeakPolarHBondContact O-CB 3.35Å; Q149-R153 VanDerWaalsContact O-CG 3.31Å; Q149-R153 WeakPolarHBondContact O-CG 3.43Å; Q149-R153 PolarHBondContact O-N 3.4Å; R153-A155 VanDerWaalsContact C-N 3.3Å; R153-A155 PolarHBondContact O-N 3.13Å; R153-Q156 PolarHBondContact O-N 2.86Å; R153-E157 PolarHBondContact O-N 2.79Å
154	Q	71.1	Confident	72.6	Confident	103 Å²	103	64.1 Å²	64.1	48%	0.481	36%	0.359	S	S	.	.	H	α-helix	trans	-59.3	-43.7	173.1	-178	169.6	0.2	0	0	111.6	E150 T151 E152 G158 N160	E150-Q154 VanDerWaalsContact O-CB 3.32Å; E150-Q154 WeakPolarHBondContact O-CB 3.4Å; E150-Q154 PolarHBondContact O-N 2.83Å; T151-Q154 PolarHBondContact O-N 2.82Å; E152-Q154 VanDerWaalsContact C-N 3.33Å; E152-Q154 PolarHBondContact O-N 3.48Å; Q154-G158 VanDerWaalsContact O-CA 3.26Å; Q154-G158 WeakPolarHBondContact O-CA 3.27Å; Q154-G158 PolarHBondContact O-N 2.59Å; Q154-G158 VanDerWaalsContact O-N 3.1Å; Q154-N160 WeakPolarHBondContact CB-OD1 3.28Å; Q154-N160 VanDerWaalsContact CD-OD1 3.24Å; Q154-N160 WeakPolarHBondContact CG-OD1 3.17Å; Q154-N160 PolarHBondContact OE1-ND2 3.08Å; Q154-N160 PolarHBondContact OE1-OD1 3.15Å
155	A	68	Low	72.3	Confident	88 Å²	88	65.7 Å²	65.7	73%	0.727	36%	0.359	S	S	*	.	H	α-helix	trans	-68.8	-34.7	-179.6	0	0	0	0	0	112.9	T151 E152 R153	T151-A155 WeakPolarHBondContact O-CB 3.36Å; T151-A155 PolarHBondContact O-N 2.98Å; E152-A155 PolarHBondContact O-N 3.1Å; E152-A155 VanDerWaalsContact O-N 3.14Å; R153-A155 VanDerWaalsContact C-N 3.3Å; R153-A155 PolarHBondContact O-N 3.13Å
156	Q	64.3	Low	72	Confident	156 Å²	156	67.9 Å²	67.9	73%	0.729	37%	0.369	S	S	*	.	H	α-helix	trans	-87.2	-46.2	-176.5	-70.1	-179.9	-0.3	0	0	113.5	E152 R153	E152-Q156 WeakPolarHBondContact O-CG 3.35Å; E152-Q156 PolarHBondContact O-N 3.05Å; R153-Q156 PolarHBondContact O-N 2.86Å
157	E	60.2	Low	72	Confident	131 Å²	131	67.5 Å²	67.5	61%	0.612	37%	0.367	S	S	*	.	H	α-helix	trans	-108.7	-5.6	-169.9	-61.3	-174	169.4	0	0	112.9	R153 K159	R153-E157 PolarHBondContact O-N 2.79Å; E157-K159 HydrophobicContact CB-CB 4.49Å; E157-K159 PolarHBondContact O-N 3.07Å; E157-K159 VanDerWaalsContact O-N 3.09Å
158	G	60.8	Low	72.2	Confident	65 Å²	65	67.1 Å²	67.1	67%	0.67	36%	0.361	S	S	*	.	S	Bend	trans	63.3	10.7	-173.5	0	0	0	0	0	113.6	Q154	Q154-G158 VanDerWaalsContact O-CA 3.26Å; Q154-G158 WeakPolarHBondContact O-CA 3.27Å; Q154-G158 PolarHBondContact O-N 2.59Å; Q154-G158 VanDerWaalsContact O-N 3.1Å
159	K	60.2	Low	72.3	Confident	121 Å²	121	66 Å²	66	53%	0.526	36%	0.36	S	S	.	.			trans	-123.8	128.9	-175.2	-69	177.7	-175.4	175.4	0	109.9	E157	E157-K159 HydrophobicContact CB-CB 4.49Å; E157-K159 PolarHBondContact O-N 3.07Å; E157-K159 VanDerWaalsContact O-N 3.09Å
160	N	65.4	Low	72.7	Confident	40 Å²	40	63.9 Å²	63.9	21%	0.214	35%	0.351	C	S	.	.			trans	-101	138	171.9	-62.5	38.4	0	0	0	108.2	E150 Q154 I309	E150-N160 HydrophobicContact CG-CB 4.49Å; Q154-N160 WeakPolarHBondContact CB-OD1 3.28Å; Q154-N160 VanDerWaalsContact CD-OD1 3.24Å; Q154-N160 WeakPolarHBondContact CG-OD1 3.17Å; Q154-N160 PolarHBondContact OE1-ND2 3.08Å; Q154-N160 PolarHBondContact OE1-OD1 3.15Å; N160-I309 HydrophobicContact CB-CD1 4.31Å; N160-I309 VanDerWaalsContact O-CD1 3.3Å; N160-I309 WeakPolarHBondContact O-CD1 3.31Å
161	I	65.6	Low	73.2	Confident	37 Å²	37	63.5 Å²	63.5	19%	0.19	35%	0.349	C	S	.	.			trans	-71.8	-29.3	172.6	-65.4	-169.1	0	0	0	110.1	E150 T163 F271	E150-I161 PolarHBondContact OE1-N 2.84Å; E150-I161 PolarHBondContact OE2-N 3.38Å; I161-T163 HydrophobicContact CB-CG2 4.19Å; I161-T163 HydrophobicContact CG2-CG2 4.21Å; I161-F271 HydrophobicContact CG1-CD1 4.5Å; I161-F271 HydrophobicContact CG2-CD1 4.43Å
162	G	65.5	Low	73.8	Confident	27 Å²	27	60.8 Å²	60.8	28%	0.278	33%	0.33	S	S	.	.			trans	82.3	42.4	-172	0	0	0	0	0	111.3	E150	E150-G162 WeakPolarHBondContact OE1-CA 3.37Å; E150-G162 PolarHBondContact OE1-N 3.37Å
163	T	66.4	Low	74.3	Confident	37 Å²	37	59.7 Å²	59.7	23%	0.227	33%	0.332	C	S	.	.			trans	-61.7	153.7	-179.8	78.5	0	0	0	0	110.6	D146 E150 I161 K165	D146-T163 VanDerWaalsContact OD1-CB 3.26Å; D146-T163 WeakPolarHBondContact OD1-CB 3.34Å; D146-T163 PolarHBondContact OD1-OG1 3.01Å; E150-T163 PolarHBondContact OE1-N 3.08Å; E150-T163 VanDerWaalsContact OE1-N 3.08Å; I161-T163 HydrophobicContact CB-CG2 4.19Å; I161-T163 HydrophobicContact CG2-CG2 4.21Å; T163-K165 PolarHBondContact O-N 2.9Å; T163-K165 VanDerWaalsContact O-N 3.16Å; T163-K165 PolarHBondContact OG1-N 2.79Å
164	T	65.8	Low	75.1	Confident	74 Å²	74	54.9 Å²	54.9	45%	0.454	31%	0.314	S	S	.	.			trans	-72.2	-3.3	179	52.5	0	0	0	0	112.9	N67 K166	N67-T164 HydrophobicContact CB-CG2 4.22Å; T164-K166 WeakPolarHBondContact O-CG 3.27Å; T164-K166 PolarHBondContact O-N 3.15Å
165	K	78.7	Confident	76.1	Confident	110 Å²	110	53 Å²	53	48%	0.478	31%	0.305	S	S	.	.	S	Bend	trans	53.5	33.6	-173.6	-56.2	-173.4	178.1	-168.9	0	112.9	D146 T163	D146-K165 WeakPolarHBondContact OD2-CA 3.37Å; D146-K165 PolarHBondContact OD2-N 2.95Å; T163-K165 PolarHBondContact O-N 2.9Å; T163-K165 VanDerWaalsContact O-N 3.16Å; T163-K165 PolarHBondContact OG1-N 2.79Å
166	K	81.1	Confident	77.2	Confident	45 Å²	45	52.6 Å²	52.6	20%	0.196	30%	0.301	C	S	.	.	S	Bend	trans	-105.4	3.8	-176.8	-71.7	-172.8	178.6	-172.3	0	112.3	N66 D146 T164 I168	N66-K166 HydrophobicContact CB-CD 4.44Å; N66-K166 WeakPolarHBondContact O-CD 3.34Å; N66-K166 WeakPolarHBondContact O-CE 3.4Å; N66-K166 PolarHBondContact O-NZ 2.81Å; N66-K166 WeakPolarHBondContact OD1-CB 3.36Å; N66-K166 WeakPolarHBondContact OD1-CD 3.24Å; D146-K166 PolarHBondContact OD2-N 2.88Å; T164-K166 WeakPolarHBondContact O-CG 3.27Å; T164-K166 PolarHBondContact O-N 3.15Å; K166-I168 VanDerWaalsContact C-N 3.29Å; K166-I168 HydrophobicContact CB-CG1 4.21Å; K166-I168 PolarHBondContact O-N 3.35Å
167	G	84.6	Confident	78.4	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	29%	0.289	C	S	.	.	S	Bend	trans	77.5	13.4	175.5	0	0	0	0	0	114.3	H142 D146 A171	H142-G167 VanDerWaalsContact O-CA 3.29Å; H142-G167 WeakPolarHBondContact O-CA 3.48Å; D146-G167 PolarHBondContact OD2-N 3.14Å; G167-A171 VanDerWaalsContact O-CB 3.23Å; G167-A171 WeakPolarHBondContact O-CB 3.4Å; G167-A171 PolarHBondContact O-N 2.91Å
168	I	86.8	Confident	79.8	Confident	5 Å²	5	53.1 Å²	53.1	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-65.9	-48.2	-178.3	-54.5	-58.1	0	0	0	110.8	N67 V102 K166 A171 Y172	N67-I168 HydrophobicContact CB-CG1 3.94Å; V102-I168 HydrophobicContact CG2-CD1 3.6Å; V102-I168 HydrophobicContact CG2-CG2 4.14Å; K166-I168 VanDerWaalsContact C-N 3.29Å; K166-I168 HydrophobicContact CB-CG1 4.21Å; K166-I168 PolarHBondContact O-N 3.35Å; I168-A171 PolarHBondContact O-N 3.35Å; I168-Y172 HydrophobicContact CG2-CD2 3.69Å; I168-Y172 HydrophobicContact CG2-CE2 3.7Å; I168-Y172 WeakPolarHBondContact O-CD2 3.28Å; I168-Y172 PolarHBondContact O-N 3.48Å
169	G	85.9	Confident	81.2	Confident	21 Å²	21	53 Å²	53	22%	0.216	29%	0.285	C	S	.	.	H	α-helix	trans	-59.7	-54.4	179	0	0	0	0	0	112.7	A171 Y172 S173 S274	G169-A171 VanDerWaalsContact C-N 3.3Å; G169-A171 PolarHBondContact O-N 2.84Å; G169-Y172 PolarHBondContact O-N 3.47Å; G169-S173 PolarHBondContact O-N 2.88Å; G169-S274 WeakPolarHBondContact CA-OG 3.38Å
170	P	88.1	Confident	82.5	Confident	1 Å²	1	48 Å²	48	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-58.5	-37.7	176.1	-29	37.5	0	0	0	113.7	H142 V145 D146 S173 S174 Y204	H142-P170 HydrophobicContact CB-CB 4.09Å; V145-P170 HydrophobicContact CB-CG 4.4Å; V145-P170 HydrophobicContact CG1-CB 4.39Å; V145-P170 HydrophobicContact CG1-CG 4.07Å; D146-P170 HydrophobicContact CB-CG 3.97Å; P170-S173 WeakPolarHBondContact O-CB 3.5Å; P170-S173 PolarHBondContact O-N 2.96Å; P170-S174 PolarHBondContact O-N 2.89Å; P170-Y204 PolarHBondContact O-OH 2.88Å; P170-Y204 VanDerWaalsContact O-OH 3.09Å
171	A	90.1	Very high	83.8	Confident	2 Å²	2	46.2 Å²	46.2	2%	0.017	26%	0.257	C	S	.	.	H	α-helix	trans	-65.5	-43.1	176.6	0	0	0	0	0	112.6	V102 V138 G167 I168 G169 S173 S174 K175	V102-A171 HydrophobicContact CB-CB 4.33Å; V102-A171 HydrophobicContact CG1-CB 4.19Å; V138-A171 HydrophobicContact CG2-CB 3.88Å; G167-A171 VanDerWaalsContact O-CB 3.23Å; G167-A171 WeakPolarHBondContact O-CB 3.4Å; G167-A171 PolarHBondContact O-N 2.91Å; I168-A171 PolarHBondContact O-N 3.35Å; G169-A171 VanDerWaalsContact C-N 3.3Å; G169-A171 PolarHBondContact O-N 2.84Å; A171-S173 VanDerWaalsContact C-N 3.34Å; A171-S174 WeakPolarHBondContact O-CB 3.33Å; A171-S174 PolarHBondContact O-N 3.3Å; A171-K175 PolarHBondContact O-N 2.92Å
172	Y	90.2	Very high	85.2	Confident	25 Å²	25	48.5 Å²	48.5	10%	0.098	26%	0.263	C	S	.	.	H	α-helix	trans	-68.1	-33.2	174	-84.3	-71.8	0	0	0	112.5	G64 G100 V102 I168 G169 K175 A176 S275	G64-Y172 PolarHBondContact N-OH 2.98Å; G100-Y172 PolarHBondContact O-OH 3.23Å; V102-Y172 HydrophobicContact CG1-CD1 4.39Å; V102-Y172 HydrophobicContact CG1-CD2 4.07Å; V102-Y172 HydrophobicContact CG1-CE1 4.14Å; V102-Y172 HydrophobicContact CG1-CE2 3.82Å; V102-Y172 HydrophobicContact CG1-CG 4.35Å; V102-Y172 HydrophobicContact CG2-CD2 4.44Å; V102-Y172 HydrophobicContact CG2-CE2 3.95Å; I168-Y172 HydrophobicContact CG2-CD2 3.69Å; I168-Y172 HydrophobicContact CG2-CE2 3.7Å; I168-Y172 WeakPolarHBondContact O-CD2 3.28Å; I168-Y172 PolarHBondContact O-N 3.48Å; G169-Y172 PolarHBondContact O-N 3.47Å; Y172-K175 HydrophobicContact CD1-CD 4.07Å; Y172-K175 HydrophobicContact CE1-CD 4.32Å; Y172-K175 WeakPolarHBondContact O-CB 3.38Å; Y172-K175 PolarHBondContact O-N 3.29Å; Y172-A176 PolarHBondContact O-N 3.41Å; Y172-S275 WeakPolarHBondContact OH-CB 3.08Å
173	S	89.3	Confident	86.4	Confident	63 Å²	63	47.2 Å²	47.2	44%	0.441	25%	0.25	S	S	.	.	H	α-helix	trans	-63.1	-45.8	171.6	178.4	0	0	0	0	111.3	G169 P170 A171 K175 A176 S177	G169-S173 PolarHBondContact O-N 2.88Å; P170-S173 WeakPolarHBondContact O-CB 3.5Å; P170-S173 PolarHBondContact O-N 2.96Å; A171-S173 VanDerWaalsContact C-N 3.34Å; S173-K175 VanDerWaalsContact C-N 3.28Å; S173-K175 PolarHBondContact O-N 3.03Å; S173-A176 PolarHBondContact O-N 3.01Å; S173-A176 VanDerWaalsContact O-N 3.15Å; S173-S177 WeakPolarHBondContact O-CB 3.45Å; S173-S177 PolarHBondContact O-N 3.1Å; S173-S177 PolarHBondContact O-OG 2.79Å
174	S	89.5	Confident	87.7	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.007	25%	0.251	C	S	.	.	H	α-helix	trans	-59	-38.5	173.1	-83.3	0	0	0	0	112.7	H142 P170 A171 R178 I179 G180 Y204	H142-S174 PolarHBondContact NE2-OG 3.34Å; P170-S174 PolarHBondContact O-N 2.89Å; A171-S174 WeakPolarHBondContact O-CB 3.33Å; A171-S174 PolarHBondContact O-N 3.3Å; S174-R178 PolarHBondContact O-N 2.89Å; S174-I179 PolarHBondContact O-N 3.37Å; S174-I179 VanDerWaalsContact O-N 3.07Å; S174-G180 PolarHBondContact O-N 2.86Å; S174-Y204 WeakPolarHBondContact OG-CE2 3.5Å; S174-Y204 PolarHBondContact OG-OH 3.3Å
175	K	91.7	Very high	88.8	Confident	65 Å²	65	44.8 Å²	44.8	28%	0.283	24%	0.236	S	C	.	.	H	α-helix	trans	-62.8	-46.8	173.1	175.2	174.1	-178.9	-178.9	0	111.8	H136 A171 Y172 S173 R178	H136-K175 WeakPolarHBondContact NE2-CG 3.3Å; A171-K175 PolarHBondContact O-N 2.92Å; Y172-K175 HydrophobicContact CD1-CD 4.07Å; Y172-K175 HydrophobicContact CE1-CD 4.32Å; Y172-K175 WeakPolarHBondContact O-CB 3.38Å; Y172-K175 PolarHBondContact O-N 3.29Å; S173-K175 VanDerWaalsContact C-N 3.28Å; S173-K175 PolarHBondContact O-N 3.03Å; K175-R178 PolarHBondContact O-N 3.39Å
176	A	90.2	Very high	89.3	Confident	78 Å²	78	39.8 Å²	39.8	65%	0.645	21%	0.214	S	C	*	.	H	α-helix	trans	-65	-39.7	178.4	0	0	0	0	0	112.2	Y172 S173 R178	Y172-A176 PolarHBondContact O-N 3.41Å; S173-A176 PolarHBondContact O-N 3.01Å; S173-A176 VanDerWaalsContact O-N 3.15Å; A176-R178 PolarHBondContact O-N 2.85Å
177	S	90.3	Very high	89.6	Confident	70 Å²	70	39.6 Å²	39.6	49%	0.49	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-5	175.7	-63.4	0	0	0	0	113.8	S173 I179	S173-S177 WeakPolarHBondContact O-CB 3.45Å; S173-S177 PolarHBondContact O-N 3.1Å; S173-S177 PolarHBondContact O-OG 2.79Å; S177-I179 PolarHBondContact O-N 2.92Å
178	R	90.4	Very high	89.6	Confident	229 Å²	229	41.9 Å²	41.9	86%	0.864	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	20	178.9	-48.2	166.5	-170.2	173.1	0.9	114.1	S174 K175 A176	S174-R178 PolarHBondContact O-N 2.89Å; K175-R178 PolarHBondContact O-N 3.39Å; A176-R178 PolarHBondContact O-N 2.85Å
179	I	89	Confident	89.7	Confident	63 Å²	63	46.4 Å²	46.4	32%	0.323	26%	0.263	S	S	.	.			trans	-100.4	-10.4	175.7	63.7	176.3	0	0	0	112.1	S174 S177 L200 H203	S174-I179 PolarHBondContact O-N 3.37Å; S174-I179 VanDerWaalsContact O-N 3.07Å; S177-I179 PolarHBondContact O-N 2.92Å; I179-L200 HydrophobicContact CB-CD1 4.1Å; I179-L200 HydrophobicContact CD1-CD1 3.63Å; I179-L200 HydrophobicContact CG1-CD1 3.72Å; I179-H203 VanDerWaalsContact CD1-CD2 3.46Å; I179-H203 WeakPolarHBondContact CD1-CD2 3.21Å
180	G	88.9	Confident	89.7	Confident	14 Å²	14	47.9 Å²	47.9	14%	0.144	26%	0.264	C	S	.	.			trans	-67.4	150.7	179.7	0	0	0	0	0	113.1	S174	S174-G180 PolarHBondContact O-N 2.86Å
181	L	92.6	Very high	89.7	Confident	4 Å²	4	53.3 Å²	53.3	2%	0.021	29%	0.293	C	S	.	.			trans	-100.5	146.4	177.2	-59.9	176	0	0	0	110.7	L137 F139 F193 R196 F197 L200	L137-L181 PolarHBondContact N-O 3.36Å; F139-L181 HydrophobicContact CE2-CB 3.98Å; F139-L181 HydrophobicContact CE2-CD1 3.85Å; F139-L181 HydrophobicContact CE2-CG 4.21Å; F139-L181 HydrophobicContact CZ-CB 3.89Å; F139-L181 HydrophobicContact CZ-CD1 3.7Å; F139-L181 HydrophobicContact CZ-CG 4.3Å; L181-F193 HydrophobicContact CB-CE2 4.15Å; L181-F193 HydrophobicContact CD1-CD2 4.16Å; L181-F193 HydrophobicContact CD1-CE2 3.67Å; L181-F193 HydrophobicContact CD1-CZ 4.07Å; L181-F193 HydrophobicContact CG-CE2 4.4Å; L181-R196 HydrophobicContact CD2-CB 3.71Å; L181-F197 HydrophobicContact CD1-CB 3.91Å; L181-F197 HydrophobicContact CD1-CD2 4.01Å; L181-F197 HydrophobicContact CD1-CG 4.49Å; L181-L200 HydrophobicContact CG-CD2 4.41Å
182	R	93.6	Very high	89.6	Confident	84 Å²	84	56.6 Å²	56.6	32%	0.317	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-116.9	169.2	-178.7	-60.2	170.7	-62.6	170.4	6.6	111.6	A135 C184 D185 L186	A135-R182 CarbonylContact O-C 3.53Å; A135-R182 WeakPolarHBondContact O-CA 3.42Å; A135-R182 WeakPolarHBondContact O-CB 3.33Å; R182-C184 VanDerWaalsContact C-N 3.26Å; R182-C184 PolarHBondContact O-N 3.5Å; R182-D185 WeakPolarHBondContact CB-OD2 3.4Å; R182-D185 PolarHBondContact N-OD2 3.16Å; R182-D185 IonicContact NE-OD2 3.92Å; R182-D185 PolarHBondContact NE-OD2 3.23Å; R182-D185 IonicContact NH2-OD1 3.1Å; R182-D185 WeakPolarHBondContact O-CB 3.43Å; R182-D185 PolarHBondContact O-N 3.44Å; R182-D185 VanDerWaalsContact O-N 3.08Å; R182-L186 PolarHBondContact O-N 3.08Å
183	V	92.3	Very high	89.6	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-58.5	-37.9	176.8	175.1	0	0	0	0	111.8	I103 V131 D133 A135 L137 D185 L186 L187 L229 V233	I103-V183 HydrophobicContact CD1-CG2 4.24Å; V131-V183 HydrophobicContact CG1-CG2 4.24Å; D133-V183 CarbonylContact O-C 3.36Å; D133-V183 WeakPolarHBondContact O-CB 3.48Å; D133-V183 PolarHBondContact O-N 3.08Å; A135-V183 HydrophobicContact CB-CG2 4.14Å; A135-V183 PolarHBondContact O-N 3.19Å; L137-V183 HydrophobicContact CD2-CG2 3.88Å; V183-D185 VanDerWaalsContact C-N 3.28Å; V183-D185 PolarHBondContact O-N 2.9Å; V183-L186 PolarHBondContact O-N 3.12Å; V183-L187 HydrophobicContact CG1-CD1 4.43Å; V183-L187 PolarHBondContact O-N 3.26Å; V183-L187 VanDerWaalsContact O-N 3.12Å; V183-L229 HydrophobicContact CG1-CD2 3.82Å; V183-L229 HydrophobicContact CG2-CD2 4.46Å; V183-V233 HydrophobicContact CG1-CB 4.3Å; V183-V233 HydrophobicContact CG1-CG1 3.78Å; V183-V233 HydrophobicContact CG1-CG2 3.49Å; V183-V233 VanDerWaalsContact CG1-CG2 3.49Å
184	C	92	Very high	89.7	Confident	36 Å²	36	53.2 Å²	53.2	24%	0.243	29%	0.289	C	S	.	.	H	α-helix	trans	-62.4	-35.8	176.2	65	0	0	0	0	112.5	D133 R182 L186 L187 G188	D133-C184 HydrophobicContact CB-CB 4.14Å; D133-C184 WeakPolarHBondContact O-CB 3.13Å; D133-C184 PolarHBondContact O-N 2.84Å; R182-C184 VanDerWaalsContact C-N 3.26Å; R182-C184 PolarHBondContact O-N 3.5Å; C184-L186 VanDerWaalsContact C-N 3.33Å; C184-L187 PolarHBondContact O-N 2.95Å; C184-G188 PolarHBondContact O-N 3.15Å
185	D	90.6	Very high	89.7	Confident	25 Å²	25	56.8 Å²	56.8	13%	0.134	31%	0.311	C	S	.	.	H	α-helix	trans	-71.5	-34.2	-179.7	-51.9	-49	0	0	0	110	R182 V183 F193 R196	R182-D185 WeakPolarHBondContact CB-OD2 3.4Å; R182-D185 PolarHBondContact N-OD2 3.16Å; R182-D185 IonicContact NE-OD2 3.92Å; R182-D185 PolarHBondContact NE-OD2 3.23Å; R182-D185 IonicContact NH2-OD1 3.1Å; R182-D185 WeakPolarHBondContact O-CB 3.43Å; R182-D185 PolarHBondContact O-N 3.44Å; R182-D185 VanDerWaalsContact O-N 3.08Å; V183-D185 VanDerWaalsContact C-N 3.28Å; V183-D185 PolarHBondContact O-N 2.9Å; D185-F193 HydrophobicContact CB-CD2 4.19Å; D185-R196 IonicContact OD1-NH1 2.72Å
186	L	88.4	Confident	89.6	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.021	32%	0.317	C	S	.	.	H	α-helix	trans	-69.3	-35.9	175.6	-179.1	66.8	0	0	0	113	L105 L137 R182 V183 C184 F193 L222 A226	L105-L186 HydrophobicContact CD1-CD2 3.52Å; L137-L186 HydrophobicContact CD1-CB 4.04Å; L137-L186 HydrophobicContact CD1-CD2 4.15Å; R182-L186 PolarHBondContact O-N 3.08Å; V183-L186 PolarHBondContact O-N 3.12Å; C184-L186 VanDerWaalsContact C-N 3.33Å; L186-F193 HydrophobicContact CB-CD2 4.31Å; L186-F193 HydrophobicContact CB-CE2 4.02Å; L186-F193 HydrophobicContact CB-CZ 4.5Å; L186-F193 HydrophobicContact CD1-CD1 4.22Å; L186-F193 HydrophobicContact CD1-CD2 4.44Å; L186-F193 HydrophobicContact CD1-CE1 3.77Å; L186-F193 HydrophobicContact CD1-CE2 3.99Å; L186-F193 HydrophobicContact CD1-CZ 3.64Å; L186-L222 HydrophobicContact CD1-CB 4.25Å; L186-A226 HydrophobicContact CD1-CB 3.99Å; L186-A226 HydrophobicContact CD2-CB 4.03Å; L186-A226 HydrophobicContact CG-CB 3.72Å
187	L	87.5	Confident	89.6	Confident	41 Å²	41	55.1 Å²	55.1	22%	0.215	29%	0.287	C	S	.	.	H	α-helix	trans	-86	-12.2	179.8	-68.7	-175.4	0	0	0	114.2	V183 C184 A226 R230 V233	V183-L187 HydrophobicContact CG1-CD1 4.43Å; V183-L187 PolarHBondContact O-N 3.26Å; V183-L187 VanDerWaalsContact O-N 3.12Å; C184-L187 PolarHBondContact O-N 2.95Å; L187-A226 HydrophobicContact CD2-CB 4.48Å; L187-R230 HydrophobicContact CD2-CB 3.89Å; L187-R230 HydrophobicContact CD2-CG 4.22Å; L187-V233 HydrophobicContact CD1-CB 3.49Å; L187-V233 VanDerWaalsContact CD1-CB 3.49Å; L187-V233 HydrophobicContact CD1-CG1 3.67Å; L187-V233 HydrophobicContact CD1-CG2 3.56Å
188	G	84.9	Confident	89.6	Confident	49 Å²	49	56.7 Å²	56.7	51%	0.505	29%	0.285	S	S	.	.	S	Bend	trans	-78.8	-141.7	177.3	0	0	0	0	0	113	C184 F190	C184-G188 PolarHBondContact O-N 3.15Å; G188-F190 PolarHBondContact O-N 3Å
189	D	87.7	Confident	89.5	Confident	100 Å²	100	50.7 Å²	50.7	54%	0.535	27%	0.27	S	S	.	.			trans	-72.9	112.4	174.9	-175.4	-3.1	0	0	0	110.7	N191 D192 F193	D189-N191 PolarHBondContact O-N 3.26Å; D189-N191 WeakPolarHBondContact OD1-CB 3.27Å; D189-N191 PolarHBondContact OD1-N 2.89Å; D189-D192 HydrophobicContact CB-CB 4.4Å; D189-D192 PolarHBondContact O-N 3.47Å; D189-F193 PolarHBondContact O-N 3.07Å
190	F	87	Confident	89.5	Confident	52 Å²	52	47.9 Å²	47.9	23%	0.228	26%	0.255	C	S	.	.	H	α-helix	trans	-62.2	-25	-178.7	-167.2	-96.4	0	0	0	113.2	G188 F193 S194 L219 K223	G188-F190 PolarHBondContact O-N 3Å; F190-F193 HydrophobicContact CD2-CD1 4.36Å; F190-F193 HydrophobicContact CE2-CD1 4.16Å; F190-S194 WeakPolarHBondContact CD1-OG 3.29Å; F190-S194 VanDerWaalsContact CE1-OG 3.28Å; F190-S194 WeakPolarHBondContact CE1-OG 3.31Å; F190-S194 VanDerWaalsContact O-CB 3.3Å; F190-S194 WeakPolarHBondContact O-CB 3.31Å; F190-S194 PolarHBondContact O-N 3.41Å; F190-S194 PolarHBondContact O-OG 3.24Å; F190-L219 HydrophobicContact CZ-CB 4.43Å; F190-L219 HydrophobicContact CZ-CD2 4.47Å; F190-L219 WeakPolarHBondContact CZ-O 3.44Å; F190-K223 HydrophobicContact CD2-CG 4.47Å; F190-K223 HydrophobicContact CE1-CD 4.35Å; F190-K223 HydrophobicContact CE2-CB 3.76Å; F190-K223 HydrophobicContact CE2-CG 4.06Å; F190-K223 HydrophobicContact CZ-CB 3.76Å; F190-K223 HydrophobicContact CZ-CD 4.29Å; F190-K223 HydrophobicContact CZ-CG 4.2Å
191	N	87.5	Confident	89.5	Confident	115 Å²	115	47.3 Å²	47.3	62%	0.615	25%	0.249	S	C	*	.	H	α-helix	trans	-72.2	-42.7	177.6	-65.4	-44.6	0	0	0	111.8	D189 S194 T195	D189-N191 PolarHBondContact O-N 3.26Å; D189-N191 WeakPolarHBondContact OD1-CB 3.27Å; D189-N191 PolarHBondContact OD1-N 2.89Å; N191-S194 PolarHBondContact O-N 3.47Å; N191-T195 PolarHBondContact O-N 3.31Å; N191-T195 PolarHBondContact O-OG1 3.49Å
192	D	88.8	Confident	89.2	Confident	70 Å²	70	53 Å²	53	37%	0.374	28%	0.275	S	S	.	.	H	α-helix	trans	-64.9	-44.9	173.5	-176.1	36.9	0	0	0	110.1	D189 S194 T195 R196	D189-D192 HydrophobicContact CB-CB 4.4Å; D189-D192 PolarHBondContact O-N 3.47Å; D192-S194 VanDerWaalsContact C-N 3.34Å; D192-S194 PolarHBondContact O-N 2.93Å; D192-T195 PolarHBondContact O-N 3.34Å; D192-T195 VanDerWaalsContact O-N 3.16Å; D192-R196 WeakPolarHBondContact O-CG 3.49Å; D192-R196 PolarHBondContact O-N 3.07Å; D192-R196 IonicContact OD1-CZ 2.66Å; D192-R196 IonicContact OD1-NE 3.89Å; D192-R196 PolarHBondContact OD1-NE 3.22Å; D192-R196 IonicContact OD1-NH2 2.82Å; D192-R196 IonicContact OD2-CZ 3.94Å; D192-R196 IonicContact OD2-NE 3.17Å; D192-R196 PolarHBondContact OD2-NE 3.25Å; D192-R196 IonicContact OD2-NH2 3.82Å; D192-R196 PolarHBondContact OD2-NH2 3.39Å
193	F	90.4	Very high	88.9	Confident	1 Å²	1	53 Å²	53	0%	0.004	28%	0.279	C	S	.	.	H	α-helix	trans	-54	-49.3	173.7	178.6	-95.7	0	0	0	112.1	L137 F139 L181 D185 L186 D189 F190 T195 R196 F197 L219 L222	L137-F193 HydrophobicContact CD1-CE2 4.27Å; F139-F193 HydrophobicContact CE1-CZ 4.23Å; F139-F193 HydrophobicContact CZ-CE2 4.46Å; F139-F193 HydrophobicContact CZ-CZ 4.13Å; L181-F193 HydrophobicContact CB-CE2 4.15Å; L181-F193 HydrophobicContact CD1-CD2 4.16Å; L181-F193 HydrophobicContact CD1-CE2 3.67Å; L181-F193 HydrophobicContact CD1-CZ 4.07Å; L181-F193 HydrophobicContact CG-CE2 4.4Å; D185-F193 HydrophobicContact CB-CD2 4.19Å; L186-F193 HydrophobicContact CB-CD2 4.31Å; L186-F193 HydrophobicContact CB-CE2 4.02Å; L186-F193 HydrophobicContact CB-CZ 4.5Å; L186-F193 HydrophobicContact CD1-CD1 4.22Å; L186-F193 HydrophobicContact CD1-CD2 4.44Å; L186-F193 HydrophobicContact CD1-CE1 3.77Å; L186-F193 HydrophobicContact CD1-CE2 3.99Å; L186-F193 HydrophobicContact CD1-CZ 3.64Å; D189-F193 PolarHBondContact O-N 3.07Å; F190-F193 HydrophobicContact CD2-CD1 4.36Å; F190-F193 HydrophobicContact CE2-CD1 4.16Å; F193-T195 VanDerWaalsContact C-N 3.29Å; F193-T195 PolarHBondContact O-N 3.46Å; F193-R196 PolarHBondContact O-N 3.28Å; F193-F197 VanDerWaalsContact O-CB 3.26Å; F193-F197 WeakPolarHBondContact O-CB 3.32Å; F193-F197 PolarHBondContact O-N 2.85Å; F193-L219 HydrophobicContact CD1-CD2 4.13Å; F193-L219 HydrophobicContact CE1-CD2 3.89Å; F193-L222 HydrophobicContact CE1-CD1 4.06Å; F193-L222 HydrophobicContact CZ-CD1 4.11Å
194	S	89.7	Confident	88.5	Confident	16 Å²	16	53.4 Å²	53.4	11%	0.112	28%	0.28	C	S	.	.	H	α-helix	trans	-61.8	-37.6	-179.9	-63.3	0	0	0	0	112.4	F190 N191 D192 K198	F190-S194 WeakPolarHBondContact CD1-OG 3.29Å; F190-S194 VanDerWaalsContact CE1-OG 3.28Å; F190-S194 WeakPolarHBondContact CE1-OG 3.31Å; F190-S194 VanDerWaalsContact O-CB 3.3Å; F190-S194 WeakPolarHBondContact O-CB 3.31Å; F190-S194 PolarHBondContact O-N 3.41Å; F190-S194 PolarHBondContact O-OG 3.24Å; N191-S194 PolarHBondContact O-N 3.47Å; D192-S194 VanDerWaalsContact C-N 3.34Å; D192-S194 PolarHBondContact O-N 2.93Å; S194-K198 WeakPolarHBondContact O-CB 2.94Å; S194-K198 VanDerWaalsContact O-CG 3.32Å; S194-K198 WeakPolarHBondContact O-CG 3.47Å; S194-K198 PolarHBondContact O-N 2.93Å
195	T	90.6	Very high	88.3	Confident	76 Å²	76	54.9 Å²	54.9	47%	0.466	28%	0.284	S	S	.	.	H	α-helix	trans	-67.9	-47.6	177.5	-56.7	0	0	0	0	111	N191 D192 F193 F197 K198 N199	N191-T195 PolarHBondContact O-N 3.31Å; N191-T195 PolarHBondContact O-OG1 3.49Å; D192-T195 PolarHBondContact O-N 3.34Å; D192-T195 VanDerWaalsContact O-N 3.16Å; F193-T195 VanDerWaalsContact C-N 3.29Å; F193-T195 PolarHBondContact O-N 3.46Å; T195-F197 VanDerWaalsContact C-N 3.32Å; T195-F197 PolarHBondContact O-N 2.83Å; T195-K198 PolarHBondContact O-N 3.06Å; T195-N199 VanDerWaalsContact O-CG 3.29Å; T195-N199 PolarHBondContact O-N 3.06Å; T195-N199 PolarHBondContact O-ND2 3.02Å
196	R	89.4	Confident	88	Confident	109 Å²	109	57.5 Å²	57.5	41%	0.411	30%	0.304	S	S	.	.	H	α-helix	trans	-65.3	-36.8	177.5	-63.4	-179.9	-171.7	-167.7	5.6	112.2	L181 D185 D192 F193 N199 L200	L181-R196 HydrophobicContact CD2-CB 3.71Å; D185-R196 IonicContact OD1-NH1 2.72Å; D192-R196 WeakPolarHBondContact O-CG 3.49Å; D192-R196 PolarHBondContact O-N 3.07Å; D192-R196 IonicContact OD1-CZ 2.66Å; D192-R196 IonicContact OD1-NE 3.89Å; D192-R196 PolarHBondContact OD1-NE 3.22Å; D192-R196 IonicContact OD1-NH2 2.82Å; D192-R196 IonicContact OD2-CZ 3.94Å; D192-R196 IonicContact OD2-NE 3.17Å; D192-R196 PolarHBondContact OD2-NE 3.25Å; D192-R196 IonicContact OD2-NH2 3.82Å; D192-R196 PolarHBondContact OD2-NH2 3.39Å; F193-R196 PolarHBondContact O-N 3.28Å; R196-N199 PolarHBondContact O-N 2.71Å; R196-L200 WeakPolarHBondContact O-CB 3.42Å; R196-L200 PolarHBondContact O-N 2.93Å
197	F	90.1	Very high	87.8	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-61.8	-46.5	174.2	-176.8	-94.6	0	0	0	111.7	F139 F141 L181 F193 T195 N199 L200 V201 V215 Q218 L219 L222	F139-F197 HydrophobicContact CB-CE2 4.47Å; F139-F197 HydrophobicContact CD1-CD2 4.32Å; F139-F197 AromaticContact CD1-CE2 3.63Å; F139-F197 HydrophobicContact CD1-CE2 3.63Å; F139-F197 HydrophobicContact CD2-CD2 4.45Å; F139-F197 HydrophobicContact CD2-CE2 4.09Å; F139-F197 AromaticContact CE1-CD2 4Å; F139-F197 HydrophobicContact CE1-CD2 4Å; F139-F197 AromaticContact CE1-CE2 3.75Å; F139-F197 HydrophobicContact CE1-CE2 3.75Å; F139-F197 HydrophobicContact CE2-CD2 4.14Å; F139-F197 HydrophobicContact CE2-CE2 4.2Å; F139-F197 AromaticContact CG-CE2 3.8Å; F139-F197 HydrophobicContact CG-CE2 3.8Å; F139-F197 AromaticContact CZ-CD2 3.9Å; F139-F197 HydrophobicContact CZ-CD2 3.9Å; F139-F197 HydrophobicContact CZ-CE2 4.04Å; F141-F197 HydrophobicContact CD1-CZ 4.38Å; F141-F197 AromaticContact CE1-CE2 3.69Å; F141-F197 HydrophobicContact CE1-CE2 3.69Å; F141-F197 AromaticContact CE1-CZ 3.91Å; F141-F197 HydrophobicContact CE1-CZ 3.91Å; L181-F197 HydrophobicContact CD1-CB 3.91Å; L181-F197 HydrophobicContact CD1-CD2 4.01Å; L181-F197 HydrophobicContact CD1-CG 4.49Å; F193-F197 VanDerWaalsContact O-CB 3.26Å; F193-F197 WeakPolarHBondContact O-CB 3.32Å; F193-F197 PolarHBondContact O-N 2.85Å; T195-F197 VanDerWaalsContact C-N 3.32Å; T195-F197 PolarHBondContact O-N 2.83Å; F197-N199 VanDerWaalsContact C-N 3.33Å; F197-N199 PolarHBondContact O-N 2.6Å; F197-L200 WeakPolarHBondContact O-CB 3.45Å; F197-L200 PolarHBondContact O-N 3.49Å; F197-V201 HydrophobicContact CD1-CG2 4.17Å; F197-V201 HydrophobicContact CE1-CG2 3.8Å; F197-V201 HydrophobicContact CZ-CG2 4.04Å; F197-V201 WeakPolarHBondContact O-CG2 3.27Å; F197-V201 PolarHBondContact O-N 3Å; F197-V215 HydrophobicContact CD1-CG1 4Å; F197-V215 HydrophobicContact CE1-CG1 3.99Å; F197-Q218 HydrophobicContact CE1-CB 4.38Å; F197-Q218 HydrophobicContact CZ-CB 4.08Å; F197-L219 HydrophobicContact CB-CD2 4.04Å; F197-L219 HydrophobicContact CD1-CD1 4.32Å; F197-L219 HydrophobicContact CD1-CD2 3.66Å; F197-L219 HydrophobicContact CD1-CG 3.85Å; F197-L219 HydrophobicContact CE1-CD2 4.28Å; F197-L219 HydrophobicContact CE1-CG 4.16Å; F197-L219 HydrophobicContact CG-CD2 3.86Å; F197-L222 HydrophobicContact CD2-CD1 4.33Å; F197-L222 HydrophobicContact CE2-CD1 3.93Å; F197-L222 HydrophobicContact CZ-CD1 4.33Å
198	K	89.4	Confident	87.5	Confident	103 Å²	103	61 Å²	61	45%	0.448	32%	0.319	S	S	.	.	H	α-helix	trans	-57.2	-44.7	173.8	-79	171.2	-177.8	-170	0	112.2	S194 T195 L200 V201 H202 V215	S194-K198 WeakPolarHBondContact O-CB 2.94Å; S194-K198 VanDerWaalsContact O-CG 3.32Å; S194-K198 WeakPolarHBondContact O-CG 3.47Å; S194-K198 PolarHBondContact O-N 2.93Å; T195-K198 PolarHBondContact O-N 3.06Å; K198-L200 PolarHBondContact O-N 3.22Å; K198-V201 PolarHBondContact O-N 3.08Å; K198-H202 WeakPolarHBondContact O-CB 3.49Å; K198-H202 PolarHBondContact O-N 2.97Å; K198-V215 HydrophobicContact CD-CG1 4.5Å; K198-V215 HydrophobicContact CG-CG1 3.71Å
199	N	89.8	Confident	87.2	Confident	102 Å²	102	64.5 Å²	64.5	55%	0.545	33%	0.333	S	S	.	.	H	α-helix	trans	-63.2	-41.2	177.2	-67.2	-17.6	0	0	0	112.1	T195 R196 F197 H202 H203	T195-N199 VanDerWaalsContact O-CG 3.29Å; T195-N199 PolarHBondContact O-N 3.06Å; T195-N199 PolarHBondContact O-ND2 3.02Å; R196-N199 PolarHBondContact O-N 2.71Å; F197-N199 VanDerWaalsContact C-N 3.33Å; F197-N199 PolarHBondContact O-N 2.6Å; N199-H202 PolarHBondContact O-N 2.76Å; N199-H203 WeakPolarHBondContact O-CB 3.44Å; N199-H203 PolarHBondContact O-N 2.79Å
200	L	88.9	Confident	86.8	Confident	5 Å²	5	63.4 Å²	63.4	3%	0.026	33%	0.333	C	S	.	.	H	α-helix	trans	-63.5	-45.4	177.1	-174.7	60.3	0	0	0	111.4	F139 F141 I179 L181 R196 F197 K198 H203 Y204	F139-L200 HydrophobicContact CD2-CD2 4.22Å; F139-L200 HydrophobicContact CE2-CD2 4.04Å; F141-L200 HydrophobicContact CE2-CD2 4.41Å; F141-L200 HydrophobicContact CE2-CG 4.3Å; F141-L200 HydrophobicContact CZ-CD2 3.77Å; F141-L200 HydrophobicContact CZ-CG 3.93Å; I179-L200 HydrophobicContact CB-CD1 4.1Å; I179-L200 HydrophobicContact CD1-CD1 3.63Å; I179-L200 HydrophobicContact CG1-CD1 3.72Å; L181-L200 HydrophobicContact CG-CD2 4.41Å; R196-L200 WeakPolarHBondContact O-CB 3.42Å; R196-L200 PolarHBondContact O-N 2.93Å; F197-L200 WeakPolarHBondContact O-CB 3.45Å; F197-L200 PolarHBondContact O-N 3.49Å; K198-L200 PolarHBondContact O-N 3.22Å; L200-H203 PolarHBondContact O-N 3.43Å; L200-Y204 HydrophobicContact CD1-CD2 3.98Å; L200-Y204 HydrophobicContact CD1-CE2 3.69Å; L200-Y204 HydrophobicContact CG-CD2 4.16Å; L200-Y204 HydrophobicContact CG-CE2 4.17Å; L200-Y204 WeakPolarHBondContact O-CD2 3.38Å; L200-Y204 PolarHBondContact O-N 2.62Å; L200-Y204 VanDerWaalsContact O-N 3.08Å
201	V	87.7	Confident	86.4	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.012	32%	0.324	C	S	.	.	H	α-helix	trans	-60.9	-46.1	175.8	172.7	0	0	0	0	110.8	F141 F197 K198 H203 Y204 Q205 V213 V215	F141-V201 HydrophobicContact CD1-CG2 4.09Å; F141-V201 HydrophobicContact CE1-CG2 3.85Å; F141-V201 HydrophobicContact CZ-CG2 4.4Å; F197-V201 HydrophobicContact CD1-CG2 4.17Å; F197-V201 HydrophobicContact CE1-CG2 3.8Å; F197-V201 HydrophobicContact CZ-CG2 4.04Å; F197-V201 WeakPolarHBondContact O-CG2 3.27Å; F197-V201 PolarHBondContact O-N 3Å; K198-V201 PolarHBondContact O-N 3.08Å; V201-H203 VanDerWaalsContact C-N 3.3Å; V201-H203 PolarHBondContact O-N 2.98Å; V201-Y204 PolarHBondContact O-N 2.7Å; V201-Q205 HydrophobicContact CG1-CG 4.18Å; V201-Q205 WeakPolarHBondContact O-CB 3.49Å; V201-Q205 WeakPolarHBondContact O-CG 3.49Å; V201-Q205 PolarHBondContact O-N 2.85Å; V201-V213 HydrophobicContact CG1-CB 3.92Å; V201-V213 HydrophobicContact CG1-CG1 4.23Å; V201-V213 HydrophobicContact CG1-CG2 4.13Å; V201-V213 HydrophobicContact CG2-CG1 4.32Å; V201-V215 HydrophobicContact CB-CG2 4.34Å; V201-V215 HydrophobicContact CG1-CG2 3.89Å; V201-V215 HydrophobicContact CG2-CG2 4.33Å
202	H	86.8	Confident	86	Confident	122 Å²	122	62.4 Å²	62.4	57%	0.565	34%	0.335	S	S	*	.	H	α-helix	trans	-61.2	-38.7	178.8	-174.7	64.7	0	0	0	112.8	K198 N199 Q205 S206	K198-H202 WeakPolarHBondContact O-CB 3.49Å; K198-H202 PolarHBondContact O-N 2.97Å; N199-H202 PolarHBondContact O-N 2.76Å; H202-Q205 PolarHBondContact O-N 2.86Å; H202-S206 WeakPolarHBondContact O-CB 3.12Å; H202-S206 PolarHBondContact O-N 2.86Å; H202-S206 PolarHBondContact O-OG 3.26Å
203	H	86.9	Confident	85.6	Confident	85 Å²	85	60.1 Å²	60.1	39%	0.394	32%	0.324	S	S	.	.	H	α-helix	trans	-62.1	-46.4	174.7	-177.7	66.1	0	0	0	111.7	I179 N199 L200 V201 S206 M207	I179-H203 VanDerWaalsContact CD1-CD2 3.46Å; I179-H203 WeakPolarHBondContact CD1-CD2 3.21Å; N199-H203 WeakPolarHBondContact O-CB 3.44Å; N199-H203 PolarHBondContact O-N 2.79Å; L200-H203 PolarHBondContact O-N 3.43Å; V201-H203 VanDerWaalsContact C-N 3.3Å; V201-H203 PolarHBondContact O-N 2.98Å; H203-S206 PolarHBondContact O-N 2.97Å; H203-M207 WeakPolarHBondContact CD2-CE 3.21Å; H203-M207 VanDerWaalsContact NE2-CE 3.32Å; H203-M207 WeakPolarHBondContact NE2-CE 3.36Å; H203-M207 PolarHBondContact O-N 2.9Å
204	Y	85.3	Confident	85.4	Confident	8 Å²	8	64.9 Å²	64.9	3%	0.031	35%	0.349	C	S	.	.	H	α-helix	trans	-68	-36.4	176.8	-85.1	-74.1	0	0	0	113.4	F141 H142 V145 P170 S174 L200 V201 S206 M207 Y208	F141-Y204 HydrophobicContact CD2-CD2 4.06Å; F141-Y204 HydrophobicContact CD2-CG 4.33Å; F141-Y204 AromaticContact CE2-CD2 3.54Å; F141-Y204 HydrophobicContact CE2-CD2 3.54Å; F141-Y204 AromaticContact CE2-CE2 3.8Å; F141-Y204 HydrophobicContact CE2-CE2 3.8Å; F141-Y204 HydrophobicContact CE2-CG 4.26Å; H142-Y204 AromaticContact CD2-CE2 3.8Å; H142-Y204 AromaticContact CD2-CZ 3.78Å; H142-Y204 AromaticContact NE2-CE2 3.52Å; H142-Y204 AromaticContact NE2-CZ 3.81Å; V145-Y204 HydrophobicContact CG1-CD1 4.21Å; V145-Y204 HydrophobicContact CG1-CE1 4.11Å; V145-Y204 HydrophobicContact CG2-CD1 3.92Å; V145-Y204 HydrophobicContact CG2-CE1 4.46Å; P170-Y204 PolarHBondContact O-OH 2.88Å; P170-Y204 VanDerWaalsContact O-OH 3.09Å; S174-Y204 WeakPolarHBondContact OG-CE2 3.5Å; S174-Y204 PolarHBondContact OG-OH 3.3Å; L200-Y204 HydrophobicContact CD1-CD2 3.98Å; L200-Y204 HydrophobicContact CD1-CE2 3.69Å; L200-Y204 HydrophobicContact CG-CD2 4.16Å; L200-Y204 HydrophobicContact CG-CE2 4.17Å; L200-Y204 WeakPolarHBondContact O-CD2 3.38Å; L200-Y204 PolarHBondContact O-N 2.62Å; L200-Y204 VanDerWaalsContact O-N 3.08Å; V201-Y204 PolarHBondContact O-N 2.7Å; Y204-S206 VanDerWaalsContact C-N 3.3Å; Y204-S206 PolarHBondContact O-N 3.22Å; Y204-M207 HydrophobicContact CD1-CE 3.75Å; Y204-M207 HydrophobicContact CE1-CE 4Å; Y204-M207 HydrophobicContact CG-CE 4.19Å; Y204-M207 PolarHBondContact O-N 3.15Å; Y204-Y208 HydrophobicContact CD1-CD2 4.25Å; Y204-Y208 HydrophobicContact CD1-CE2 4.3Å; Y204-Y208 PolarHBondContact O-N 3.02Å
205	Q	86.3	Confident	85.2	Confident	67 Å²	67	65.5 Å²	65.5	31%	0.313	35%	0.352	S	S	.	.	H	α-helix	trans	-65.6	-34.1	174.8	-75.5	-179.5	-36.4	0	0	112.4	V201 H202 M207 Y208 L211	V201-Q205 HydrophobicContact CG1-CG 4.18Å; V201-Q205 WeakPolarHBondContact O-CB 3.49Å; V201-Q205 WeakPolarHBondContact O-CG 3.49Å; V201-Q205 PolarHBondContact O-N 2.85Å; H202-Q205 PolarHBondContact O-N 2.86Å; Q205-M207 VanDerWaalsContact C-N 3.34Å; Q205-Y208 CarbonylContact O-C 3.21Å; Q205-Y208 PolarHBondContact O-N 3.43Å; Q205-L211 HydrophobicContact CG-CD2 4.5Å; Q205-L211 PolarHBondContact NE2-O 2.84Å
206	S	85.4	Confident	84.9	Confident	81 Å²	81	67.1 Å²	67.1	57%	0.566	36%	0.358	S	S	*	.	H	α-helix	trans	-68.5	-34.3	175.8	-60.5	0	0	0	0	112	H202 H203 Y204	H202-S206 WeakPolarHBondContact O-CB 3.12Å; H202-S206 PolarHBondContact O-N 2.86Å; H202-S206 PolarHBondContact O-OG 3.26Å; H203-S206 PolarHBondContact O-N 2.97Å; Y204-S206 VanDerWaalsContact C-N 3.3Å; Y204-S206 PolarHBondContact O-N 3.22Å
207	M	82.8	Confident	84.8	Confident	89 Å²	89	65 Å²	65	44%	0.438	36%	0.355	S	S	.	.	H	α-helix	trans	-79.2	-34.6	174.3	-69.4	-174.2	-69.3	0	0	112.7	H203 Y204 Q205	H203-M207 WeakPolarHBondContact CD2-CE 3.21Å; H203-M207 VanDerWaalsContact NE2-CE 3.32Å; H203-M207 WeakPolarHBondContact NE2-CE 3.36Å; H203-M207 PolarHBondContact O-N 2.9Å; Y204-M207 HydrophobicContact CD1-CE 3.75Å; Y204-M207 HydrophobicContact CE1-CE 4Å; Y204-M207 HydrophobicContact CG-CE 4.19Å; Y204-M207 PolarHBondContact O-N 3.15Å; Q205-M207 VanDerWaalsContact C-N 3.34Å
208	Y	82.8	Confident	84.6	Confident	30 Å²	30	66.2 Å²	66.2	12%	0.118	36%	0.361	C	S	.	.			trans	-127.6	88.5	-176.5	-60.3	-76.4	0	0	0	110.2	V145 Q149 Y204 Q205 S210 L211	V145-Y208 HydrophobicContact CG1-CD2 3.97Å; V145-Y208 HydrophobicContact CG1-CE2 3.56Å; V145-Y208 HydrophobicContact CG2-CD2 4.09Å; V145-Y208 HydrophobicContact CG2-CE2 4.5Å; Q149-Y208 HydrophobicContact CG-CE1 4.23Å; Q149-Y208 VanDerWaalsContact CG-OH 3.27Å; Q149-Y208 WeakPolarHBondContact CG-OH 3.45Å; Q149-Y208 PolarHBondContact NE2-OH 2.85Å; Y204-Y208 HydrophobicContact CD1-CD2 4.25Å; Y204-Y208 HydrophobicContact CD1-CE2 4.3Å; Y204-Y208 PolarHBondContact O-N 3.02Å; Q205-Y208 CarbonylContact O-C 3.21Å; Q205-Y208 PolarHBondContact O-N 3.43Å; Y208-S210 PolarHBondContact O-N 2.82Å; Y208-S210 VanDerWaalsContact O-N 3.08Å; Y208-L211 VanDerWaalsContact O-CB 3.24Å; Y208-L211 WeakPolarHBondContact O-CB 3.14Å; Y208-L211 PolarHBondContact O-N 3.41Å
209	P	78.7	Confident	84.5	Confident	122 Å²	122	61.9 Å²	61.9	79%	0.792	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-20.9	-177	-23.3	33.4	0	0	0	114.1	L211	P209-L211 VanDerWaalsContact C-N 3.27Å; P209-L211 PolarHBondContact O-N 3.47Å
210	S	77.4	Confident	84.4	Confident	77 Å²	77	64 Å²	64	54%	0.538	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-9.7	176.4	54.4	0	0	0	0	113.8	Y208 T212	Y208-S210 PolarHBondContact O-N 2.82Å; Y208-S210 VanDerWaalsContact O-N 3.08Å; S210-T212 PolarHBondContact O-N 2.92Å
211	L	80.2	Confident	84.4	Confident	8 Å²	8	68.4 Å²	68.4	4%	0.042	37%	0.366	C	S	.	.			trans	-80.2	105.8	-176.9	-174.4	71.3	0	0	0	111.1	F141 V144 V145 Q205 Y208 P209 V213	F141-L211 HydrophobicContact CB-CD1 4.29Å; F141-L211 HydrophobicContact CB-CD2 4.13Å; V144-L211 HydrophobicContact CB-CD1 3.83Å; V144-L211 HydrophobicContact CG1-CD1 3.57Å; V145-L211 HydrophobicContact CG2-CD1 4.19Å; V145-L211 HydrophobicContact CG2-CD2 3.93Å; Q205-L211 HydrophobicContact CG-CD2 4.5Å; Q205-L211 PolarHBondContact NE2-O 2.84Å; Y208-L211 VanDerWaalsContact O-CB 3.24Å; Y208-L211 WeakPolarHBondContact O-CB 3.14Å; Y208-L211 PolarHBondContact O-N 3.41Å; P209-L211 VanDerWaalsContact C-N 3.27Å; P209-L211 PolarHBondContact O-N 3.47Å; L211-V213 HydrophobicContact CD1-CG2 4.22Å; L211-V213 HydrophobicContact CD2-CG2 3.87Å; L211-V213 HydrophobicContact CG-CG2 3.72Å
212	T	78.9	Confident	84.4	Confident	138 Å²	138	69 Å²	69	85%	0.847	37%	0.368	S	S	*	.			trans	-94.7	122.3	170.1	1.6	0	0	0	0	109.6	S210	S210-T212 PolarHBondContact O-N 2.92Å
213	V	80.6	Confident	84.4	Confident	22 Å²	22	68.4 Å²	68.4	13%	0.133	36%	0.364	C	S	.	.			trans	-128.4	124.4	179.1	-173.4	0	0	0	0	108.8	F141 V201 L211 V215	F141-V213 HydrophobicContact CB-CG2 3.77Å; F141-V213 HydrophobicContact CD1-CG1 4.49Å; V201-V213 HydrophobicContact CG1-CB 3.92Å; V201-V213 HydrophobicContact CG1-CG1 4.23Å; V201-V213 HydrophobicContact CG1-CG2 4.13Å; V201-V213 HydrophobicContact CG2-CG1 4.32Å; L211-V213 HydrophobicContact CD1-CG2 4.22Å; L211-V213 HydrophobicContact CD2-CG2 3.87Å; L211-V213 HydrophobicContact CG-CG2 3.72Å; V213-V215 HydrophobicContact CG1-CG2 4.46Å; V213-V215 PolarHBondContact O-N 3.04Å
214	D	85.4	Confident	84.6	Confident	101 Å²	101	69.5 Å²	69.5	54%	0.54	37%	0.373	S	S	.	.			trans	-81.5	99.5	166.5	-170.8	-23.4	0	0	0	108.8	D216 D217 Q218	D214-D216 PolarHBondContact OD1-N 3Å; D214-D217 HydrophobicContact CB-CB 4.22Å; D214-D217 PolarHBondContact OD1-N 2.97Å; D214-D217 VanDerWaalsContact OD1-N 3.12Å; D214-Q218 WeakPolarHBondContact O-CB 3.28Å; D214-Q218 WeakPolarHBondContact O-CG 3.3Å; D214-Q218 PolarHBondContact O-N 3.04Å
215	V	84.9	Confident	84.7	Confident	28 Å²	28	71.3 Å²	71.3	17%	0.17	38%	0.381	C	S	.	.	H	α-helix	trans	-69.4	-40.4	-174.8	174.1	0	0	0	0	111.6	F197 K198 V201 V213 L219	F197-V215 HydrophobicContact CD1-CG1 4Å; F197-V215 HydrophobicContact CE1-CG1 3.99Å; K198-V215 HydrophobicContact CD-CG1 4.5Å; K198-V215 HydrophobicContact CG-CG1 3.71Å; V201-V215 HydrophobicContact CB-CG2 4.34Å; V201-V215 HydrophobicContact CG1-CG2 3.89Å; V201-V215 HydrophobicContact CG2-CG2 4.33Å; V213-V215 HydrophobicContact CG1-CG2 4.46Å; V213-V215 PolarHBondContact O-N 3.04Å; V215-L219 HydrophobicContact CG1-CD1 3.83Å; V215-L219 HydrophobicContact CG1-CG 4.33Å; V215-L219 WeakPolarHBondContact O-CB 3.43Å; V215-L219 VanDerWaalsContact O-CG 3.27Å; V215-L219 WeakPolarHBondContact O-CG 3.25Å; V215-L219 PolarHBondContact O-N 3.14Å
216	D	85.1	Confident	84.8	Confident	110 Å²	110	68.2 Å²	68.2	59%	0.588	37%	0.367	S	S	*	.	H	α-helix	trans	-75	-38.4	-172.5	-67.6	-37.9	0	0	0	111.1	D214 K220	D214-D216 PolarHBondContact OD1-N 3Å; D216-K220 WeakPolarHBondContact O-CB 3.38Å; D216-K220 PolarHBondContact O-N 3.33Å
217	D	86.6	Confident	84.9	Confident	65 Å²	65	69.2 Å²	69.2	35%	0.348	36%	0.363	S	S	.	.	H	α-helix	trans	-64.8	-43.1	173.4	-177.3	61.3	0	0	0	111.9	D214 K220 K221	D214-D217 HydrophobicContact CB-CB 4.22Å; D214-D217 PolarHBondContact OD1-N 2.97Å; D214-D217 VanDerWaalsContact OD1-N 3.12Å; D217-K220 PolarHBondContact O-N 2.62Å; D217-K221 WeakPolarHBondContact O-CG 3.4Å; D217-K221 PolarHBondContact O-N 2.92Å; D217-K221 IonicContact OD1-NZ 2.81Å; D217-K221 WeakPolarHBondContact OD2-CE 3.46Å; D217-K221 IonicContact OD2-NZ 3.27Å; D217-K221 PolarHBondContact OD2-NZ 3.16Å
218	Q	86	Confident	85.2	Confident	26 Å²	26	68.6 Å²	68.6	12%	0.121	36%	0.356	C	S	.	.	H	α-helix	trans	-65	-42.9	177.3	-74.3	-172.2	9.7	0	0	112.1	F197 D214 K220 K221 L222	F197-Q218 HydrophobicContact CE1-CB 4.38Å; F197-Q218 HydrophobicContact CZ-CB 4.08Å; D214-Q218 WeakPolarHBondContact O-CB 3.28Å; D214-Q218 WeakPolarHBondContact O-CG 3.3Å; D214-Q218 PolarHBondContact O-N 3.04Å; Q218-K220 VanDerWaalsContact C-N 3.32Å; Q218-K220 PolarHBondContact O-N 3.47Å; Q218-K221 PolarHBondContact O-N 2.9Å; Q218-L222 WeakPolarHBondContact O-CB 3.45Å; Q218-L222 WeakPolarHBondContact O-CG 3.49Å; Q218-L222 PolarHBondContact O-N 2.98Å
219	L	87.6	Confident	85.5	Confident	11 Å²	11	67.1 Å²	67.1	6%	0.058	35%	0.35	C	S	.	.	H	α-helix	trans	-61.5	-40.7	175.9	-76.2	174.5	0	0	0	111.8	F190 F193 F197 V215 L222 K223	F190-L219 HydrophobicContact CZ-CB 4.43Å; F190-L219 HydrophobicContact CZ-CD2 4.47Å; F190-L219 WeakPolarHBondContact CZ-O 3.44Å; F193-L219 HydrophobicContact CD1-CD2 4.13Å; F193-L219 HydrophobicContact CE1-CD2 3.89Å; F197-L219 HydrophobicContact CB-CD2 4.04Å; F197-L219 HydrophobicContact CD1-CD1 4.32Å; F197-L219 HydrophobicContact CD1-CD2 3.66Å; F197-L219 HydrophobicContact CD1-CG 3.85Å; F197-L219 HydrophobicContact CE1-CD2 4.28Å; F197-L219 HydrophobicContact CE1-CG 4.16Å; F197-L219 HydrophobicContact CG-CD2 3.86Å; V215-L219 HydrophobicContact CG1-CD1 3.83Å; V215-L219 HydrophobicContact CG1-CG 4.33Å; V215-L219 WeakPolarHBondContact O-CB 3.43Å; V215-L219 VanDerWaalsContact O-CG 3.27Å; V215-L219 WeakPolarHBondContact O-CG 3.25Å; V215-L219 PolarHBondContact O-N 3.14Å; L219-L222 PolarHBondContact O-N 3.42Å; L219-K223 PolarHBondContact O-N 3.47Å
220	K	88.9	Confident	86	Confident	147 Å²	147	67 Å²	67	64%	0.639	33%	0.334	S	S	*	.	H	α-helix	trans	-61.1	-48.4	176.5	-171.1	179.6	179.3	-176.4	0	111.6	D216 D217 Q218 L222 K223 D224	D216-K220 WeakPolarHBondContact O-CB 3.38Å; D216-K220 PolarHBondContact O-N 3.33Å; D217-K220 PolarHBondContact O-N 2.62Å; Q218-K220 VanDerWaalsContact C-N 3.32Å; Q218-K220 PolarHBondContact O-N 3.47Å; K220-L222 PolarHBondContact O-N 2.9Å; K220-K223 WeakPolarHBondContact O-CB 3.39Å; K220-K223 PolarHBondContact O-N 2.92Å; K220-D224 PolarHBondContact O-N 2.9Å
221	K	87.9	Confident	86.6	Confident	98 Å²	98	68 Å²	68	43%	0.426	34%	0.338	S	S	.	.	H	α-helix	trans	-60.7	-43.2	176.2	-72.6	170.2	177.5	163.9	0	112.2	D217 Q218 K223 D224 F225	D217-K221 WeakPolarHBondContact O-CG 3.4Å; D217-K221 PolarHBondContact O-N 2.92Å; D217-K221 IonicContact OD1-NZ 2.81Å; D217-K221 WeakPolarHBondContact OD2-CE 3.46Å; D217-K221 IonicContact OD2-NZ 3.27Å; D217-K221 PolarHBondContact OD2-NZ 3.16Å; Q218-K221 PolarHBondContact O-N 2.9Å; K221-K223 VanDerWaalsContact C-N 3.27Å; K221-K223 PolarHBondContact O-N 3.06Å; K221-D224 PolarHBondContact O-N 3.31Å; K221-F225 HydrophobicContact CB-CE2 4.3Å; K221-F225 WeakPolarHBondContact O-CD2 3.4Å; K221-F225 PolarHBondContact O-N 3.01Å
222	L	87.6	Confident	87.1	Confident	13 Å²	13	67.8 Å²	67.8	7%	0.068	34%	0.337	C	S	.	.	H	α-helix	trans	-62.4	-34.8	178	-73.2	169	0	0	0	112.1	L105 F139 L186 F193 F197 Q218 L219 K220 F225 A226	L105-L222 HydrophobicContact CD1-CD2 3.88Å; F139-L222 HydrophobicContact CD1-CD1 3.99Å; F139-L222 HydrophobicContact CD1-CD2 4.28Å; F139-L222 HydrophobicContact CE1-CD1 3.68Å; F139-L222 HydrophobicContact CE1-CD2 4.03Å; L186-L222 HydrophobicContact CD1-CB 4.25Å; F193-L222 HydrophobicContact CE1-CD1 4.06Å; F193-L222 HydrophobicContact CZ-CD1 4.11Å; F197-L222 HydrophobicContact CD2-CD1 4.33Å; F197-L222 HydrophobicContact CE2-CD1 3.93Å; F197-L222 HydrophobicContact CZ-CD1 4.33Å; Q218-L222 WeakPolarHBondContact O-CB 3.45Å; Q218-L222 WeakPolarHBondContact O-CG 3.49Å; Q218-L222 PolarHBondContact O-N 2.98Å; L219-L222 PolarHBondContact O-N 3.42Å; K220-L222 PolarHBondContact O-N 2.9Å; L222-F225 PolarHBondContact O-N 2.85Å; L222-A226 WeakPolarHBondContact O-CB 3.38Å; L222-A226 PolarHBondContact O-N 3.17Å
223	K	88	Confident	87.8	Confident	111 Å²	111	62.3 Å²	62.3	48%	0.483	30%	0.304	S	S	.	.	H	α-helix	trans	-63.5	-44.5	174.7	-168.5	176.9	179.1	178.2	0	112	F190 L219 K220 K221 F225 A226 E227	F190-K223 HydrophobicContact CD2-CG 4.47Å; F190-K223 HydrophobicContact CE1-CD 4.35Å; F190-K223 HydrophobicContact CE2-CB 3.76Å; F190-K223 HydrophobicContact CE2-CG 4.06Å; F190-K223 HydrophobicContact CZ-CB 3.76Å; F190-K223 HydrophobicContact CZ-CD 4.29Å; F190-K223 HydrophobicContact CZ-CG 4.2Å; L219-K223 PolarHBondContact O-N 3.47Å; K220-K223 WeakPolarHBondContact O-CB 3.39Å; K220-K223 PolarHBondContact O-N 2.92Å; K221-K223 VanDerWaalsContact C-N 3.27Å; K221-K223 PolarHBondContact O-N 3.06Å; K223-F225 VanDerWaalsContact C-N 3.33Å; K223-F225 PolarHBondContact O-N 3.43Å; K223-A226 WeakPolarHBondContact O-CB 3.4Å; K223-A226 PolarHBondContact O-N 2.9Å; K223-E227 PolarHBondContact O-N 3.45Å
224	D	89.2	Confident	88.4	Confident	108 Å²	108	68 Å²	68	58%	0.578	32%	0.323	S	S	*	.	H	α-helix	trans	-63.7	-41.3	177	-64.6	-22.2	0	0	0	111	K220 K221 A226 E227 R228	K220-D224 PolarHBondContact O-N 2.9Å; K221-D224 PolarHBondContact O-N 3.31Å; D224-A226 VanDerWaalsContact C-N 3.34Å; D224-A226 PolarHBondContact O-N 3.39Å; D224-E227 PolarHBondContact O-N 2.79Å; D224-R228 PolarHBondContact O-N 3.29Å
225	F	88	Confident	88.7	Confident	45 Å²	45	66.1 Å²	66.1	20%	0.197	31%	0.313	C	S	.	.	H	α-helix	trans	-66.8	-32.8	174.6	-69.7	-52.9	0	0	0	113.3	L105 P106 F109 K221 L222 K223 R228 L229	L105-F225 HydrophobicContact CB-CB 4.38Å; L105-F225 HydrophobicContact CB-CD2 4.4Å; L105-F225 HydrophobicContact CB-CG 4.35Å; L105-F225 HydrophobicContact CD1-CB 4.22Å; P106-F225 HydrophobicContact CB-CE2 4.34Å; P106-F225 HydrophobicContact CB-CZ 4.25Å; P106-F225 HydrophobicContact CG-CE2 3.91Å; P106-F225 HydrophobicContact CG-CZ 4.32Å; F109-F225 HydrophobicContact CB-CE1 4.28Å; F109-F225 AromaticContact CD2-CD1 3.23Å; F109-F225 HydrophobicContact CD2-CD1 3.23Å; F109-F225 AromaticContact CD2-CE1 3.56Å; F109-F225 HydrophobicContact CD2-CE1 3.56Å; F109-F225 HydrophobicContact CD2-CG 4.15Å; F109-F225 HydrophobicContact CE2-CB 4.08Å; F109-F225 AromaticContact CE2-CD1 3.47Å; F109-F225 HydrophobicContact CE2-CD1 3.47Å; F109-F225 VanDerWaalsContact CE2-CD1 3.47Å; F109-F225 HydrophobicContact CE2-CE1 4.27Å; F109-F225 HydrophobicContact CE2-CG 4.11Å; F109-F225 HydrophobicContact CG-CD1 4.18Å; F109-F225 HydrophobicContact CG-CE1 4.21Å; K221-F225 HydrophobicContact CB-CE2 4.3Å; K221-F225 WeakPolarHBondContact O-CD2 3.4Å; K221-F225 PolarHBondContact O-N 3.01Å; L222-F225 PolarHBondContact O-N 2.85Å; K223-F225 VanDerWaalsContact C-N 3.33Å; K223-F225 PolarHBondContact O-N 3.43Å; F225-R228 PolarHBondContact O-N 2.51Å; F225-L229 WeakPolarHBondContact O-CB 3.33Å; F225-L229 PolarHBondContact O-N 3.24Å
226	A	88.5	Confident	89	Confident	3 Å²	3	65 Å²	65	3%	0.025	31%	0.306	C	S	.	.	H	α-helix	trans	-62.2	-44.2	177.9	0	0	0	0	0	111.6	L186 L187 L222 K223 D224 L229 R230	L186-A226 HydrophobicContact CD1-CB 3.99Å; L186-A226 HydrophobicContact CD2-CB 4.03Å; L186-A226 HydrophobicContact CG-CB 3.72Å; L187-A226 HydrophobicContact CD2-CB 4.48Å; L222-A226 WeakPolarHBondContact O-CB 3.38Å; L222-A226 PolarHBondContact O-N 3.17Å; K223-A226 WeakPolarHBondContact O-CB 3.4Å; K223-A226 PolarHBondContact O-N 2.9Å; D224-A226 VanDerWaalsContact C-N 3.34Å; D224-A226 PolarHBondContact O-N 3.39Å; A226-L229 PolarHBondContact O-N 3.18Å; A226-R230 WeakPolarHBondContact O-CB 3.48Å; A226-R230 PolarHBondContact O-N 3.32Å
227	E	88.1	Confident	89.3	Confident	102 Å²	102	62.1 Å²	62.1	48%	0.477	29%	0.293	S	S	.	.	H	α-helix	trans	-65.6	-39.8	178	-67.9	-59	140.2	0	0	111.8	K223 D224 R230	K223-E227 PolarHBondContact O-N 3.45Å; D224-E227 PolarHBondContact O-N 2.79Å; E227-R230 VanDerWaalsContact CD-NH1 3.25Å; E227-R230 IonicContact OE1-CZ 3.58Å; E227-R230 IonicContact OE1-NH1 2.8Å; E227-R230 PolarHBondContact OE1-NH1 2.94Å; E227-R230 IonicContact OE1-NH2 3.73Å; E227-R230 PolarHBondContact OE1-NH2 3.06Å; E227-R230 IonicContact OE2-CZ 3.79Å; E227-R230 IonicContact OE2-NH1 3.88Å; E227-R230 PolarHBondContact OE2-NH1 3.01Å
228	R	87.9	Confident	89.5	Confident	75 Å²	75	65.7 Å²	65.7	28%	0.283	30%	0.302	S	S	.	.	H	α-helix	trans	-68.4	-34.9	174.7	-166.3	177.3	173.2	-171.1	-3.7	112.3	F109 D113 E126 D224 F225 P231 M232	F109-R228 HydrophobicContact CD1-CG 4.35Å; F109-R228 HydrophobicContact CE1-CB 4.24Å; F109-R228 VanDerWaalsContact CE1-CD 3.41Å; F109-R228 HydrophobicContact CE1-CG 3.59Å; F109-R228 HydrophobicContact CZ-CB 3.98Å; F109-R228 HydrophobicContact CZ-CG 3.87Å; D113-R228 IonicContact OD1-CZ 2.61Å; D113-R228 IonicContact OD1-NH1 3.36Å; D113-R228 IonicContact OD1-NH2 3.62Å; D113-R228 PolarHBondContact OD1-NH2 3.23Å; D113-R228 IonicContact OD2-NH1 2.9Å; D113-R228 PolarHBondContact OD2-NH1 2.72Å; E126-R228 IonicContact OE1-CZ 2.82Å; E126-R228 VanDerWaalsContact OE1-CZ 3.27Å; E126-R228 IonicContact OE1-NE 2.9Å; E126-R228 PolarHBondContact OE1-NE 2.93Å; E126-R228 IonicContact OE1-NH2 3.21Å; E126-R228 PolarHBondContact OE1-NH2 3.25Å; D224-R228 PolarHBondContact O-N 3.29Å; F225-R228 PolarHBondContact O-N 2.51Å; R228-P231 WeakPolarHBondContact O-CD 3.4Å; R228-M232 WeakPolarHBondContact O-CE 3.39Å
229	L	89.1	Confident	89.8	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-77.6	-32.5	-178.3	-169.1	70.1	0	0	0	112.8	L105 L108 F109 V131 V183 F225 A226 P231 M232 V233	L105-L229 HydrophobicContact CD2-CD1 4.41Å; L105-L229 HydrophobicContact CD2-CD2 3.74Å; L108-L229 HydrophobicContact CD2-CD1 4.44Å; F109-L229 HydrophobicContact CZ-CB 4.31Å; F109-L229 HydrophobicContact CZ-CD1 4.32Å; V131-L229 HydrophobicContact CG2-CD1 4.19Å; V183-L229 HydrophobicContact CG1-CD2 3.82Å; V183-L229 HydrophobicContact CG2-CD2 4.46Å; F225-L229 WeakPolarHBondContact O-CB 3.33Å; F225-L229 PolarHBondContact O-N 3.24Å; A226-L229 PolarHBondContact O-N 3.18Å; L229-P231 VanDerWaalsContact C-CD 3.42Å; L229-P231 VanDerWaalsContact O-N 3.16Å; L229-M232 HydrophobicContact CD1-CE 4.24Å; L229-M232 WeakPolarHBondContact O-CB 3.45Å; L229-M232 PolarHBondContact O-N 3.16Å; L229-V233 HydrophobicContact CD2-CG2 4.03Å; L229-V233 HydrophobicContact CG-CG2 3.72Å; L229-V233 PolarHBondContact O-N 3.45Å
230	R	89.3	Confident	90	Very high	119 Å²	119	64.9 Å²	64.9	45%	0.449	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-44.1	-46.9	-174.9	-171.4	176.3	-78.1	147.9	5.5	115.4	L187 A226 E227 M232 V233	L187-R230 HydrophobicContact CD2-CB 3.89Å; L187-R230 HydrophobicContact CD2-CG 4.22Å; A226-R230 WeakPolarHBondContact O-CB 3.48Å; A226-R230 PolarHBondContact O-N 3.32Å; E227-R230 VanDerWaalsContact CD-NH1 3.25Å; E227-R230 IonicContact OE1-CZ 3.58Å; E227-R230 IonicContact OE1-NH1 2.8Å; E227-R230 PolarHBondContact OE1-NH1 2.94Å; E227-R230 IonicContact OE1-NH2 3.73Å; E227-R230 PolarHBondContact OE1-NH2 3.06Å; E227-R230 IonicContact OE2-CZ 3.79Å; E227-R230 IonicContact OE2-NH1 3.88Å; E227-R230 PolarHBondContact OE2-NH1 3.01Å; R230-M232 PolarHBondContact O-N 2.78Å; R230-V233 PolarHBondContact O-N 3.42Å
231	P	90.1	Very high	90.1	Very high	98 Å²	98	64.2 Å²	64.2	64%	0.636	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-67.6	-19.7	-179.3	26.7	-36.2	0	0	0	114.5	R228 L229	R228-P231 WeakPolarHBondContact O-CD 3.4Å; L229-P231 VanDerWaalsContact C-CD 3.42Å; L229-P231 VanDerWaalsContact O-N 3.16Å
232	M	91.4	Very high	90.2	Very high	3 Å²	3	64 Å²	64	2%	0.015	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-90.8	-16	-178.7	-69.2	173.8	-86.3	0	0	112.9	F109 W125 E126 L129 I130 V131 R228 L229 R230	F109-M232 HydrophobicContact CE1-CE 3.98Å; F109-M232 HydrophobicContact CZ-CE 4.25Å; W125-M232 HydrophobicContact CZ3-SD 4.2Å; E126-M232 HydrophobicContact CB-CE 4.48Å; E126-M232 HydrophobicContact CB-SD 4.08Å; E126-M232 HydrophobicContact CG-CE 4.42Å; E126-M232 HydrophobicContact CG-SD 4.33Å; E126-M232 WeakPolarHBondContact O-CG 3.42Å; L129-M232 HydrophobicContact CB-SD 4.22Å; L129-M232 HydrophobicContact CD2-SD 4.07Å; L129-M232 WeakPolarHBondContact O-CG 3.28Å; I130-M232 CarbonylContact C-O 3.52Å; I130-M232 VanDerWaalsContact CA-O 3.31Å; I130-M232 WeakPolarHBondContact CA-O 3.33Å; V131-M232 HydrophobicContact CG2-CB 4.42Å; V131-M232 PolarHBondContact N-O 2.86Å; R228-M232 WeakPolarHBondContact O-CE 3.39Å; L229-M232 HydrophobicContact CD1-CE 4.24Å; L229-M232 WeakPolarHBondContact O-CB 3.45Å; L229-M232 PolarHBondContact O-N 3.16Å; R230-M232 PolarHBondContact O-N 2.78Å
233	V	93.2	Very high	90.3	Very high	24 Å²	24	63.5 Å²	63.5	15%	0.145	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	133.3	-173.1	-177.8	0	0	0	0	111.5	V131 D133 V183 L187 L229 R230	V131-V233 HydrophobicContact CB-CG2 4.37Å; V131-V233 WeakPolarHBondContact O-CA 3.39Å; D133-V233 HydrophobicContact CB-CG1 3.72Å; V183-V233 HydrophobicContact CG1-CB 4.3Å; V183-V233 HydrophobicContact CG1-CG1 3.78Å; V183-V233 HydrophobicContact CG1-CG2 3.49Å; V183-V233 VanDerWaalsContact CG1-CG2 3.49Å; L187-V233 HydrophobicContact CD1-CB 3.49Å; L187-V233 VanDerWaalsContact CD1-CB 3.49Å; L187-V233 HydrophobicContact CD1-CG1 3.67Å; L187-V233 HydrophobicContact CD1-CG2 3.56Å; L229-V233 HydrophobicContact CD2-CG2 4.03Å; L229-V233 HydrophobicContact CG-CG2 3.72Å; L229-V233 PolarHBondContact O-N 3.45Å; R230-V233 PolarHBondContact O-N 3.42Å
234	R	92.8	Very high	90.3	Very high	140 Å²	140	58.3 Å²	58.3	53%	0.528	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	165.9	173.1	-62	-171.8	179.4	-172	-1.5	110.6	I130 V131 D133 G236	I130-R234 HydrophobicContact CG2-CB 3.87Å; I130-R234 HydrophobicContact CG2-CG 4.04Å; V131-R234 PolarHBondContact O-N 2.86Å; D133-R234 PolarHBondContact N-O 3.23Å; D133-R234 VanDerWaalsContact N-O 3.08Å; R234-G236 PolarHBondContact O-N 3.34Å
235	D	93.3	Very high	90.2	Very high	63 Å²	63	56.8 Å²	56.8	34%	0.337	26%	0.257	S	S	.	.			trans	-65.4	105.8	164.7	-172.9	-45.9	0	0	0	108.3	R134 V237 Y238 Y239	R134-D235 IonicContact NH2-OD2 3.42Å; D235-V237 VanDerWaalsContact C-N 3.3Å; D235-V237 PolarHBondContact O-N 3.01Å; D235-V237 WeakPolarHBondContact OD1-CA 3.44Å; D235-V237 WeakPolarHBondContact OD1-CB 3.43Å; D235-V237 PolarHBondContact OD1-N 3.32Å; D235-Y238 PolarHBondContact OD1-N 3.47Å; D235-Y239 VanDerWaalsContact O-CB 3.27Å; D235-Y239 WeakPolarHBondContact O-CB 3.33Å; D235-Y239 PolarHBondContact O-N 3.41Å
236	G	89.6	Confident	90	Very high	3 Å²	3	56.2 Å²	56.2	3%	0.031	26%	0.264	C	S	.	.	H	α-helix	trans	-66.2	-32.3	-175.7	0	0	0	0	0	113	R234 M240	R234-G236 PolarHBondContact O-N 3.34Å; G236-M240 WeakPolarHBondContact O-CB 3.06Å; G236-M240 VanDerWaalsContact O-CG 3.29Å; G236-M240 WeakPolarHBondContact O-CG 3.42Å; G236-M240 PolarHBondContact O-N 3.41Å; G236-M240 VanDerWaalsContact O-N 3.08Å
237	V	91.6	Very high	89.8	Confident	51 Å²	51	60.1 Å²	60.1	31%	0.309	29%	0.289	S	S	.	.	H	α-helix	trans	-73.6	-47	-178	179.9	0	0	0	0	109.7	D235 M240 Y241	D235-V237 VanDerWaalsContact C-N 3.3Å; D235-V237 PolarHBondContact O-N 3.01Å; D235-V237 WeakPolarHBondContact OD1-CA 3.44Å; D235-V237 WeakPolarHBondContact OD1-CB 3.43Å; D235-V237 PolarHBondContact OD1-N 3.32Å; V237-M240 PolarHBondContact O-N 3.46Å; V237-Y241 WeakPolarHBondContact O-CB 3.39Å; V237-Y241 PolarHBondContact O-N 2.97Å
238	Y	92.4	Very high	89.7	Confident	139 Å²	139	61 Å²	61	55%	0.545	30%	0.303	S	S	.	.	H	α-helix	trans	-63.5	-43.5	176.9	-174.4	-105.2	0	0	0	111.5	D235 M240 Y241 E242	D235-Y238 PolarHBondContact OD1-N 3.47Å; Y238-M240 VanDerWaalsContact C-N 3.33Å; Y238-M240 PolarHBondContact O-N 3.22Å; Y238-Y241 WeakPolarHBondContact O-CB 3.34Å; Y238-Y241 PolarHBondContact O-N 2.86Å; Y238-Y241 VanDerWaalsContact O-N 3.14Å; Y238-E242 HydrophobicContact CD1-CG 4.17Å; Y238-E242 HydrophobicContact CE1-CG 3.77Å; Y238-E242 WeakPolarHBondContact CE1-OE1 3.48Å; Y238-E242 HydrophobicContact CE2-CG 4.39Å; Y238-E242 PolarHBondContact O-N 3.29Å; Y238-E242 PolarHBondContact OH-OE1 2.82Å
239	Y	91.9	Very high	89.8	Confident	19 Å²	19	60.7 Å²	60.7	8%	0.075	30%	0.304	C	S	.	.	H	α-helix	trans	-58.8	-43.5	177	-178.4	-96.7	0	0	0	112.4	I58 I94 L96 I130 D235 A243	I58-Y239 HydrophobicContact CD1-CE1 4.16Å; I58-Y239 HydrophobicContact CG2-CE1 4.49Å; I94-Y239 VanDerWaalsContact CD1-OH 3.27Å; I94-Y239 WeakPolarHBondContact CD1-OH 3.28Å; I94-Y239 WeakPolarHBondContact CG2-OH 2.95Å; L96-Y239 HydrophobicContact CD1-CD1 4.33Å; L96-Y239 HydrophobicContact CD2-CD1 4.16Å; I130-Y239 HydrophobicContact CD1-CD1 4.36Å; I130-Y239 HydrophobicContact CD1-CD2 4.01Å; I130-Y239 HydrophobicContact CD1-CE1 3.83Å; I130-Y239 HydrophobicContact CD1-CE2 3.42Å; I130-Y239 VanDerWaalsContact CD1-CE2 3.42Å; I130-Y239 HydrophobicContact CD1-CG 4.44Å; D235-Y239 VanDerWaalsContact O-CB 3.27Å; D235-Y239 WeakPolarHBondContact O-CB 3.33Å; D235-Y239 PolarHBondContact O-N 3.41Å; Y239-A243 WeakPolarHBondContact O-CB 3.35Å; Y239-A243 PolarHBondContact O-N 3.22Å
240	M	90.9	Very high	89.9	Confident	2 Å²	2	66 Å²	66	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-67	-39.7	175.6	-74.9	-59.4	-59.5	0	0	112	L96 G236 V237 Y238 E242 A243 L244 I251 L286 I288	L96-M240 HydrophobicContact CD2-CG 3.6Å; L96-M240 HydrophobicContact CD2-SD 3.31Å; L96-M240 WeakPolarHBondContact CD2-SD 3.19Å; G236-M240 WeakPolarHBondContact O-CB 3.06Å; G236-M240 VanDerWaalsContact O-CG 3.29Å; G236-M240 WeakPolarHBondContact O-CG 3.42Å; G236-M240 PolarHBondContact O-N 3.41Å; G236-M240 VanDerWaalsContact O-N 3.08Å; V237-M240 PolarHBondContact O-N 3.46Å; Y238-M240 VanDerWaalsContact C-N 3.33Å; Y238-M240 PolarHBondContact O-N 3.22Å; M240-E242 PolarHBondContact O-N 2.76Å; M240-A243 PolarHBondContact O-N 2.91Å; M240-L244 WeakPolarHBondContact O-CB 3.5Å; M240-L244 WeakPolarHBondContact O-CG 3.35Å; M240-L244 PolarHBondContact O-N 2.73Å; M240-I251 HydrophobicContact CE-CD1 4.3Å; M240-I251 HydrophobicContact CE-CG2 4.08Å; M240-L286 HydrophobicContact CE-CD1 4.36Å; M240-I288 HydrophobicContact CB-CG2 4.11Å; M240-I288 HydrophobicContact CE-CG2 3.95Å
241	Y	91	Very high	90	Very high	132 Å²	132	60.5 Å²	60.5	52%	0.518	31%	0.307	S	S	.	.	H	α-helix	trans	-59.7	-46.7	175.9	-179.1	-95.3	0	0	0	111.9	V237 Y238 L244 H245	V237-Y241 WeakPolarHBondContact O-CB 3.39Å; V237-Y241 PolarHBondContact O-N 2.97Å; Y238-Y241 WeakPolarHBondContact O-CB 3.34Å; Y238-Y241 PolarHBondContact O-N 2.86Å; Y238-Y241 VanDerWaalsContact O-N 3.14Å; Y241-L244 PolarHBondContact O-N 2.89Å; Y241-H245 AromaticContact CD2-CE1 3.43Å; Y241-H245 VanDerWaalsContact CD2-CE1 3.43Å; Y241-H245 WeakPolarHBondContact CD2-CE1 3.41Å; Y241-H245 AromaticContact CD2-ND1 3.56Å; Y241-H245 AromaticContact CE2-CE1 3.08Å; Y241-H245 WeakPolarHBondContact CE2-CE1 2.99Å; Y241-H245 AromaticContact CE2-ND1 3.43Å; Y241-H245 WeakPolarHBondContact CE2-ND1 3.31Å; Y241-H245 AromaticContact CE2-NE2 3.52Å; Y241-H245 AromaticContact CG-ND1 3.97Å; Y241-H245 AromaticContact CZ-CE1 3.71Å; Y241-H245 AromaticContact CZ-CG 3.97Å; Y241-H245 AromaticContact CZ-ND1 3.73Å; Y241-H245 AromaticContact CZ-NE2 3.86Å; Y241-H245 PolarHBondContact O-N 2.9Å; Y241-H245 PolarHBondContact O-ND1 2.94Å
242	E	91.2	Very high	90.2	Very high	95 Å²	95	56 Å²	56	44%	0.444	28%	0.277	S	S	.	.	H	α-helix	trans	-63.2	-40.3	175	-71.2	-169.7	138.6	0	0	112.4	Y238 M240 L244 G246	Y238-E242 HydrophobicContact CD1-CG 4.17Å; Y238-E242 HydrophobicContact CE1-CG 3.77Å; Y238-E242 WeakPolarHBondContact CE1-OE1 3.48Å; Y238-E242 HydrophobicContact CE2-CG 4.39Å; Y238-E242 PolarHBondContact O-N 3.29Å; Y238-E242 PolarHBondContact OH-OE1 2.82Å; M240-E242 PolarHBondContact O-N 2.76Å; E242-L244 VanDerWaalsContact C-N 3.26Å; E242-L244 PolarHBondContact O-N 2.9Å; E242-G246 WeakPolarHBondContact O-CA 3.22Å; E242-G246 PolarHBondContact O-N 2.91Å
243	A	89.1	Confident	90.3	Very high	2 Å²	2	55.9 Å²	55.9	2%	0.017	28%	0.277	C	S	.	.	H	α-helix	trans	-64.5	-32.7	176.7	0	0	0	0	0	112.5	N30 I58 Y239 M240 I251	N30-A243 PolarHBondContact ND2-O 3.24Å; I58-A243 HydrophobicContact CD1-CB 3.5Å; Y239-A243 WeakPolarHBondContact O-CB 3.35Å; Y239-A243 PolarHBondContact O-N 3.22Å; M240-A243 PolarHBondContact O-N 2.91Å; A243-I251 HydrophobicContact CB-CD1 3.99Å
244	L	87.6	Confident	90.2	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-78.7	-38.3	-179.7	-71.3	170.4	0	0	0	113.6	N30 V32 M240 Y241 E242 I251 I288 N292	N30-L244 HydrophobicContact CB-CD2 4.44Å; N30-L244 PolarHBondContact N-O 2.8Å; N30-L244 VanDerWaalsContact O-CD2 3.26Å; N30-L244 WeakPolarHBondContact O-CD2 3.34Å; V32-L244 HydrophobicContact CG2-CD2 3.65Å; M240-L244 WeakPolarHBondContact O-CB 3.5Å; M240-L244 WeakPolarHBondContact O-CG 3.35Å; M240-L244 PolarHBondContact O-N 2.73Å; Y241-L244 PolarHBondContact O-N 2.89Å; E242-L244 VanDerWaalsContact C-N 3.26Å; E242-L244 PolarHBondContact O-N 2.9Å; L244-I251 HydrophobicContact CD2-CD1 3.79Å; L244-I251 HydrophobicContact CG-CD1 4.29Å; L244-I288 HydrophobicContact CD1-CB 4.08Å; L244-I288 HydrophobicContact CD1-CG2 3.64Å; L244-N292 HydrophobicContact CD1-CB 4.2Å; L244-N292 HydrophobicContact CD2-CB 4.15Å
245	H	87.4	Confident	89.9	Confident	75 Å²	75	48.7 Å²	48.7	35%	0.347	25%	0.249	S	C	.	.	H	α-helix	trans	-97.9	-7.1	-176	-64.4	75.4	0	0	0	113.7	E29 Y241	E29-H245 IonicContact OE1-NE2 2.86Å; Y241-H245 AromaticContact CD2-CE1 3.43Å; Y241-H245 VanDerWaalsContact CD2-CE1 3.43Å; Y241-H245 WeakPolarHBondContact CD2-CE1 3.41Å; Y241-H245 AromaticContact CD2-ND1 3.56Å; Y241-H245 AromaticContact CE2-CE1 3.08Å; Y241-H245 WeakPolarHBondContact CE2-CE1 2.99Å; Y241-H245 AromaticContact CE2-ND1 3.43Å; Y241-H245 WeakPolarHBondContact CE2-ND1 3.31Å; Y241-H245 AromaticContact CE2-NE2 3.52Å; Y241-H245 AromaticContact CG-ND1 3.97Å; Y241-H245 AromaticContact CZ-CE1 3.71Å; Y241-H245 AromaticContact CZ-CG 3.97Å; Y241-H245 AromaticContact CZ-ND1 3.73Å; Y241-H245 AromaticContact CZ-NE2 3.86Å; Y241-H245 PolarHBondContact O-N 2.9Å; Y241-H245 PolarHBondContact O-ND1 2.94Å
246	G	84.3	Confident	89.4	Confident	33 Å²	33	46 Å²	46	34%	0.34	24%	0.235	S	C	.	.	S	Bend	trans	-80.5	-156.9	179.1	0	0	0	0	0	113.5	E242	E242-G246 WeakPolarHBondContact O-CA 3.22Å; E242-G246 PolarHBondContact O-N 2.91Å
247	P	84.8	Confident	89.2	Confident	86 Å²	86	47.1 Å²	47.1	56%	0.558	24%	0.24	S	C	*	.	S	Bend	trans	-60.5	161.2	176.8	28.1	-35.3	0	0	0	111.3	N30 K249	N30-P247 PolarHBondContact ND2-O 3.27Å; P247-K249 PolarHBondContact O-N 2.78Å
248	P	85.4	Confident	88.9	Confident	119 Å²	119	44.7 Å²	44.7	77%	0.773	23%	0.225	S	C	*	.			trans	-57	115.8	-179.3	22.4	-33	0	0	0	111	N30	N30-P248 VanDerWaalsContact OD1-CA 3.24Å; N30-P248 WeakPolarHBondContact OD1-CA 3.01Å
249	K	88.9	Confident	88.6	Confident	69 Å²	69	38 Å²	38	30%	0.3	20%	0.199	S	C	.	.			trans	-129.7	138.3	179.7	-75.2	-175.4	-178.5	-178	0	110.4	N30 D57 I58 P247	N30-K249 PolarHBondContact ND2-N 3.09Å; N30-K249 PolarHBondContact OD1-N 3.32Å; N30-K249 VanDerWaalsContact OD1-N 3.17Å; D57-K249 HydrophobicContact CB-CB 4.39Å; D57-K249 HydrophobicContact CB-CG 4.46Å; D57-K249 WeakPolarHBondContact OD2-CA 3.27Å; I58-K249 HydrophobicContact CD1-CD 4.18Å; P247-K249 PolarHBondContact O-N 2.78Å
250	K	90.9	Very high	88.3	Confident	113 Å²	113	37.1 Å²	37.1	49%	0.491	20%	0.196	S	C	.	.			trans	-86.9	111.3	172.5	-73.4	177.4	170.9	-177.5	0	109.4	E55 D57 I58	E55-K250 HydrophobicContact CB-CD 4.19Å; E55-K250 WeakPolarHBondContact O-CD 3.28Å; E55-K250 IonicContact OE2-NZ 2.73Å; E55-K250 PolarHBondContact OE2-NZ 2.75Å; D57-K250 PolarHBondContact N-O 3.44Å; D57-K250 PolarHBondContact OD2-N 3.07Å; I58-K250 PolarHBondContact N-O 3.4Å
251	I	92.5	Very high	88.1	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.9	179.6	-54.5	175.9	0	0	0	108.9	V32 T33 I58 M240 A243 L244	V32-I251 HydrophobicContact CG1-CG2 4.09Å; V32-I251 HydrophobicContact CG2-CB 4.27Å; V32-I251 HydrophobicContact CG2-CD1 4.44Å; V32-I251 HydrophobicContact CG2-CG2 4.19Å; T33-I251 PolarHBondContact N-O 3.29Å; I58-I251 HydrophobicContact CB-CG1 4.34Å; I58-I251 HydrophobicContact CB-CG2 4.39Å; I58-I251 HydrophobicContact CD1-CG1 4.35Å; I58-I251 WeakPolarHBondContact O-CA 3.43Å; M240-I251 HydrophobicContact CE-CD1 4.3Å; M240-I251 HydrophobicContact CE-CG2 4.08Å; A243-I251 HydrophobicContact CB-CD1 3.99Å; L244-I251 HydrophobicContact CD2-CD1 3.79Å; L244-I251 HydrophobicContact CG-CD1 4.29Å
252	L	93.9	Very high	88	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.021	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.3	178.1	179.6	63.9	0	0	0	110.1	T33 V35 V49 L52 A53 A56 I58 I59 C60	T33-L252 HydrophobicContact CG2-CD1 4.05Å; T33-L252 CarbonylContact O-C 3.58Å; T33-L252 WeakPolarHBondContact O-CA 3.39Å; V35-L252 HydrophobicContact CG2-CD1 3.87Å; V49-L252 HydrophobicContact CG1-CD2 3.98Å; L52-L252 HydrophobicContact CB-CD1 4Å; L52-L252 HydrophobicContact CB-CD2 3.69Å; L52-L252 HydrophobicContact CB-CG 4.5Å; L52-L252 HydrophobicContact CD1-CD1 3.94Å; A53-L252 HydrophobicContact CB-CD2 4.13Å; A56-L252 HydrophobicContact CB-CB 3.83Å; A56-L252 HydrophobicContact CB-CD2 4.41Å; I58-L252 PolarHBondContact O-N 2.85Å; I59-L252 CarbonylContact C-O 3.56Å; I59-L252 WeakPolarHBondContact CA-O 3.43Å; I59-L252 HydrophobicContact CG1-CB 4.42Å; I59-L252 HydrophobicContact CG1-CD2 4.42Å; I59-L252 HydrophobicContact CG2-CD2 4.49Å; C60-L252 PolarHBondContact N-O 3.02Å
253	V	93.7	Very high	87.8	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	120.7	174.2	-179	0	0	0	0	110	V32 T33 V34 V35 C60 C62 V282 L286	V32-V253 HydrophobicContact CG1-CB 4.31Å; V32-V253 HydrophobicContact CG1-CG2 3.25Å; T33-V253 PolarHBondContact O-N 2.73Å; V34-V253 HydrophobicContact CG1-CB 4.31Å; V34-V253 HydrophobicContact CG1-CG1 4.45Å; V34-V253 HydrophobicContact CG2-CB 4.3Å; V35-V253 PolarHBondContact N-O 2.92Å; C60-V253 HydrophobicContact CB-CG2 4.19Å; C60-V253 WeakPolarHBondContact O-CA 3.4Å; C62-V253 HydrophobicContact CB-CG1 4.07Å; V253-V282 HydrophobicContact CB-CG1 4.4Å; V253-V282 HydrophobicContact CG1-CG1 4.08Å; V253-V282 HydrophobicContact CG1-CG2 4.1Å; V253-V282 HydrophobicContact CG2-CG1 4.04Å; V253-L286 HydrophobicContact CG1-CD1 4.23Å; V253-L286 HydrophobicContact CG2-CD1 3.52Å
254	E	91.4	Very high	87.5	Confident	10 Å²	10	34.9 Å²	34.9	5%	0.047	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	109.5	170.9	-178.8	179.3	174.8	0	0	109.7	V49 C60 R61 H70 P85 S86	V49-E254 HydrophobicContact CG1-CB 4.33Å; V49-E254 HydrophobicContact CG1-CG 4.42Å; V49-E254 HydrophobicContact CG2-CB 4.39Å; V49-E254 HydrophobicContact CG2-CG 4.12Å; C60-E254 PolarHBondContact O-N 2.74Å; R61-E254 HydrophobicContact CG-CB 4.38Å; H70-E254 IonicContact CE1-OE1 2.81Å; H70-E254 PolarHBondContact CE1-OE1 2.82Å; H70-E254 IonicContact CE1-OE2 3.98Å; H70-E254 IonicContact CG-OE1 2.7Å; H70-E254 IonicContact ND1-OE1 3.67Å; H70-E254 PolarHBondContact ND1-OE1 2.87Å; H70-E254 IonicContact NE2-OE1 2.65Å; P85-E254 WeakPolarHBondContact CA-OE2 3.15Å; S86-E254 PolarHBondContact N-OE2 3.32Å; S86-E254 PolarHBondContact OG-OE2 2.99Å; S86-E254 VanDerWaalsContact OG-OE2 3.06Å
255	G	86.8	Confident	86.6	Confident	4 Å²	4	40 Å²	40	4%	0.041	22%	0.217	C	C	.	.			trans	-70.6	130.8	172	0	0	0	0	0	112.2	V35	V35-G255 VanDerWaalsContact O-CA 3.31Å; V35-G255 WeakPolarHBondContact O-CA 3.39Å; V35-G255 PolarHBondContact O-N 2.85Å
256	A	82.5	Confident	85.5	Confident	5 Å²	5	36.5 Å²	36.5	4%	0.041	20%	0.201	C	C	.	.			trans	-77.4	145.3	171	0	0	0	0	0	111.1	Q63 A258 C277	Q63-A256 VanDerWaalsContact O-CB 3.3Å; Q63-A256 WeakPolarHBondContact O-CB 3.35Å; A256-A258 PolarHBondContact O-N 2.75Å; A256-C277 PolarHBondContact O-SG 3.38Å; A256-C277 VanDerWaalsContact O-SG 3.41Å
257	N	84.2	Confident	84.9	Confident	27 Å²	27	35.4 Å²	35.4	14%	0.144	19%	0.19	C	C	.	.	S	Bend	trans	51.2	-136.8	176.2	-62.9	77.2	0	0	0	111.7	K45 N67 L261	K45-N257 WeakPolarHBondContact CE-O 3.08Å; K45-N257 PolarHBondContact NZ-O 3.47Å; N67-N257 PolarHBondContact ND2-OD1 3.34Å; N257-L261 HydrophobicContact CB-CB 4.43Å; N257-L261 HydrophobicContact CB-CD1 4.14Å
258	A	86.8	Confident	84.6	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.164	C	C	.	.			trans	-154	166.5	-176.7	0	0	0	0	0	111.3	Q39 E43 A256 L260 L261 C277	Q39-A258 WeakPolarHBondContact O-CB 3.03Å; E43-A258 WeakPolarHBondContact OE1-CB 3.04Å; A256-A258 PolarHBondContact O-N 2.75Å; A258-L260 VanDerWaalsContact C-N 3.34Å; A258-L260 PolarHBondContact O-N 2.95Å; A258-L261 PolarHBondContact O-N 3.39Å; A258-C277 VanDerWaalsContact O-CB 3.23Å; A258-C277 WeakPolarHBondContact O-CB 3.33Å
259	A	85.4	Confident	84.5	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-53.7	-45.4	-174.9	0	0	0	0	0	112.6	G37 L261 D262 V266 A352	G37-A259 WeakPolarHBondContact O-CB 3.47Å; G37-A259 PolarHBondContact O-N 3.22Å; A259-L261 PolarHBondContact O-N 2.94Å; A259-D262 WeakPolarHBondContact O-CB 3.45Å; A259-D262 PolarHBondContact O-N 2.97Å; A259-V266 HydrophobicContact CB-CB 4.19Å; A259-V266 HydrophobicContact CB-CG1 3.98Å; A259-V266 HydrophobicContact CB-CG2 4.39Å; A259-V266 VanDerWaalsContact O-CB 3.29Å; A259-V266 WeakPolarHBondContact O-CB 3.36Å; A259-A352 HydrophobicContact CB-CB 3.92Å
260	L	85.1	Confident	84.3	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-73.9	-0.1	-177.5	-61.6	154.8	0	0	0	114.4	Q39 W40 A258 V266 G267 T268 I348 F391	Q39-L260 VanDerWaalsContact C-CD1 3.46Å; Q39-L260 HydrophobicContact CB-CD1 4.42Å; Q39-L260 VanDerWaalsContact O-CB 3.28Å; Q39-L260 WeakPolarHBondContact O-CB 3.35Å; Q39-L260 PolarHBondContact O-N 2.82Å; W40-L260 VanDerWaalsContact CD1-CB 3.47Å; W40-L260 HydrophobicContact CD2-CB 3.8Å; W40-L260 HydrophobicContact CD2-CD1 3.43Å; W40-L260 VanDerWaalsContact CD2-CD1 3.43Å; W40-L260 HydrophobicContact CD2-CG 4.17Å; W40-L260 HydrophobicContact CE3-CD1 3.44Å; W40-L260 VanDerWaalsContact CE3-CD1 3.44Å; W40-L260 HydrophobicContact CG-CB 3.74Å; W40-L260 HydrophobicContact CG-CD1 4.08Å; W40-L260 HydrophobicContact CH2-CD1 3.77Å; W40-L260 HydrophobicContact CH2-CD2 4.37Å; W40-L260 HydrophobicContact CZ2-CB 4.17Å; W40-L260 HydrophobicContact CZ2-CD1 3.75Å; W40-L260 HydrophobicContact CZ2-CD2 3.92Å; W40-L260 HydrophobicContact CZ2-CG 4.18Å; W40-L260 HydrophobicContact CZ3-CD1 3.63Å; W40-L260 VanDerWaalsContact NE1-CB 3.34Å; A258-L260 VanDerWaalsContact C-N 3.34Å; A258-L260 PolarHBondContact O-N 2.95Å; L260-V266 HydrophobicContact CB-CG1 4.29Å; L260-V266 HydrophobicContact CD2-CG1 3.33Å; L260-V266 WeakPolarHBondContact CD2-O 3.4Å; L260-V266 HydrophobicContact CG-CG1 3.67Å; L260-G267 WeakPolarHBondContact O-CA 3.49Å; L260-T268 PolarHBondContact O-N 3.23Å; L260-T268 VanDerWaalsContact O-N 3.16Å; L260-I348 HydrophobicContact CD1-CB 3.78Å; L260-I348 HydrophobicContact CD1-CD1 3.59Å; L260-I348 HydrophobicContact CD1-CG1 4.04Å; L260-I348 HydrophobicContact CD1-CG2 4.19Å; L260-I348 HydrophobicContact CD2-CB 4.02Å; L260-I348 HydrophobicContact CD2-CG2 4.07Å; L260-I348 HydrophobicContact CG-CB 4.48Å; L260-F391 HydrophobicContact CD2-CE1 4.49Å; L260-F391 HydrophobicContact CD2-CZ 4.22Å
261	L	86.4	Confident	83.8	Confident	31 Å²	31	27.9 Å²	27.9	16%	0.162	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-106.4	2.6	170	-63.3	175.3	0	0	0	112.4	W40 N257 A258 A259 V272 T273	W40-L261 WeakPolarHBondContact O-CD1 3.41Å; N257-L261 HydrophobicContact CB-CB 4.43Å; N257-L261 HydrophobicContact CB-CD1 4.14Å; A258-L261 PolarHBondContact O-N 3.39Å; A259-L261 PolarHBondContact O-N 2.94Å; L261-V272 WeakPolarHBondContact O-CB 3.28Å; L261-T273 HydrophobicContact CB-CG2 4.41Å; L261-T273 WeakPolarHBondContact O-CG2 3.23Å; L261-T273 PolarHBondContact O-N 2.99Å
262	D	88.8	Confident	83.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.145	C	C	.	.			trans	-59.5	145.8	175.1	-174.5	-92.2	0	0	0	111.2	A259 D264 F265 G267 V272 N276 C277 T278	A259-D262 WeakPolarHBondContact O-CB 3.45Å; A259-D262 PolarHBondContact O-N 2.97Å; D262-D264 VanDerWaalsContact C-N 3.34Å; D262-D264 PolarHBondContact O-N 3.47Å; D262-D264 PolarHBondContact OD1-N 3.38Å; D262-F265 WeakPolarHBondContact OD1-CD2 3.33Å; D262-F265 PolarHBondContact OD1-N 2.87Å; D262-G267 WeakPolarHBondContact O-CA 3.43Å; D262-V272 WeakPolarHBondContact O-CB 3.35Å; D262-V272 VanDerWaalsContact O-CG1 3.32Å; D262-V272 WeakPolarHBondContact O-CG1 3.03Å; D262-N276 WeakPolarHBondContact OD2-CA 3.18Å; D262-C277 HydrophobicContact CB-CB 4.36Å; D262-C277 PolarHBondContact OD2-N 2.96Å; D262-T278 HydrophobicContact CB-CG2 4.12Å; D262-T278 WeakPolarHBondContact OD2-CG2 3.16Å; D262-T278 PolarHBondContact OD2-N 3.05Å; D262-T278 PolarHBondContact OD2-OG1 3.09Å
263	I	87.3	Confident	83	Confident	50 Å²	50	29.4 Å²	29.4	26%	0.256	15%	0.149	S	C	.	.	S	Bend	trans	-70.4	-27.3	-177.4	-173.9	58.2	0	0	0	113.6	Y269 V272 T273 S275	I263-Y269 HydrophobicContact CD1-CD2 4.3Å; I263-Y269 HydrophobicContact CD1-CE2 4.17Å; I263-V272 HydrophobicContact CD1-CG2 3.82Å; I263-T273 WeakPolarHBondContact CB-O 3.39Å; I263-T273 WeakPolarHBondContact CD1-O 3.46Å; I263-S275 PolarHBondContact N-O 3.31Å
264	D	83.1	Confident	82.6	Confident	102 Å²	102	31.6 Å²	31.6	55%	0.545	16%	0.164	S	C	.	.	S	Bend	trans	-108.8	-59.1	-168.4	-69	-60.4	0	0	0	113	D262 N276	D262-D264 VanDerWaalsContact C-N 3.34Å; D262-D264 PolarHBondContact O-N 3.47Å; D262-D264 PolarHBondContact OD1-N 3.38Å; D264-N276 PolarHBondContact OD2-ND2 3.24Å
265	F	69	Low	82.4	Confident	111 Å²	111	31.2 Å²	31.2	49%	0.487	16%	0.163	S	C	.	.	S	Bend	trans	-101.6	-65	-155.7	-50	-74.7	0	0	0	113.9	D262 Y351 I355	D262-F265 WeakPolarHBondContact OD1-CD2 3.33Å; D262-F265 PolarHBondContact OD1-N 2.87Å; F265-Y351 PolarHBondContact O-OH 3.06Å; F265-I355 HydrophobicContact CB-CD1 3.75Å; F265-I355 HydrophobicContact CB-CG1 4.49Å; F265-I355 HydrophobicContact CB-CG2 4.38Å; F265-I355 HydrophobicContact CD2-CG2 4.47Å
266	V	64.3	Low	82.5	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	-90.3	-16.4	-175.4	-174.3	0	0	0	0	111.2	A259 L260 T268 Y351 I355	A259-V266 HydrophobicContact CB-CB 4.19Å; A259-V266 HydrophobicContact CB-CG1 3.98Å; A259-V266 HydrophobicContact CB-CG2 4.39Å; A259-V266 VanDerWaalsContact O-CB 3.29Å; A259-V266 WeakPolarHBondContact O-CB 3.36Å; L260-V266 HydrophobicContact CB-CG1 4.29Å; L260-V266 HydrophobicContact CD2-CG1 3.33Å; L260-V266 WeakPolarHBondContact CD2-O 3.4Å; L260-V266 HydrophobicContact CG-CG1 3.67Å; V266-T268 PolarHBondContact O-N 3.34Å; V266-Y351 HydrophobicContact CB-CD1 4.19Å; V266-Y351 HydrophobicContact CB-CE1 4.21Å; V266-Y351 HydrophobicContact CG1-CD1 3.88Å; V266-Y351 HydrophobicContact CG1-CE1 4.36Å; V266-Y351 HydrophobicContact CG2-CD1 3.89Å; V266-Y351 HydrophobicContact CG2-CE1 3.92Å; V266-I355 HydrophobicContact CG2-CB 4.16Å; V266-I355 HydrophobicContact CG2-CD1 3.19Å; V266-I355 HydrophobicContact CG2-CG1 4.25Å; V266-I355 HydrophobicContact CG2-CG2 4.34Å
267	G	71.4	Confident	82.8	Confident	11 Å²	11	33 Å²	33	11%	0.113	17%	0.17	C	C	.	.			trans	-47.5	129.9	177.3	0	0	0	0	0	114.4	L260 D262 Y269	L260-G267 WeakPolarHBondContact O-CA 3.49Å; D262-G267 WeakPolarHBondContact O-CA 3.43Å; G267-Y269 PolarHBondContact O-N 3.25Å
268	T	78.9	Confident	83	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.018	17%	0.165	C	C	.	.			trans	-76.5	73.3	161.7	63.6	0	0	0	0	109.1	W40 L260 V266 F271 V272 R306 F391 M395 L398	W40-T268 HydrophobicContact CZ2-CG2 3.56Å; W40-T268 PolarHBondContact NE1-OG1 2.64Å; L260-T268 PolarHBondContact O-N 3.23Å; L260-T268 VanDerWaalsContact O-N 3.16Å; V266-T268 PolarHBondContact O-N 3.34Å; T268-F271 CarbonylContact O-C 3.59Å; T268-F271 WeakPolarHBondContact O-CA 3.47Å; T268-F271 WeakPolarHBondContact O-CB 3.26Å; T268-F271 PolarHBondContact O-N 3.26Å; T268-V272 VanDerWaalsContact C-CG1 3.44Å; T268-R306 PolarHBondContact OG1-NH1 3.48Å; T268-R306 VanDerWaalsContact OG1-NH1 3.09Å; T268-R306 PolarHBondContact OG1-NH2 2.81Å; T268-R306 VanDerWaalsContact OG1-NH2 3.1Å; T268-F391 HydrophobicContact CG2-CE1 4.2Å; T268-F391 HydrophobicContact CG2-CZ 3.9Å; T268-M395 HydrophobicContact CG2-CE 4.47Å; T268-M395 WeakPolarHBondContact O-CE 3.37Å; T268-L398 HydrophobicContact CG2-CD2 3.93Å
269	Y	83.7	Confident	83.3	Confident	146 Å²	146	33.3 Å²	33.3	57%	0.573	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	134.8	-179.5	-174.2	-85.8	0	0	0	111	I263 G267 V272 M395	I263-Y269 HydrophobicContact CD1-CD2 4.3Å; I263-Y269 HydrophobicContact CD1-CE2 4.17Å; G267-Y269 PolarHBondContact O-N 3.25Å; Y269-V272 HydrophobicContact CD2-CG2 3.76Å; Y269-V272 HydrophobicContact CE2-CG2 4.49Å; Y269-M395 WeakPolarHBondContact O-CE 3.5Å; Y269-M395 WeakPolarHBondContact O-CG 3.48Å
270	P	83.3	Confident	83.5	Confident	53 Å²	53	35 Å²	35	34%	0.344	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	cis	-89.6	1.8	9.8	35.3	-36.9	0	0	0	115.6	V272	P270-V272 PolarHBondContact O-N 2.97Å
271	F	82.2	Confident	83.7	Confident	26 Å²	26	35 Å²	35	11%	0.114	19%	0.191	C	C	.	.	S	Bend	trans	-82.8	59.3	-178.7	-53.4	-67.9	0	0	0	111.9	I161 T268 I309 M395	I161-F271 HydrophobicContact CG1-CD1 4.5Å; I161-F271 HydrophobicContact CG2-CD1 4.43Å; T268-F271 CarbonylContact O-C 3.59Å; T268-F271 WeakPolarHBondContact O-CA 3.47Å; T268-F271 WeakPolarHBondContact O-CB 3.26Å; T268-F271 PolarHBondContact O-N 3.26Å; F271-I309 HydrophobicContact CD1-CB 4.42Å; F271-I309 HydrophobicContact CE1-CB 4Å; F271-I309 HydrophobicContact CE1-CG2 4.16Å; F271-I309 VanDerWaalsContact CG-O 3.31Å; F271-I309 WeakPolarHBondContact CG-O 3.33Å; F271-I309 HydrophobicContact CZ-CB 4.4Å; F271-I309 HydrophobicContact CZ-CG2 4.08Å; F271-M395 HydrophobicContact CD2-CE 3.47Å; F271-M395 VanDerWaalsContact CD2-CE 3.47Å; F271-M395 HydrophobicContact CD2-SD 4Å; F271-M395 HydrophobicContact CE2-CE 4.15Å; F271-M395 HydrophobicContact CE2-SD 4.19Å; F271-M395 HydrophobicContact CG-CE 4.44Å
272	V	84.5	Confident	84	Confident	23 Å²	23	33.5 Å²	33.5	14%	0.139	18%	0.183	C	C	.	.	S	Bend	trans	-131.7	170.3	-174.4	-65.2	0	0	0	0	110.5	L261 D262 I263 T268 Y269 P270	L261-V272 WeakPolarHBondContact O-CB 3.28Å; D262-V272 WeakPolarHBondContact O-CB 3.35Å; D262-V272 VanDerWaalsContact O-CG1 3.32Å; D262-V272 WeakPolarHBondContact O-CG1 3.03Å; I263-V272 HydrophobicContact CD1-CG2 3.82Å; T268-V272 VanDerWaalsContact C-CG1 3.44Å; Y269-V272 HydrophobicContact CD2-CG2 3.76Å; Y269-V272 HydrophobicContact CE2-CG2 4.49Å; P270-V272 PolarHBondContact O-N 2.97Å
273	T	84.4	Confident	84.2	Confident	16 Å²	16	34.9 Å²	34.9	10%	0.098	19%	0.192	C	C	.	.			trans	-84.9	169.3	167.3	-163.9	0	0	0	0	110.9	L261 I263 S275 C277	L261-T273 HydrophobicContact CB-CG2 4.41Å; L261-T273 WeakPolarHBondContact O-CG2 3.23Å; L261-T273 PolarHBondContact O-N 2.99Å; I263-T273 WeakPolarHBondContact CB-O 3.39Å; I263-T273 WeakPolarHBondContact CD1-O 3.46Å; T273-S275 VanDerWaalsContact C-N 3.28Å; T273-S275 WeakPolarHBondContact CG2-OG 3.29Å; T273-S275 PolarHBondContact O-N 2.92Å; T273-C277 WeakPolarHBondContact CG2-SG 3.35Å
274	S	85.3	Confident	84.4	Confident	46 Å²	46	36.5 Å²	36.5	32%	0.322	21%	0.205	S	C	.	.	S	Bend	trans	-91.4	14.6	-178.4	-50.2	0	0	0	0	113.2	G169	G169-S274 WeakPolarHBondContact CA-OG 3.38Å
275	S	86.8	Confident	84.8	Confident	2 Å²	2	31.6 Å²	31.6	1%	0.014	18%	0.179	C	C	.	.	S	Bend	trans	-124.5	157	-179.2	63.8	0	0	0	0	111.6	Y172 I263 T273 C277	Y172-S275 WeakPolarHBondContact OH-CB 3.08Å; I263-S275 PolarHBondContact N-O 3.31Å; T273-S275 VanDerWaalsContact C-N 3.28Å; T273-S275 WeakPolarHBondContact CG2-OG 3.29Å; T273-S275 PolarHBondContact O-N 2.92Å; S275-C277 PolarHBondContact O-N 3.08Å
276	N	89.1	Confident	85.8	Confident	41 Å²	41	26.4 Å²	26.4	22%	0.219	16%	0.156	C	C	.	.			trans	-79	117.8	170.5	-62.7	103.7	0	0	0	110.7	Q63 D262 D264	Q63-N276 WeakPolarHBondContact CG-O 3.42Å; D262-N276 WeakPolarHBondContact OD2-CA 3.18Å; D264-N276 PolarHBondContact OD2-ND2 3.24Å
277	C	88	Confident	87	Confident	4 Å²	4	28.4 Å²	28.4	3%	0.027	18%	0.176	C	C	.	.			trans	-101.5	10.2	-179	-61.9	0	0	0	0	112.4	A256 A258 D262 T273 S275	A256-C277 PolarHBondContact O-SG 3.38Å; A256-C277 VanDerWaalsContact O-SG 3.41Å; A258-C277 VanDerWaalsContact O-CB 3.23Å; A258-C277 WeakPolarHBondContact O-CB 3.33Å; D262-C277 HydrophobicContact CB-CB 4.36Å; D262-C277 PolarHBondContact OD2-N 2.96Å; T273-C277 WeakPolarHBondContact CG2-SG 3.35Å; S275-C277 PolarHBondContact O-N 3.08Å
278	T	90.1	Very high	87.9	Confident	4 Å²	4	28.3 Å²	28.3	3%	0.025	17%	0.173	C	C	.	.	S	Bend	trans	-99.4	173	179.4	52.7	0	0	0	0	111.8	D262 G280 G281 I355 N356	D262-T278 HydrophobicContact CB-CG2 4.12Å; D262-T278 WeakPolarHBondContact OD2-CG2 3.16Å; D262-T278 PolarHBondContact OD2-N 3.05Å; D262-T278 PolarHBondContact OD2-OG1 3.09Å; T278-G280 PolarHBondContact O-N 3.35Å; T278-G281 WeakPolarHBondContact O-CA 3.35Å; T278-G281 PolarHBondContact O-N 3.25Å; T278-I355 HydrophobicContact CG2-CG2 3.7Å; T278-N356 WeakPolarHBondContact CA-OD1 3.41Å; T278-N356 WeakPolarHBondContact CB-OD1 3.32Å
279	V	91.9	Very high	88.5	Confident	30 Å²	30	31 Å²	31	18%	0.182	19%	0.191	C	C	.	.	H	α-helix	trans	-55.8	-32.2	179	70.2	0	0	0	0	112.9	L36 G281 V282 I293 V296 N356	L36-V279 HydrophobicContact CD1-CB 4.11Å; V279-G281 PolarHBondContact O-N 2.88Å; V279-V282 VanDerWaalsContact O-CB 3.27Å; V279-V282 WeakPolarHBondContact O-CB 3.42Å; V279-V282 PolarHBondContact O-N 3.19Å; V279-I293 HydrophobicContact CG2-CD1 3.83Å; V279-I293 HydrophobicContact CG2-CG2 4.2Å; V279-V296 HydrophobicContact CG2-CG2 4.13Å; V279-N356 PolarHBondContact N-OD1 3.14Å
280	G	89.9	Confident	88.8	Confident	36 Å²	36	28.7 Å²	28.7	37%	0.371	19%	0.194	S	C	.	.	H	α-helix	trans	-62	-30.7	174.8	0	0	0	0	0	113.2	T278 V282 C283 T284	T278-G280 PolarHBondContact O-N 3.35Å; G280-V282 PolarHBondContact O-N 3.36Å; G280-C283 PolarHBondContact O-N 3.17Å; G280-T284 PolarHBondContact O-N 3.48Å; G280-T284 PolarHBondContact O-OG1 2.93Å
281	G	90	Very high	89	Confident	0 Å²	0	32 Å²	32	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.7	-24.5	173.6	0	0	0	0	0	113.4	Q63 T278 V279 T284 G285	Q63-G281 WeakPolarHBondContact CG-O 3.15Å; Q63-G281 PolarHBondContact NE2-O 3.28Å; T278-G281 WeakPolarHBondContact O-CA 3.35Å; T278-G281 PolarHBondContact O-N 3.25Å; V279-G281 PolarHBondContact O-N 2.88Å; G281-T284 PolarHBondContact O-OG1 3.3Å; G281-G285 WeakPolarHBondContact O-CA 3.3Å; G281-G285 PolarHBondContact O-N 3.07Å
282	V	92.2	Very high	89.3	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-70.3	-47.7	175.4	-177.1	0	0	0	0	110.4	V34 V253 V279 G280 G285 L286 I288 I293	V34-V282 HydrophobicContact CG1-CG2 3.61Å; V34-V282 HydrophobicContact CG2-CG1 4.19Å; V34-V282 HydrophobicContact CG2-CG2 4.13Å; V253-V282 HydrophobicContact CB-CG1 4.4Å; V253-V282 HydrophobicContact CG1-CG1 4.08Å; V253-V282 HydrophobicContact CG1-CG2 4.1Å; V253-V282 HydrophobicContact CG2-CG1 4.04Å; V279-V282 VanDerWaalsContact O-CB 3.27Å; V279-V282 WeakPolarHBondContact O-CB 3.42Å; V279-V282 PolarHBondContact O-N 3.19Å; G280-V282 PolarHBondContact O-N 3.36Å; V282-G285 PolarHBondContact O-N 2.76Å; V282-L286 HydrophobicContact CG1-CD1 3.98Å; V282-L286 WeakPolarHBondContact O-CB 3.35Å; V282-L286 PolarHBondContact O-N 3.16Å; V282-I288 HydrophobicContact CG1-CD1 3.94Å; V282-I293 HydrophobicContact CB-CD1 4.42Å; V282-I293 HydrophobicContact CG1-CD1 4.49Å
283	C	92.6	Very high	89.7	Confident	28 Å²	28	31.2 Å²	31.2	19%	0.189	20%	0.203	C	C	.	.	H	α-helix	trans	-58.9	-51.4	177.1	-61.6	0	0	0	0	111.2	G280 G285 G287 I288 I293	G280-C283 PolarHBondContact O-N 3.17Å; C283-G285 VanDerWaalsContact C-N 3.34Å; C283-G285 PolarHBondContact O-N 3.15Å; C283-G287 WeakPolarHBondContact O-CA 3.28Å; C283-G287 PolarHBondContact O-N 3.09Å; C283-I288 PolarHBondContact O-N 2.74Å; C283-I293 WeakPolarHBondContact SG-CD1 3.37Å
284	T	92.3	Very high	90	Very high	84 Å²	84	31.4 Å²	31.4	52%	0.515	21%	0.209	S	C	.	.	H	α-helix	trans	-72.5	-28.4	-176.8	60.5	0	0	0	0	112.9	Q63 N99 G280 G281	Q63-T284 PolarHBondContact NE2-OG1 2.81Å; Q63-T284 VanDerWaalsContact NE2-OG1 3.15Å; N99-T284 PolarHBondContact ND2-O 3.45Å; G280-T284 PolarHBondContact O-N 3.48Å; G280-T284 PolarHBondContact O-OG1 2.93Å; G281-T284 PolarHBondContact O-OG1 3.3Å
285	G	91.4	Very high	90.4	Very high	0 Å²	0	33 Å²	33	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-87.1	-18.6	-175.7	0	0	0	0	0	115.3	C62 Q63 G98 N99 G100 G281 V282 C283	C62-G285 VanDerWaalsContact O-CA 3.26Å; C62-G285 WeakPolarHBondContact O-CA 3.28Å; Q63-G285 VanDerWaalsContact NE2-CA 3.33Å; G98-G285 CarbonylContact C-O 3.57Å; G98-G285 WeakPolarHBondContact CA-O 3.49Å; N99-G285 PolarHBondContact N-O 3.4Å; N99-G285 PolarHBondContact OD1-O 3.43Å; G100-G285 PolarHBondContact N-O 2.84Å; G100-G285 VanDerWaalsContact N-O 3.16Å; G281-G285 WeakPolarHBondContact O-CA 3.3Å; G281-G285 PolarHBondContact O-N 3.07Å; V282-G285 PolarHBondContact O-N 2.76Å; C283-G285 VanDerWaalsContact C-N 3.34Å; C283-G285 PolarHBondContact O-N 3.15Å
286	L	90.8	Very high	90.8	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-119.9	-10.5	177.9	-61.3	174.5	0	0	0	113.5	C60 C62 L96 M240 V253 V282 I288	C60-L286 HydrophobicContact CB-CD1 3.98Å; C60-L286 HydrophobicContact CB-CD2 3.91Å; C62-L286 HydrophobicContact CB-CD1 4.2Å; C62-L286 HydrophobicContact CB-CD2 4.27Å; C62-L286 HydrophobicContact CB-CG 3.83Å; L96-L286 HydrophobicContact CD2-CD2 4.31Å; M240-L286 HydrophobicContact CE-CD1 4.36Å; V253-L286 HydrophobicContact CG1-CD1 4.23Å; V253-L286 HydrophobicContact CG2-CD1 3.52Å; V282-L286 HydrophobicContact CG1-CD1 3.98Å; V282-L286 WeakPolarHBondContact O-CB 3.35Å; V282-L286 PolarHBondContact O-N 3.16Å; L286-I288 HydrophobicContact CB-CG1 4.48Å; L286-I288 HydrophobicContact CB-CG2 4.03Å
287	G	89.4	Confident	91.1	Very high	41 Å²	41	31.6 Å²	31.6	42%	0.423	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	30.9	-177.9	0	0	0	0	0	113.5	C283	C283-G287 WeakPolarHBondContact O-CA 3.28Å; C283-G287 PolarHBondContact O-N 3.09Å
288	I	89.8	Confident	91.4	Very high	9 Å²	9	31.4 Å²	31.4	5%	0.046	20%	0.204	C	C	.	.			trans	-102.3	147.7	-177.8	67.4	171.9	0	0	0	111.9	V32 M240 L244 V282 C283 L286 I293	V32-I288 HydrophobicContact CB-CD1 4.3Å; V32-I288 HydrophobicContact CG1-CD1 4.47Å; V32-I288 HydrophobicContact CG2-CD1 3.86Å; M240-I288 HydrophobicContact CB-CG2 4.11Å; M240-I288 HydrophobicContact CE-CG2 3.95Å; L244-I288 HydrophobicContact CD1-CB 4.08Å; L244-I288 HydrophobicContact CD1-CG2 3.64Å; V282-I288 HydrophobicContact CG1-CD1 3.94Å; C283-I288 PolarHBondContact O-N 2.74Å; L286-I288 HydrophobicContact CB-CG1 4.48Å; L286-I288 HydrophobicContact CB-CG2 4.03Å; I288-I293 HydrophobicContact CD1-CG1 4.22Å
289	P	90.6	Very high	91.6	Very high	60 Å²	60	31.2 Å²	31.2	39%	0.39	20%	0.203	S	C	.	.			trans	-67	148.2	172.1	-11.9	25.6	0	0	0	111.3	L291 N292	P289-L291 PolarHBondContact O-N 3.37Å; P289-N292 WeakPolarHBondContact CB-OD1 3.39Å; P289-N292 WeakPolarHBondContact CD-OD1 3.48Å; P289-N292 WeakPolarHBondContact CG-OD1 3.31Å; P289-N292 PolarHBondContact O-N 3.1Å; P289-N292 VanDerWaalsContact O-N 3.11Å
290	P	89.5	Confident	91.6	Very high	98 Å²	98	29.8 Å²	29.8	64%	0.636	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-62.5	-23.2	176.1	25.5	-34.3	0	0	0	113.3	N292 I293	P290-N292 PolarHBondContact O-N 3.47Å; P290-I293 PolarHBondContact O-N 2.91Å
291	L	88.8	Confident	91.8	Very high	122 Å²	122	28 Å²	28	64%	0.639	18%	0.177	S	C	*	.	G	3₁₀ helix	trans	-65.4	-24.5	176.8	-65.8	172.8	0	0	0	113.1	P289 I293	P289-L291 PolarHBondContact O-N 3.37Å; L291-I293 VanDerWaalsContact C-N 3.29Å
292	N	88.5	Confident	91.9	Very high	3 Å²	3	28.1 Å²	28.1	2%	0.016	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-86.3	-1.1	179.4	-61.9	94.5	0	0	0	112.8	E29 K31 V32 L244 P289 P290	E29-N292 PolarHBondContact OE2-ND2 3.02Å; K31-N292 CarbonylContact C-O 3.56Å; K31-N292 WeakPolarHBondContact CA-O 3.41Å; V32-N292 PolarHBondContact N-O 2.72Å; L244-N292 HydrophobicContact CD1-CB 4.2Å; L244-N292 HydrophobicContact CD2-CB 4.15Å; P289-N292 WeakPolarHBondContact CB-OD1 3.39Å; P289-N292 WeakPolarHBondContact CD-OD1 3.48Å; P289-N292 WeakPolarHBondContact CG-OD1 3.31Å; P289-N292 PolarHBondContact O-N 3.1Å; P289-N292 VanDerWaalsContact O-N 3.11Å; P290-N292 PolarHBondContact O-N 3.47Å
293	I	91.6	Very high	91.9	Very high	29 Å²	29	28.1 Å²	28.1	15%	0.149	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	123.1	173.1	-59.9	-176.4	0	0	0	108.4	V34 V279 V282 C283 I288 P290 L291 V296	V34-I293 HydrophobicContact CG2-CG2 4.15Å; V279-I293 HydrophobicContact CG2-CD1 3.83Å; V279-I293 HydrophobicContact CG2-CG2 4.2Å; V282-I293 HydrophobicContact CB-CD1 4.42Å; V282-I293 HydrophobicContact CG1-CD1 4.49Å; C283-I293 WeakPolarHBondContact SG-CD1 3.37Å; I288-I293 HydrophobicContact CD1-CG1 4.22Å; P290-I293 PolarHBondContact O-N 2.91Å; L291-I293 VanDerWaalsContact C-N 3.29Å; I293-V296 HydrophobicContact CG2-CG2 3.66Å
294	G	91.8	Very high	92	Very high	20 Å²	20	26.8 Å²	26.8	21%	0.206	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-114.3	176	0	0	0	0	0	111.2	V32	V32-G294 PolarHBondContact O-N 3.48Å
295	D	93.6	Very high	91.9	Very high	79 Å²	79	22.9 Å²	22.9	42%	0.422	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	130.3	-179	-67.8	-53.3	0	0	0	112.1	T33 V34 F297 T359	T33-D295 CarbonylContact C-O 3.55Å; T33-D295 WeakPolarHBondContact CA-O 3.5Å; T33-D295 HydrophobicContact CG2-CB 4.41Å; V34-D295 PolarHBondContact N-O 2.83Å; D295-F297 HydrophobicContact CB-CE1 4.01Å; D295-F297 HydrophobicContact CB-CE2 4.05Å; D295-F297 HydrophobicContact CB-CZ 3.63Å; D295-T359 PolarHBondContact OD1-OG1 3.4Å
296	V	95	Very high	91.8	Very high	6 Å²	6	23.1 Å²	23.1	4%	0.036	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	107.4	175.5	-172.4	0	0	0	0	108.2	V34 L36 V279 I293 F358 T359	V34-V296 HydrophobicContact CB-CG1 4.31Å; V34-V296 HydrophobicContact CB-CG2 4.43Å; L36-V296 HydrophobicContact CD1-CG1 3.94Å; L36-V296 HydrophobicContact CG-CG1 4.44Å; V279-V296 HydrophobicContact CG2-CG2 4.13Å; I293-V296 HydrophobicContact CG2-CG2 3.66Å; V296-F358 HydrophobicContact CG1-CD1 3.93Å; V296-F358 HydrophobicContact CG1-CE1 4.3Å; V296-F358 CarbonylContact O-C 3.52Å; V296-F358 WeakPolarHBondContact O-CA 3.49Å; V296-T359 PolarHBondContact N-OG1 3.35Å; V296-T359 VanDerWaalsContact N-OG1 3.15Å; V296-T359 PolarHBondContact O-N 3.36Å; V296-T359 PolarHBondContact O-OG1 3.33Å
297	F	95	Very high	91.4	Very high	8 Å²	8	26.4 Å²	26.4	4%	0.035	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	120.7	-179.8	-58.7	-52	0	0	0	111.2	T33 V34 V35 L36 L52 D295 A360 K444 W445	T33-F297 HydrophobicContact CG2-CD2 3.69Å; T33-F297 HydrophobicContact CG2-CE2 3.37Å; T33-F297 HydrophobicContact CG2-CZ 4.42Å; V34-F297 PolarHBondContact O-N 2.88Å; V35-F297 HydrophobicContact CG2-CD2 4.43Å; L36-F297 PolarHBondContact N-O 3.31Å; L52-F297 HydrophobicContact CD1-CD2 3.83Å; L52-F297 HydrophobicContact CD1-CE2 4.01Å; D295-F297 HydrophobicContact CB-CE1 4.01Å; D295-F297 HydrophobicContact CB-CE2 4.05Å; D295-F297 HydrophobicContact CB-CZ 3.63Å; F297-A360 WeakPolarHBondContact CA-O 3.47Å; F297-A360 HydrophobicContact CD1-CB 3.89Å; F297-A360 HydrophobicContact CE1-CB 3.99Å; F297-K444 HydrophobicContact CE1-CD 4.19Å; F297-W445 HydrophobicContact CB-CZ3 4.31Å; F297-W445 HydrophobicContact CD1-CH2 4.21Å; F297-W445 AromaticContact CD1-CZ3 3.65Å; F297-W445 HydrophobicContact CD1-CZ3 3.65Å; F297-W445 AromaticContact CD2-CH2 3.91Å; F297-W445 HydrophobicContact CD2-CH2 3.91Å; F297-W445 AromaticContact CD2-CZ3 3.8Å; F297-W445 HydrophobicContact CD2-CZ3 3.8Å; F297-W445 AromaticContact CE1-CH2 3.96Å; F297-W445 HydrophobicContact CE1-CH2 3.96Å; F297-W445 AromaticContact CE1-CZ3 3.82Å; F297-W445 HydrophobicContact CE1-CZ3 3.82Å; F297-W445 AromaticContact CE2-CH2 3.61Å; F297-W445 HydrophobicContact CE2-CH2 3.61Å; F297-W445 AromaticContact CE2-CZ3 3.94Å; F297-W445 HydrophobicContact CE2-CZ3 3.94Å; F297-W445 HydrophobicContact CG-CH2 4.2Å; F297-W445 AromaticContact CG-CZ3 3.64Å; F297-W445 HydrophobicContact CG-CZ3 3.64Å; F297-W445 AromaticContact CZ-CH2 3.66Å; F297-W445 HydrophobicContact CZ-CH2 3.66Å; F297-W445 AromaticContact CZ-CZ3 3.97Å; F297-W445 HydrophobicContact CZ-CZ3 3.97Å
298	G	94.2	Very high	90.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	116.8	173.5	0	0	0	0	0	110.8	F358 A360 I361 A362	G298-F358 VanDerWaalsContact CA-CD1 3.44Å; G298-F358 VanDerWaalsContact CA-CE1 3.41Å; G298-A360 PolarHBondContact N-O 2.88Å; G298-I361 CarbonylContact O-C 3.55Å; G298-I361 WeakPolarHBondContact O-CA 3.18Å; G298-I361 WeakPolarHBondContact O-CG2 3.45Å; G298-A362 PolarHBondContact O-N 2.9Å
299	V	93.9	Very high	90	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	117.3	175.5	-170.4	0	0	0	0	108.7	V35 L36 A38 E43 K45 V48 A362 T364	V35-V299 HydrophobicContact CG1-CG2 3.47Å; V35-V299 VanDerWaalsContact CG1-CG2 3.47Å; L36-V299 PolarHBondContact O-N 2.96Å; A38-V299 WeakPolarHBondContact CB-O 3.47Å; A38-V299 PolarHBondContact N-O 3.25Å; E43-V299 HydrophobicContact CB-CB 4.34Å; E43-V299 HydrophobicContact CB-CG1 3.84Å; E43-V299 WeakPolarHBondContact O-CG1 3.33Å; K45-V299 HydrophobicContact CB-CG2 4.4Å; K45-V299 HydrophobicContact CG-CB 3.78Å; K45-V299 HydrophobicContact CG-CG1 4.19Å; K45-V299 HydrophobicContact CG-CG2 3.8Å; V48-V299 HydrophobicContact CB-CG2 4.27Å; V48-V299 HydrophobicContact CG1-CG2 4.49Å; V48-V299 HydrophobicContact CG2-CG1 4.31Å; V48-V299 HydrophobicContact CG2-CG2 4.01Å; V299-A362 HydrophobicContact CG1-CB 4.46Å; V299-A362 HydrophobicContact CG2-CB 4.29Å; V299-T364 HydrophobicContact CG1-CG2 3.77Å
300	S	93.7	Very high	89.6	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	137.4	178	-174.5	0	0	0	0	110	Q39 L349 A362 L363 T364	Q39-S300 PolarHBondContact NE2-OG 3.42Å; Q39-S300 VanDerWaalsContact NE2-OG 3.15Å; S300-L349 WeakPolarHBondContact OG-CD2 3.35Å; S300-A362 PolarHBondContact N-O 3.18Å; S300-A362 VanDerWaalsContact O-O 3.08Å; S300-L363 CarbonylContact O-C 3.52Å; S300-L363 VanDerWaalsContact O-CA 3.26Å; S300-L363 WeakPolarHBondContact O-CA 3.31Å; S300-T364 PolarHBondContact O-N 3.36Å; S300-T364 PolarHBondContact O-OG1 3.07Å
301	K	93.3	Very high	89.3	Confident	0 Å²	0	22 Å²	22	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	149.2	171.5	-169.9	-176.3	-60.2	-178.6	0	109.5	Q39 D42 E43 Y303 T305 E330 L344 T364 K365	Q39-K301 PolarHBondContact NE2-O 2.96Å; Q39-K301 VanDerWaalsContact NE2-O 3.08Å; Q39-K301 VanDerWaalsContact OE1-CB 3.29Å; D42-K301 WeakPolarHBondContact O-CE 3.43Å; D42-K301 PolarHBondContact O-NZ 2.96Å; E43-K301 HydrophobicContact CB-CB 4.49Å; K301-Y303 CarbonylContact C-O 3.49Å; K301-Y303 WeakPolarHBondContact CB-O 3.3Å; K301-Y303 HydrophobicContact CD-CD1 4.17Å; K301-Y303 HydrophobicContact CD-CD2 3.91Å; K301-Y303 HydrophobicContact CD-CE1 3.8Å; K301-Y303 HydrophobicContact CD-CE2 3.53Å; K301-Y303 HydrophobicContact CD-CG 4.21Å; K301-Y303 VanDerWaalsContact CD-CZ 3.48Å; K301-Y303 HydrophobicContact CG-CD1 4.02Å; K301-Y303 HydrophobicContact CG-CE1 3.89Å; K301-Y303 HydrophobicContact CG-CE2 4.42Å; K301-Y303 HydrophobicContact CG-CG 4.34Å; K301-Y303 WeakPolarHBondContact CG-O 3.38Å; K301-Y303 PolarHBondContact O-N 2.82Å; K301-T305 HydrophobicContact CD-CG2 4.17Å; K301-T305 PolarHBondContact NZ-OG1 3.43Å; K301-E330 IonicContact NZ-OE1 2.68Å; K301-E330 PolarHBondContact NZ-OE1 3.49Å; K301-E330 IonicContact NZ-OE2 3.49Å; K301-E330 PolarHBondContact NZ-OE2 2.95Å; K301-L344 WeakPolarHBondContact O-CD1 3.24Å; K301-T364 WeakPolarHBondContact CA-O 3.12Å; K301-T364 WeakPolarHBondContact CA-OG1 2.81Å; K301-K365 HydrophobicContact CD-CD 4.03Å; K301-K365 HydrophobicContact CG-CB 4.05Å; K301-K365 HydrophobicContact CG-CD 4.2Å; K301-K365 HydrophobicContact CG-CG 4.31Å
302	A	92.4	Very high	89.4	Confident	1 Å²	1	17 Å²	17	1%	0.008	10%	0.104	C	C	.	.	S	Bend	trans	-63.5	-10	177.4	0	0	0	0	0	113.8	L363 T364 L366 L369 Y431	A302-L363 HydrophobicContact CB-CD1 4.33Å; A302-L363 HydrophobicContact CB-CG 4.44Å; A302-T364 PolarHBondContact N-O 3.29Å; A302-L366 HydrophobicContact CB-CD1 4.22Å; A302-L369 HydrophobicContact CB-CD1 3.76Å; A302-L369 HydrophobicContact CB-CG 4.36Å; A302-Y431 PolarHBondContact O-OH 3.49Å
303	Y	92.6	Very high	89.5	Confident	0 Å²	0	18 Å²	18	0%	0	11%	0.11	C	C	.	.	S	Bend	trans	-142.3	167	171.7	59.3	-85.7	0	0	0	108.2	K301 T305 L324 G328 E330 G342 K365 I368 L369	K301-Y303 CarbonylContact C-O 3.49Å; K301-Y303 WeakPolarHBondContact CB-O 3.3Å; K301-Y303 HydrophobicContact CD-CD1 4.17Å; K301-Y303 HydrophobicContact CD-CD2 3.91Å; K301-Y303 HydrophobicContact CD-CE1 3.8Å; K301-Y303 HydrophobicContact CD-CE2 3.53Å; K301-Y303 HydrophobicContact CD-CG 4.21Å; K301-Y303 VanDerWaalsContact CD-CZ 3.48Å; K301-Y303 HydrophobicContact CG-CD1 4.02Å; K301-Y303 HydrophobicContact CG-CE1 3.89Å; K301-Y303 HydrophobicContact CG-CE2 4.42Å; K301-Y303 HydrophobicContact CG-CG 4.34Å; K301-Y303 WeakPolarHBondContact CG-O 3.38Å; K301-Y303 PolarHBondContact O-N 2.82Å; Y303-T305 HydrophobicContact CD2-CG2 3.82Å; Y303-T305 HydrophobicContact CE2-CG2 3.47Å; Y303-T305 VanDerWaalsContact CE2-CG2 3.47Å; Y303-L324 HydrophobicContact CD1-CD2 4.22Å; Y303-L324 HydrophobicContact CD2-CB 4.43Å; Y303-L324 HydrophobicContact CD2-CD1 4.36Å; Y303-L324 HydrophobicContact CD2-CD2 4.43Å; Y303-L324 HydrophobicContact CE2-CB 4.45Å; Y303-L324 HydrophobicContact CG-CD1 4.43Å; Y303-L324 HydrophobicContact CG-CD2 4.11Å; Y303-G328 WeakPolarHBondContact OH-CA 3.47Å; Y303-E330 HydrophobicContact CE2-CG 4.17Å; Y303-E330 PolarHBondContact OH-OE1 3.47Å; Y303-G342 WeakPolarHBondContact CB-O 3.28Å; Y303-K365 HydrophobicContact CE1-CB 3.94Å; Y303-K365 HydrophobicContact CE1-CD 4.26Å; Y303-K365 VanDerWaalsContact OH-CD 3.27Å; Y303-K365 WeakPolarHBondContact OH-CD 3.43Å; Y303-I368 HydrophobicContact CD1-CB 4.44Å; Y303-I368 HydrophobicContact CD1-CG2 4.37Å; Y303-I368 HydrophobicContact CE1-CB 3.73Å; Y303-I368 HydrophobicContact CE1-CG1 3.94Å; Y303-I368 HydrophobicContact CE1-CG2 3.69Å; Y303-L369 HydrophobicContact CD1-CD2 4.36Å
304	T	93.1	Very high	89.5	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	144	-177.5	51.3	0	0	0	0	111.2	F312 T314 G342 W343 D345 I348	T304-F312 WeakPolarHBondContact OG1-CE2 3.32Å; T304-F312 WeakPolarHBondContact OG1-CZ 3.33Å; T304-T314 PolarHBondContact OG1-OG1 3.48Å; T304-T314 VanDerWaalsContact OG1-OG1 3.14Å; T304-G342 PolarHBondContact N-O 3.34Å; T304-G342 PolarHBondContact O-N 3.38Å; T304-G342 PolarHBondContact OG1-O 3.48Å; T304-W343 WeakPolarHBondContact CG2-O 3.4Å; T304-W343 PolarHBondContact OG1-O 2.85Å; T304-D345 HydrophobicContact CG2-CB 4.14Å; T304-I348 HydrophobicContact CG2-CD1 3.76Å
305	T	91.4	Very high	89.6	Confident	2 Å²	2	17.8 Å²	17.8	1%	0.012	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	143.7	174.1	55.6	0	0	0	0	110.7	W40 K301 Y303 E330 R340	W40-T305 WeakPolarHBondContact CB-O 3.34Å; K301-T305 HydrophobicContact CD-CG2 4.17Å; K301-T305 PolarHBondContact NZ-OG1 3.43Å; Y303-T305 HydrophobicContact CD2-CG2 3.82Å; Y303-T305 HydrophobicContact CE2-CG2 3.47Å; Y303-T305 VanDerWaalsContact CE2-CG2 3.47Å; T305-E330 HydrophobicContact CG2-CG 4Å; T305-R340 CarbonylContact C-O 3.57Å; T305-R340 VanDerWaalsContact CA-O 3.22Å; T305-R340 WeakPolarHBondContact CA-O 3.22Å
306	R	88.4	Confident	89.6	Confident	5 Å²	5	15.7 Å²	15.7	2%	0.019	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	138.6	177.1	-176.7	178.7	172.6	129.5	16.4	110.7	W40 T268 I309 A311 F312 R340	W40-R306 HydrophobicContact CB-CB 4.39Å; W40-R306 HydrophobicContact CB-CG 4.42Å; W40-R306 HydrophobicContact CG-CB 4.49Å; W40-R306 HydrophobicContact CG-CG 4.25Å; T268-R306 PolarHBondContact OG1-NH1 3.48Å; T268-R306 VanDerWaalsContact OG1-NH1 3.09Å; T268-R306 PolarHBondContact OG1-NH2 2.81Å; T268-R306 VanDerWaalsContact OG1-NH2 3.1Å; R306-I309 PolarHBondContact NE-O 2.81Å; R306-I309 PolarHBondContact NH2-O 2.86Å; R306-A311 PolarHBondContact NH1-O 3.28Å; R306-F312 HydrophobicContact CB-CD1 4.04Å; R306-F312 HydrophobicContact CB-CE1 4.12Å; R306-R340 PolarHBondContact N-O 2.91Å; R306-R340 WeakPolarHBondContact O-CB 3.44Å; R306-R340 PolarHBondContact O-N 2.97Å
307	V	82.2	Confident	89.3	Confident	71 Å²	71	22.6 Å²	22.6	43%	0.43	13%	0.127	S	C	.	.			trans	-102.5	135.9	168.7	179.1	0	0	0	0	108.5	R339	V307-R339 HydrophobicContact CG2-CB 4.34Å; V307-R339 HydrophobicContact CG2-CG 3.73Å
308	G	75.7	Confident	89.2	Confident	29 Å²	29	25.5 Å²	25.5	30%	0.299	14%	0.143	S	C	.	.	S	Bend	trans	88.7	-174.1	175.4	0	0	0	0	0	114.7	R340	G308-R340 PolarHBondContact O-NH1 3.03Å
309	I	74.7	Confident	89	Confident	83 Å²	83	29.1 Å²	29.1	43%	0.426	17%	0.173	S	C	.	.	S	Bend	trans	-80.8	157.7	-174.9	-50.9	-172.5	0	0	0	109.6	N160 F271 R306	N160-I309 HydrophobicContact CB-CD1 4.31Å; N160-I309 VanDerWaalsContact O-CD1 3.3Å; N160-I309 WeakPolarHBondContact O-CD1 3.31Å; F271-I309 HydrophobicContact CD1-CB 4.42Å; F271-I309 HydrophobicContact CE1-CB 4Å; F271-I309 HydrophobicContact CE1-CG2 4.16Å; F271-I309 VanDerWaalsContact CG-O 3.31Å; F271-I309 WeakPolarHBondContact CG-O 3.33Å; F271-I309 HydrophobicContact CZ-CB 4.4Å; F271-I309 HydrophobicContact CZ-CG2 4.08Å; R306-I309 PolarHBondContact NE-O 2.81Å; R306-I309 PolarHBondContact NH2-O 2.86Å
310	G	81.6	Confident	88.8	Confident	4 Å²	4	31 Å²	31	4%	0.041	18%	0.184	C	C	.	.	S	Bend	trans	128.1	171.5	172.5	0	0	0	0	0	113.2	F312 R340	G310-F312 PolarHBondContact O-N 3.26Å; G310-R340 PolarHBondContact O-NH1 2.9Å; G310-R340 PolarHBondContact O-NH2 2.9Å
311	A	84.9	Confident	88.7	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.008	19%	0.186	C	C	.	.			trans	-64	135.3	-174	0	0	0	0	0	111.2	R306 M395 L398 H399	R306-A311 PolarHBondContact NH1-O 3.28Å; A311-M395 HydrophobicContact CB-SD 4.25Å; A311-L398 HydrophobicContact CB-CB 3.95Å; A311-L398 HydrophobicContact CB-CD2 3.72Å; A311-L398 HydrophobicContact CB-CG 3.6Å; A311-H399 WeakPolarHBondContact CA-NE2 3.42Å; A311-H399 PolarHBondContact N-NE2 2.85Å
312	F	90.6	Very high	88.5	Confident	16 Å²	16	37.5 Å²	37.5	7%	0.07	22%	0.216	C	C	.	.			trans	-138.1	90.9	175.8	-170.1	-175.6	0	0	0	108.9	W40 T304 R306 G310 T314 E315 R340	W40-F312 HydrophobicContact CZ3-CD2 4.27Å; W40-F312 HydrophobicContact CZ3-CE2 4.26Å; T304-F312 WeakPolarHBondContact OG1-CE2 3.32Å; T304-F312 WeakPolarHBondContact OG1-CZ 3.33Å; R306-F312 HydrophobicContact CB-CD1 4.04Å; R306-F312 HydrophobicContact CB-CE1 4.12Å; G310-F312 PolarHBondContact O-N 3.26Å; F312-T314 VanDerWaalsContact C-N 3.28Å; F312-T314 WeakPolarHBondContact CE2-OG1 3.3Å; F312-T314 PolarHBondContact O-N 3.03Å; F312-E315 HydrophobicContact CB-CB 3.93Å; F312-E315 HydrophobicContact CD1-CB 3.62Å; F312-E315 HydrophobicContact CD1-CG 3.9Å; F312-E315 HydrophobicContact CD2-CB 4.41Å; F312-E315 HydrophobicContact CE1-CB 4.2Å; F312-E315 HydrophobicContact CE1-CG 4.37Å; F312-E315 HydrophobicContact CG-CB 3.73Å; F312-E315 HydrophobicContact CG-CG 4.48Å; F312-E315 WeakPolarHBondContact O-CB 3.49Å; F312-E315 PolarHBondContact O-N 2.99Å; F312-R340 HydrophobicContact CD1-CB 3.91Å; F312-R340 HydrophobicContact CE1-CB 4Å
313	P	89.5	Confident	88.5	Confident	24 Å²	24	40.3 Å²	40.3	16%	0.156	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-36.3	-170.6	-29.6	38.4	0	0	0	114.2	Y381 L398 V401 V403	P313-Y381 HydrophobicContact CB-CE1 3.92Å; P313-Y381 HydrophobicContact CG-CE1 4.33Å; P313-Y381 HydrophobicContact CG-CE2 4.45Å; P313-L398 HydrophobicContact CG-CD1 3.88Å; P313-L398 HydrophobicContact CG-CG 4.31Å; P313-V401 HydrophobicContact CB-CG2 3.88Å; P313-V401 HydrophobicContact CG-CG2 3.9Å; P313-V403 HydrophobicContact CB-CG2 3.47Å; P313-V403 VanDerWaalsContact CB-CG2 3.47Å; P313-V403 WeakPolarHBondContact O-CG2 3.48Å
314	T	92.4	Very high	88.4	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	12.2	-177.7	56	0	0	0	0	114.7	T304 F312 Q316 G342 W343 D345 V403 Y405	T304-T314 PolarHBondContact OG1-OG1 3.48Å; T304-T314 VanDerWaalsContact OG1-OG1 3.14Å; F312-T314 VanDerWaalsContact C-N 3.28Å; F312-T314 WeakPolarHBondContact CE2-OG1 3.3Å; F312-T314 PolarHBondContact O-N 3.03Å; T314-Q316 PolarHBondContact O-N 3.42Å; T314-Q316 PolarHBondContact O-NE2 2.89Å; T314-G342 CarbonylContact O-C 3.42Å; T314-G342 WeakPolarHBondContact O-CA 3.21Å; T314-W343 WeakPolarHBondContact CB-O 3.28Å; T314-W343 PolarHBondContact O-N 3.21Å; T314-W343 PolarHBondContact OG1-O 3.36Å; T314-D345 HydrophobicContact CG2-CB 3.78Å; T314-V403 HydrophobicContact CG2-CG1 4.05Å; T314-V403 HydrophobicContact CG2-CG2 4.28Å; T314-Y405 WeakPolarHBondContact CA-OH 3.37Å; T314-Y405 HydrophobicContact CG2-CE1 3.96Å
315	E	94.3	Very high	88.3	Confident	45 Å²	45	41.8 Å²	41.8	21%	0.21	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-57.8	137.3	-179.3	-173.6	168.5	-144.9	0	0	112.2	F312 L317 R340	F312-E315 HydrophobicContact CB-CB 3.93Å; F312-E315 HydrophobicContact CD1-CB 3.62Å; F312-E315 HydrophobicContact CD1-CG 3.9Å; F312-E315 HydrophobicContact CD2-CB 4.41Å; F312-E315 HydrophobicContact CE1-CB 4.2Å; F312-E315 HydrophobicContact CE1-CG 4.37Å; F312-E315 HydrophobicContact CG-CB 3.73Å; F312-E315 HydrophobicContact CG-CG 4.48Å; F312-E315 WeakPolarHBondContact O-CB 3.49Å; F312-E315 PolarHBondContact O-N 2.99Å; E315-L317 HydrophobicContact CG-CD2 3.97Å; E315-L317 HydrophobicContact CG-CG 4.16Å; E315-R340 VanDerWaalsContact CD-NE 3.34Å; E315-R340 WeakPolarHBondContact OE1-CB 3.31Å; E315-R340 VanDerWaalsContact OE1-CG 3.3Å; E315-R340 WeakPolarHBondContact OE1-CG 3.36Å; E315-R340 IonicContact OE1-CZ 3.61Å; E315-R340 IonicContact OE1-NE 2.74Å; E315-R340 PolarHBondContact OE1-NE 2.61Å; E315-R340 IonicContact OE1-NH2 3.02Å; E315-R340 IonicContact OE2-CZ 3.7Å; E315-R340 IonicContact OE2-NE 2.75Å; E315-R340 PolarHBondContact OE2-NE 2.82Å; E315-R340 IonicContact OE2-NH2 2.92Å; E315-R340 PolarHBondContact OE2-NH2 3.31Å
316	Q	92.6	Very high	88.1	Confident	35 Å²	35	46.5 Å²	46.5	16%	0.164	27%	0.266	C	S	.	.			trans	-112.6	102.1	176.1	-64.6	-55.4	-69.6	0	0	109.9	T314 N318 G321 C341 W343	T314-Q316 PolarHBondContact O-N 3.42Å; T314-Q316 PolarHBondContact O-NE2 2.89Å; Q316-N318 PolarHBondContact O-N 3.41Å; Q316-N318 PolarHBondContact OE1-ND2 2.85Å; Q316-G321 WeakPolarHBondContact O-CA 3.13Å; Q316-C341 PolarHBondContact N-O 3.5Å; Q316-W343 HydrophobicContact CG-CG 4.3Å; Q316-W343 VanDerWaalsContact NE2-CD1 3.28Å
317	L	89.8	Confident	88.1	Confident	150 Å²	150	50.6 Å²	50.6	79%	0.785	28%	0.282	S	S	*	.			trans	-90.1	50	172.7	-59	178.7	0	0	0	110.7	E315	E315-L317 HydrophobicContact CG-CD2 3.97Å; E315-L317 HydrophobicContact CG-CG 4.16Å
318	N	91.6	Very high	88.2	Confident	69 Å²	69	47.5 Å²	47.5	37%	0.369	26%	0.264	S	S	.	.	S	Bend	trans	-145.6	-177.8	-176.1	61.7	31	0	0	0	110.5	Q316 V320 G321 E322	Q316-N318 PolarHBondContact O-N 3.41Å; Q316-N318 PolarHBondContact OE1-ND2 2.85Å; N318-V320 PolarHBondContact O-N 3.29Å; N318-V320 VanDerWaalsContact O-N 3.08Å; N318-V320 WeakPolarHBondContact OD1-CA 3.47Å; N318-V320 VanDerWaalsContact OD1-CB 3.27Å; N318-V320 WeakPolarHBondContact OD1-CB 3.32Å; N318-V320 PolarHBondContact OD1-N 3.42Å; N318-G321 PolarHBondContact O-N 2.92Å; N318-G321 PolarHBondContact OD1-N 3.24Å; N318-E322 PolarHBondContact O-N 2.93Å
319	A	90.7	Very high	88.7	Confident	77 Å²	77	52 Å²	52	64%	0.636	28%	0.277	S	S	*	.	H	α-helix	trans	-54.6	-28.9	179.7	0	0	0	0	0	113.8	L323	A319-L323 WeakPolarHBondContact O-CB 3.5Å; A319-L323 PolarHBondContact O-N 2.64Å
320	V	90.5	Very high	89.2	Confident	38 Å²	38	48 Å²	48	23%	0.23	26%	0.257	C	S	.	.	H	α-helix	trans	-68.9	-43.9	176.4	-178.5	0	0	0	0	110.9	N318 E322 L323 L324 W343 L372	N318-V320 PolarHBondContact O-N 3.29Å; N318-V320 VanDerWaalsContact O-N 3.08Å; N318-V320 WeakPolarHBondContact OD1-CA 3.47Å; N318-V320 VanDerWaalsContact OD1-CB 3.27Å; N318-V320 WeakPolarHBondContact OD1-CB 3.32Å; N318-V320 PolarHBondContact OD1-N 3.42Å; V320-E322 VanDerWaalsContact C-N 3.31Å; V320-E322 PolarHBondContact O-N 3.19Å; V320-L323 WeakPolarHBondContact O-CB 3.33Å; V320-L323 PolarHBondContact O-N 3.47Å; V320-L324 HydrophobicContact CG1-CD1 4.27Å; V320-L324 HydrophobicContact CG1-CG 4.39Å; V320-L324 WeakPolarHBondContact O-CG 3.43Å; V320-L324 PolarHBondContact O-N 2.83Å; V320-W343 HydrophobicContact CB-CZ2 4.42Å; V320-W343 HydrophobicContact CG1-CH2 3.61Å; V320-W343 HydrophobicContact CG1-CZ2 3.6Å; V320-W343 HydrophobicContact CG1-CZ3 4.33Å; V320-W343 HydrophobicContact CG2-CZ2 4.43Å; V320-L372 HydrophobicContact CG1-CD2 4.16Å
321	G	89.8	Confident	89.1	Confident	5 Å²	5	50.7 Å²	50.7	5%	0.052	27%	0.272	C	S	.	.	H	α-helix	trans	-60.4	-40.9	176.1	0	0	0	0	0	112.5	Q316 N318 L324 Q325	Q316-G321 WeakPolarHBondContact O-CA 3.13Å; N318-G321 PolarHBondContact O-N 2.92Å; N318-G321 PolarHBondContact OD1-N 3.24Å; G321-L324 PolarHBondContact O-N 3.4Å; G321-Q325 WeakPolarHBondContact O-CB 3.11Å; G321-Q325 PolarHBondContact O-N 3.18Å
322	E	90.1	Very high	88.4	Confident	132 Å²	132	51.3 Å²	51.3	62%	0.617	28%	0.279	S	S	*	.	H	α-helix	trans	-66.5	-38.4	175.4	-65.9	-176.5	171.1	0	0	112.5	N318 V320 Q325 T326	N318-E322 PolarHBondContact O-N 2.93Å; V320-E322 VanDerWaalsContact C-N 3.31Å; V320-E322 PolarHBondContact O-N 3.19Å; E322-Q325 PolarHBondContact O-N 2.87Å; E322-T326 WeakPolarHBondContact O-CB 3.47Å; E322-T326 PolarHBondContact O-N 3.12Å; E322-T326 PolarHBondContact O-OG1 3.24Å
323	L	91.4	Very high	87.2	Confident	61 Å²	61	56.2 Å²	56.2	32%	0.319	31%	0.31	S	S	.	.	H	α-helix	trans	-63.7	-47.5	175.5	-176.8	68	0	0	0	111.4	A319 V320 Q325 T326 R327 L372	A319-L323 WeakPolarHBondContact O-CB 3.5Å; A319-L323 PolarHBondContact O-N 2.64Å; V320-L323 WeakPolarHBondContact O-CB 3.33Å; V320-L323 PolarHBondContact O-N 3.47Å; L323-Q325 VanDerWaalsContact C-N 3.31Å; L323-Q325 PolarHBondContact O-N 2.87Å; L323-T326 PolarHBondContact O-N 3.47Å; L323-R327 HydrophobicContact CD1-CG 4.18Å; L323-R327 WeakPolarHBondContact O-CB 3.35Å; L323-R327 PolarHBondContact O-N 3.39Å; L323-L372 HydrophobicContact CD2-CD2 3.7Å; L323-L372 HydrophobicContact CD2-CG 4.49Å
324	L	91.5	Very high	85.7	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-60.3	-42.5	175.8	-69.2	175.9	0	0	0	111.1	Y303 V320 G321 G328 C341 I368 L369	Y303-L324 HydrophobicContact CD1-CD2 4.22Å; Y303-L324 HydrophobicContact CD2-CB 4.43Å; Y303-L324 HydrophobicContact CD2-CD1 4.36Å; Y303-L324 HydrophobicContact CD2-CD2 4.43Å; Y303-L324 HydrophobicContact CE2-CB 4.45Å; Y303-L324 HydrophobicContact CG-CD1 4.43Å; Y303-L324 HydrophobicContact CG-CD2 4.11Å; V320-L324 HydrophobicContact CG1-CD1 4.27Å; V320-L324 HydrophobicContact CG1-CG 4.39Å; V320-L324 WeakPolarHBondContact O-CG 3.43Å; V320-L324 PolarHBondContact O-N 2.83Å; G321-L324 PolarHBondContact O-N 3.4Å; L324-G328 WeakPolarHBondContact O-CA 3.32Å; L324-G328 PolarHBondContact O-N 3.46Å; L324-C341 HydrophobicContact CB-CB 4.03Å; L324-I368 HydrophobicContact CD2-CG2 3.98Å; L324-L369 HydrophobicContact CD2-CD2 3.81Å
325	Q	89.9	Confident	84.3	Confident	30 Å²	30	64.7 Å²	64.7	14%	0.14	36%	0.361	C	S	.	.	H	α-helix	trans	-63	-45.3	178.1	-176.6	178.5	88.8	0	0	111.9	G321 E322 L323 H329 E330 R339	G321-Q325 WeakPolarHBondContact O-CB 3.11Å; G321-Q325 PolarHBondContact O-N 3.18Å; E322-Q325 PolarHBondContact O-N 2.87Å; L323-Q325 VanDerWaalsContact C-N 3.31Å; L323-Q325 PolarHBondContact O-N 2.87Å; Q325-H329 PolarHBondContact O-N 3Å; Q325-E330 HydrophobicContact CG-CB 4.3Å; Q325-E330 PolarHBondContact O-N 3.34Å; Q325-R339 PolarHBondContact NE2-O 2.76Å
326	T	88.4	Confident	83	Confident	100 Å²	100	64.9 Å²	64.9	61%	0.613	38%	0.376	S	S	*	.	H	α-helix	trans	-70.7	-53.4	-176.6	-55.2	0	0	0	0	111.2	E322 L323 G328 H329	E322-T326 WeakPolarHBondContact O-CB 3.47Å; E322-T326 PolarHBondContact O-N 3.12Å; E322-T326 PolarHBondContact O-OG1 3.24Å; L323-T326 PolarHBondContact O-N 3.47Å; T326-G328 PolarHBondContact O-N 2.8Å; T326-H329 PolarHBondContact O-CD2 2.77Å; T326-H329 VanDerWaalsContact O-CD2 3.24Å; T326-H329 PolarHBondContact O-N 3.17Å
327	R	88.3	Confident	82.2	Confident	91 Å²	91	70.3 Å²	70.3	34%	0.343	40%	0.395	S	S	.	.	H	α-helix	trans	-65.4	-39.3	179.9	-73.3	-175.5	66.9	97.2	-3.9	112	L323 H329 D367 I368 V371	L323-R327 HydrophobicContact CD1-CG 4.18Å; L323-R327 WeakPolarHBondContact O-CB 3.35Å; L323-R327 PolarHBondContact O-N 3.39Å; R327-H329 PolarHBondContact O-CD2 2.68Å; R327-H329 PolarHBondContact O-N 3.19Å; R327-D367 PolarHBondContact NH2-O 3.35Å; R327-D367 VanDerWaalsContact NH2-O 3.12Å; R327-I368 HydrophobicContact CB-CD1 4.17Å; R327-I368 HydrophobicContact CB-CG2 3.89Å; R327-I368 PolarHBondContact NE-O 2.95Å; R327-I368 WeakPolarHBondContact O-CD1 3.4Å; R327-V371 VanDerWaalsContact CZ-CG2 3.47Å
328	G	84.3	Confident	81.9	Confident	6 Å²	6	70.4 Å²	70.4	6%	0.062	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-7.6	179.5	0	0	0	0	0	114.6	Y303 L324 T326 E330 K365	Y303-G328 WeakPolarHBondContact OH-CA 3.47Å; L324-G328 WeakPolarHBondContact O-CA 3.32Å; L324-G328 PolarHBondContact O-N 3.46Å; T326-G328 PolarHBondContact O-N 2.8Å; G328-E330 PolarHBondContact O-N 2.88Å; G328-K365 PolarHBondContact O-NZ 3.31Å
329	H	85.7	Confident	81.7	Confident	123 Å²	123	68.3 Å²	68.3	57%	0.569	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	48.5	-170.1	-68.2	-142.7	0	0	0	110.8	Q325 T326 R327 V331	Q325-H329 PolarHBondContact O-N 3Å; T326-H329 PolarHBondContact O-CD2 2.77Å; T326-H329 VanDerWaalsContact O-CD2 3.24Å; T326-H329 PolarHBondContact O-N 3.17Å; R327-H329 PolarHBondContact O-CD2 2.68Å; R327-H329 PolarHBondContact O-N 3.19Å; H329-V331 PolarHBondContact O-N 2.67Å
330	E	84.8	Confident	81.7	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.356	C	S	.	.			trans	-83.6	65.9	-172.6	-60.2	-66.5	-178.7	0	0	111.4	K301 Y303 T305 Q325 G328 R339 K365	K301-E330 IonicContact NZ-OE1 2.68Å; K301-E330 PolarHBondContact NZ-OE1 3.49Å; K301-E330 IonicContact NZ-OE2 3.49Å; K301-E330 PolarHBondContact NZ-OE2 2.95Å; Y303-E330 HydrophobicContact CE2-CG 4.17Å; Y303-E330 PolarHBondContact OH-OE1 3.47Å; T305-E330 HydrophobicContact CG2-CG 4Å; Q325-E330 HydrophobicContact CG-CB 4.3Å; Q325-E330 PolarHBondContact O-N 3.34Å; G328-E330 PolarHBondContact O-N 2.88Å; E330-R339 HydrophobicContact CB-CB 4.04Å; E330-R339 HydrophobicContact CB-CG 4.22Å; E330-R339 WeakPolarHBondContact O-CG 3.37Å; E330-R339 PolarHBondContact O-N 3.42Å; E330-R339 WeakPolarHBondContact OE2-CD 3.03Å; E330-R339 IonicContact OE2-CZ 3.65Å; E330-R339 IonicContact OE2-NE 3.08Å; E330-R339 IonicContact OE2-NH1 3.83Å; E330-R339 PolarHBondContact OE2-NH1 3.12Å; E330-K365 IonicContact OE1-NZ 3.87Å; E330-K365 PolarHBondContact OE1-NZ 3.04Å; E330-K365 IonicContact OE2-NZ 3Å
331	V	79.8	Confident	81.8	Confident	61 Å²	61	66 Å²	66	37%	0.37	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-128.4	136.7	176.9	-175.8	0	0	0	0	108.2	H329 V333 G336	H329-V331 PolarHBondContact O-N 2.67Å; V331-V333 PolarHBondContact O-N 2.82Å; V331-G336 WeakPolarHBondContact CG1-O 3.25Å
332	G	70.3	Confident	82	Confident	14 Å²	14	65.8 Å²	65.8	14%	0.144	35%	0.345	C	S	.	.			trans	-63.1	127.6	177.8	0	0	0	0	0	111.5	T334 G336 R337	G332-T334 PolarHBondContact O-N 2.84Å; G332-G336 VanDerWaalsContact O-CA 3.32Å; G332-G336 WeakPolarHBondContact O-CA 3.48Å; G332-G336 PolarHBondContact O-N 3.43Å; G332-R337 PolarHBondContact N-O 3.4Å
333	V	64.8	Low	82.3	Confident	118 Å²	118	60 Å²	60	72%	0.715	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-41	-175.3	-176.9	0	0	0	0	112	V331	V331-V333 PolarHBondContact O-N 2.82Å
334	T	59.3	Low	82.5	Confident	106 Å²	106	57.1 Å²	57.1	65%	0.65	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-35.9	-177.7	-39	0	0	0	0	113.2	G332	G332-T334 PolarHBondContact O-N 2.84Å
335	T	62.3	Low	82.6	Confident	96 Å²	96	57.1 Å²	57.1	59%	0.589	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-14	-169.6	58.7	0	0	0	0	113.7	R337	T335-R337 PolarHBondContact O-N 2.74Å; T335-R337 VanDerWaalsContact O-N 3.1Å; T335-R337 PolarHBondContact OG1-N 2.87Å
336	G	68.3	Low	82.7	Confident	50 Å²	50	55.7 Å²	55.7	52%	0.515	30%	0.295	S	S	.	.			trans	65.2	6.5	-173	0	0	0	0	0	114.3	V331 G332 K338	V331-G336 WeakPolarHBondContact CG1-O 3.25Å; G332-G336 VanDerWaalsContact O-CA 3.32Å; G332-G336 WeakPolarHBondContact O-CA 3.48Å; G332-G336 PolarHBondContact O-N 3.43Å; G336-K338 PolarHBondContact O-N 3.29Å
337	R	74.3	Confident	82.8	Confident	149 Å²	149	51.6 Å²	51.6	56%	0.562	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-73.1	129.2	-178	-71.8	-176.2	179.1	-177.6	-1.6	110.6	G332 T335	G332-R337 PolarHBondContact N-O 3.4Å; T335-R337 PolarHBondContact O-N 2.74Å; T335-R337 VanDerWaalsContact O-N 3.1Å; T335-R337 PolarHBondContact OG1-N 2.87Å
338	K	83.8	Confident	83	Confident	152 Å²	152	47.2 Å²	47.2	66%	0.661	25%	0.254	S	S	*	.	B	Isolated β-bridge	trans	-64.1	134.7	172.9	-77.5	-177	170.3	-158.6	0	110.8	G336	G336-K338 PolarHBondContact O-N 3.29Å
339	R	88	Confident	83.3	Confident	24 Å²	24	47.1 Å²	47.1	9%	0.091	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-87.4	143.1	174.6	-49.3	-172.8	169.1	120.3	2.7	110.4	D42 V307 Q325 E330	D42-R339 IonicContact OD1-CZ 2.71Å; D42-R339 IonicContact OD1-NH2 2.7Å; D42-R339 PolarHBondContact OD1-NH2 2.76Å; D42-R339 IonicContact OD2-CZ 3.88Å; D42-R339 IonicContact OD2-NE 2.76Å; D42-R339 PolarHBondContact OD2-NE 3.36Å; D42-R339 IonicContact OD2-NH2 2.79Å; D42-R339 PolarHBondContact OD2-NH2 3.36Å; V307-R339 HydrophobicContact CG2-CB 4.34Å; V307-R339 HydrophobicContact CG2-CG 3.73Å; Q325-R339 PolarHBondContact NE2-O 2.76Å; E330-R339 HydrophobicContact CB-CB 4.04Å; E330-R339 HydrophobicContact CB-CG 4.22Å; E330-R339 WeakPolarHBondContact O-CG 3.37Å; E330-R339 PolarHBondContact O-N 3.42Å; E330-R339 WeakPolarHBondContact OE2-CD 3.03Å; E330-R339 IonicContact OE2-CZ 3.65Å; E330-R339 IonicContact OE2-NE 3.08Å; E330-R339 IonicContact OE2-NH1 3.83Å; E330-R339 PolarHBondContact OE2-NH1 3.12Å
340	R	90.1	Very high	83.6	Confident	61 Å²	61	45.8 Å²	45.8	23%	0.23	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	135.2	170.8	-64.1	164.1	67.3	-164.7	0.9	108.1	T305 R306 G308 G310 F312 E315	T305-R340 CarbonylContact C-O 3.57Å; T305-R340 VanDerWaalsContact CA-O 3.22Å; T305-R340 WeakPolarHBondContact CA-O 3.22Å; R306-R340 PolarHBondContact N-O 2.91Å; R306-R340 WeakPolarHBondContact O-CB 3.44Å; R306-R340 PolarHBondContact O-N 2.97Å; G308-R340 PolarHBondContact O-NH1 3.03Å; G310-R340 PolarHBondContact O-NH1 2.9Å; G310-R340 PolarHBondContact O-NH2 2.9Å; F312-R340 HydrophobicContact CD1-CB 3.91Å; F312-R340 HydrophobicContact CE1-CB 4Å; E315-R340 VanDerWaalsContact CD-NE 3.34Å; E315-R340 WeakPolarHBondContact OE1-CB 3.31Å; E315-R340 VanDerWaalsContact OE1-CG 3.3Å; E315-R340 WeakPolarHBondContact OE1-CG 3.36Å; E315-R340 IonicContact OE1-CZ 3.61Å; E315-R340 IonicContact OE1-NE 2.74Å; E315-R340 PolarHBondContact OE1-NE 2.61Å; E315-R340 IonicContact OE1-NH2 3.02Å; E315-R340 IonicContact OE2-CZ 3.7Å; E315-R340 IonicContact OE2-NE 2.75Å; E315-R340 PolarHBondContact OE2-NE 2.82Å; E315-R340 IonicContact OE2-NH2 2.92Å; E315-R340 PolarHBondContact OE2-NH2 3.31Å
341	C	93.7	Very high	83.9	Confident	6 Å²	6	48.5 Å²	48.5	4%	0.041	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	144.3	-175.5	-63.2	0	0	0	0	110.5	Q316 L324	Q316-C341 PolarHBondContact N-O 3.5Å; L324-C341 HydrophobicContact CB-CB 4.03Å
342	G	93.8	Very high	84.5	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	172.4	-176.5	0	0	0	0	0	112.6	Y303 T304 T314	Y303-G342 WeakPolarHBondContact CB-O 3.28Å; T304-G342 PolarHBondContact N-O 3.34Å; T304-G342 PolarHBondContact O-N 3.38Å; T304-G342 PolarHBondContact OG1-O 3.48Å; T314-G342 CarbonylContact O-C 3.42Å; T314-G342 WeakPolarHBondContact O-CA 3.21Å
343	W	95.4	Very high	85.6	Confident	11 Å²	11	47.2 Å²	47.2	4%	0.042	24%	0.239	C	C	.	.			trans	-66	159.8	176.9	-69.3	119.8	0	0	0	112.4	T304 T314 Q316 V320 D345 L372 E374 I375 K376 Y405	T304-W343 WeakPolarHBondContact CG2-O 3.4Å; T304-W343 PolarHBondContact OG1-O 2.85Å; T314-W343 WeakPolarHBondContact CB-O 3.28Å; T314-W343 PolarHBondContact O-N 3.21Å; T314-W343 PolarHBondContact OG1-O 3.36Å; Q316-W343 HydrophobicContact CG-CG 4.3Å; Q316-W343 VanDerWaalsContact NE2-CD1 3.28Å; V320-W343 HydrophobicContact CB-CZ2 4.42Å; V320-W343 HydrophobicContact CG1-CH2 3.61Å; V320-W343 HydrophobicContact CG1-CZ2 3.6Å; V320-W343 HydrophobicContact CG1-CZ3 4.33Å; V320-W343 HydrophobicContact CG2-CZ2 4.43Å; W343-D345 PolarHBondContact O-N 3.08Å; W343-L372 HydrophobicContact CH2-CD1 3.93Å; W343-L372 HydrophobicContact CZ3-CD1 3.81Å; W343-E374 WeakPolarHBondContact CH2-O 3.22Å; W343-I375 HydrophobicContact CE3-CG2 4.24Å; W343-I375 HydrophobicContact CZ3-CB 4.31Å; W343-I375 HydrophobicContact CZ3-CG2 3.94Å; W343-K376 WeakPolarHBondContact CB-O 3.2Å; W343-K376 HydrophobicContact CD2-CB 3.88Å; W343-K376 HydrophobicContact CE3-CB 4.49Å; W343-K376 VanDerWaalsContact CE3-O 3.29Å; W343-K376 HydrophobicContact CG-CB 3.96Å; W343-K376 HydrophobicContact CZ2-CB 4.35Å; W343-K376 HydrophobicContact CZ2-CG 4.45Å; W343-Y405 HydrophobicContact CB-CE1 4.02Å; W343-Y405 AromaticContact CD1-CE1 3.83Å; W343-Y405 HydrophobicContact CG-CE1 4.23Å
344	L	95.1	Very high	86.8	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	133.1	172	-175.8	62.6	0	0	0	109.6	K301 L346 L349 V377 G378 Y431 I435	K301-L344 WeakPolarHBondContact O-CD1 3.24Å; L344-L346 HydrophobicContact CD2-CD2 3.96Å; L344-L346 HydrophobicContact CG-CD2 4.24Å; L344-L349 HydrophobicContact CD1-CD1 3.63Å; L344-L349 HydrophobicContact CD1-CD2 4.43Å; L344-V377 HydrophobicContact CB-CG1 4.25Å; L344-V377 HydrophobicContact CD2-CG1 4.35Å; L344-V377 HydrophobicContact CG-CG1 4.36Å; L344-V377 CarbonylContact O-C 3.56Å; L344-V377 WeakPolarHBondContact O-CA 3.32Å; L344-G378 PolarHBondContact O-N 3.32Å; L344-Y431 WeakPolarHBondContact CD2-OH 3.5Å; L344-I435 HydrophobicContact CD2-CD1 3.4Å; L344-I435 HydrophobicContact CD2-CG1 3.72Å
345	D	93.6	Very high	88.3	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	111.4	179.8	-174.6	-39.1	0	0	0	108.8	T304 T314 W343 V347 I348 L349 Y381	T304-D345 HydrophobicContact CG2-CB 4.14Å; T314-D345 HydrophobicContact CG2-CB 3.78Å; W343-D345 PolarHBondContact O-N 3.08Å; D345-V347 WeakPolarHBondContact OD1-CA 3.34Å; D345-V347 VanDerWaalsContact OD1-CB 3.3Å; D345-V347 WeakPolarHBondContact OD1-CB 3.4Å; D345-V347 PolarHBondContact OD1-N 3.34Å; D345-I348 HydrophobicContact CB-CD1 3.69Å; D345-I348 HydrophobicContact CB-CG1 3.78Å; D345-I348 WeakPolarHBondContact O-CG1 3.21Å; D345-I348 PolarHBondContact OD1-N 3.46Å; D345-I348 VanDerWaalsContact OD1-N 3.1Å; D345-L349 WeakPolarHBondContact O-CD1 3.3Å; D345-L349 PolarHBondContact O-N 3.46Å; D345-Y381 VanDerWaalsContact CG-OH 3.25Å; D345-Y381 PolarHBondContact OD1-OH 3.47Å; D345-Y381 WeakPolarHBondContact OD2-CE1 3.1Å; D345-Y381 VanDerWaalsContact OD2-CZ 3.3Å; D345-Y381 PolarHBondContact OD2-OH 3.1Å
346	L	92.8	Very high	89.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-81.8	-17.6	-178.6	-63.4	177.3	0	0	0	112.7	L344 L349 R350 V377 G378 V379 F434 I435 H438 I439	L344-L346 HydrophobicContact CD2-CD2 3.96Å; L344-L346 HydrophobicContact CG-CD2 4.24Å; L346-L349 HydrophobicContact CD2-CD2 4.45Å; L346-L349 PolarHBondContact O-N 3.01Å; L346-R350 VanDerWaalsContact O-CB 3.28Å; L346-R350 WeakPolarHBondContact O-CB 3.48Å; L346-R350 VanDerWaalsContact O-CG 3.25Å; L346-R350 WeakPolarHBondContact O-CG 3.47Å; L346-R350 PolarHBondContact O-N 3.16Å; L346-V377 HydrophobicContact CD1-CG1 3.49Å; L346-V377 VanDerWaalsContact CD1-CG1 3.49Å; L346-V377 HydrophobicContact CD2-CG1 4.31Å; L346-V377 HydrophobicContact CG-CG1 3.52Å; L346-G378 WeakPolarHBondContact CB-O 3.38Å; L346-G378 PolarHBondContact N-O 2.8Å; L346-V379 HydrophobicContact CD1-CG1 4.31Å; L346-F434 HydrophobicContact CD1-CD1 4.27Å; L346-F434 HydrophobicContact CD1-CE1 3.59Å; L346-F434 HydrophobicContact CD1-CZ 4.28Å; L346-I435 HydrophobicContact CD2-CG1 4.35Å; L346-I435 HydrophobicContact CD2-CG2 4.15Å; L346-H438 HydrophobicContact CD1-CB 3.81Å; L346-I439 HydrophobicContact CD2-CD1 4.23Å; L346-I439 HydrophobicContact CD2-CG1 4.29Å
347	V	91.3	Very high	90.8	Very high	14 Å²	14	40.9 Å²	40.9	9%	0.085	19%	0.188	C	C	.	.	H	α-helix	trans	-66.2	-46.6	176	-175.3	0	0	0	0	109.3	D345 Y351 Y381	D345-V347 WeakPolarHBondContact OD1-CA 3.34Å; D345-V347 VanDerWaalsContact OD1-CB 3.3Å; D345-V347 WeakPolarHBondContact OD1-CB 3.4Å; D345-V347 PolarHBondContact OD1-N 3.34Å; V347-Y351 WeakPolarHBondContact O-CB 3.36Å; V347-Y351 PolarHBondContact O-N 3.25Å; V347-Y381 HydrophobicContact CB-CD1 4.41Å; V347-Y381 HydrophobicContact CB-CD2 4.39Å; V347-Y381 HydrophobicContact CB-CE1 4.03Å; V347-Y381 HydrophobicContact CB-CE2 4.05Å; V347-Y381 HydrophobicContact CG1-CD2 3.84Å; V347-Y381 HydrophobicContact CG1-CE2 3.72Å; V347-Y381 HydrophobicContact CG1-CG 4.32Å; V347-Y381 HydrophobicContact CG2-CD1 3.93Å; V347-Y381 HydrophobicContact CG2-CE1 3.9Å; V347-Y381 HydrophobicContact CG2-CG 4.24Å
348	I	91.2	Very high	91.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-67.1	-39.8	176.4	67.4	-178.4	0	0	0	112	Q39 W40 L260 T304 D345 Y351 A352 F391	Q39-I348 HydrophobicContact CG-CD1 4.39Å; W40-I348 HydrophobicContact CE3-CD1 4.07Å; W40-I348 HydrophobicContact CH2-CD1 4.07Å; W40-I348 HydrophobicContact CH2-CG2 3.88Å; W40-I348 HydrophobicContact CZ3-CD1 3.44Å; W40-I348 VanDerWaalsContact CZ3-CD1 3.44Å; W40-I348 HydrophobicContact CZ3-CG2 4.35Å; L260-I348 HydrophobicContact CD1-CB 3.78Å; L260-I348 HydrophobicContact CD1-CD1 3.59Å; L260-I348 HydrophobicContact CD1-CG1 4.04Å; L260-I348 HydrophobicContact CD1-CG2 4.19Å; L260-I348 HydrophobicContact CD2-CB 4.02Å; L260-I348 HydrophobicContact CD2-CG2 4.07Å; L260-I348 HydrophobicContact CG-CB 4.48Å; T304-I348 HydrophobicContact CG2-CD1 3.76Å; D345-I348 HydrophobicContact CB-CD1 3.69Å; D345-I348 HydrophobicContact CB-CG1 3.78Å; D345-I348 WeakPolarHBondContact O-CG1 3.21Å; D345-I348 PolarHBondContact OD1-N 3.46Å; D345-I348 VanDerWaalsContact OD1-N 3.1Å; I348-Y351 PolarHBondContact O-N 2.78Å; I348-A352 WeakPolarHBondContact O-CB 3.47Å; I348-A352 PolarHBondContact O-N 3.42Å; I348-F391 HydrophobicContact CG2-CD2 3.97Å; I348-F391 HydrophobicContact CG2-CE2 3.58Å; I348-F391 HydrophobicContact CG2-CZ 4.43Å
349	L	91.6	Very high	92.2	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.016	15%	0.148	C	C	.	.	H	α-helix	trans	-65	-43.7	179.6	-92.8	88	0	0	0	111	Q39 S300 L344 D345 L346 Y351 A352 H353 I439	Q39-L349 HydrophobicContact CG-CD1 4.14Å; S300-L349 WeakPolarHBondContact OG-CD2 3.35Å; L344-L349 HydrophobicContact CD1-CD1 3.63Å; L344-L349 HydrophobicContact CD1-CD2 4.43Å; D345-L349 WeakPolarHBondContact O-CD1 3.3Å; D345-L349 PolarHBondContact O-N 3.46Å; L346-L349 HydrophobicContact CD2-CD2 4.45Å; L346-L349 PolarHBondContact O-N 3.01Å; L349-Y351 VanDerWaalsContact C-N 3.33Å; L349-A352 PolarHBondContact O-N 3.24Å; L349-H353 WeakPolarHBondContact O-CB 3.47Å; L349-H353 PolarHBondContact O-N 3.48Å; L349-I439 HydrophobicContact CB-CD1 3.99Å; L349-I439 HydrophobicContact CB-CG1 4.43Å; L349-I439 HydrophobicContact CD2-CD1 3.41Å; L349-I439 VanDerWaalsContact CD2-CD1 3.41Å; L349-I439 HydrophobicContact CG-CD1 4.36Å
350	R	91.8	Very high	92.5	Very high	96 Å²	96	28.7 Å²	28.7	36%	0.362	15%	0.145	S	C	.	.	H	α-helix	trans	-62.1	-42.8	175.2	-77.6	178.3	61.7	-146.2	-5.1	111.4	L346 H353 M354 H438 I439	L346-R350 VanDerWaalsContact O-CB 3.28Å; L346-R350 WeakPolarHBondContact O-CB 3.48Å; L346-R350 VanDerWaalsContact O-CG 3.25Å; L346-R350 WeakPolarHBondContact O-CG 3.47Å; L346-R350 PolarHBondContact O-N 3.16Å; R350-H353 WeakPolarHBondContact O-CB 3.33Å; R350-H353 PolarHBondContact O-N 3.37Å; R350-M354 WeakPolarHBondContact O-CG 3.49Å; R350-M354 PolarHBondContact O-N 2.87Å; R350-H438 VanDerWaalsContact CD-CD2 3.43Å; R350-H438 WeakPolarHBondContact CD-CD2 3.21Å; R350-H438 WeakPolarHBondContact CD-O 3.39Å; R350-I439 HydrophobicContact CG-CG1 4.38Å
351	Y	90.8	Very high	92.7	Very high	57 Å²	57	25.9 Å²	25.9	22%	0.224	14%	0.135	C	C	.	.	H	α-helix	trans	-64.9	-41.4	177.3	-166.6	-116.9	0	0	0	112.1	F265 V266 V347 I348 L349 H353 M354 I355 F391	F265-Y351 PolarHBondContact O-OH 3.06Å; V266-Y351 HydrophobicContact CB-CD1 4.19Å; V266-Y351 HydrophobicContact CB-CE1 4.21Å; V266-Y351 HydrophobicContact CG1-CD1 3.88Å; V266-Y351 HydrophobicContact CG1-CE1 4.36Å; V266-Y351 HydrophobicContact CG2-CD1 3.89Å; V266-Y351 HydrophobicContact CG2-CE1 3.92Å; V347-Y351 WeakPolarHBondContact O-CB 3.36Å; V347-Y351 PolarHBondContact O-N 3.25Å; I348-Y351 PolarHBondContact O-N 2.78Å; L349-Y351 VanDerWaalsContact C-N 3.33Å; Y351-H353 VanDerWaalsContact C-N 3.3Å; Y351-H353 PolarHBondContact O-N 3.45Å; Y351-M354 HydrophobicContact CD2-SD 4.32Å; Y351-M354 PolarHBondContact O-N 3.05Å; Y351-I355 HydrophobicContact CD1-CD1 4.26Å; Y351-I355 HydrophobicContact CE1-CD1 3.8Å; Y351-I355 HydrophobicContact CE2-CD1 4.19Å; Y351-I355 PolarHBondContact O-N 2.93Å; Y351-F391 HydrophobicContact CD1-CB 3.76Å; Y351-F391 HydrophobicContact CD1-CD1 4.11Å; Y351-F391 HydrophobicContact CD1-CG 4.1Å; Y351-F391 HydrophobicContact CD2-CB 4.01Å; Y351-F391 HydrophobicContact CE1-CB 4.12Å; Y351-F391 HydrophobicContact CE1-CD1 4.15Å; Y351-F391 HydrophobicContact CE1-CG 4.48Å; Y351-F391 HydrophobicContact CE2-CB 4.38Å; Y351-F391 HydrophobicContact CG-CB 3.71Å; Y351-F391 HydrophobicContact CG-CG 4.45Å
352	A	91.8	Very high	92.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.9	-37.2	172.8	0	0	0	0	0	112.1	A38 A259 I348 L349 N356 F358	A38-A352 WeakPolarHBondContact O-CB 3.39Å; A259-A352 HydrophobicContact CB-CB 3.92Å; I348-A352 WeakPolarHBondContact O-CB 3.47Å; I348-A352 PolarHBondContact O-N 3.42Å; L349-A352 PolarHBondContact O-N 3.24Å; A352-N356 WeakPolarHBondContact O-CB 3.36Å; A352-N356 PolarHBondContact O-N 3.08Å; A352-N356 PolarHBondContact O-ND2 2.68Å; A352-F358 HydrophobicContact CB-CE2 4.06Å; A352-F358 HydrophobicContact CB-CZ 4.47Å
353	H	93	Very high	92.8	Very high	48 Å²	48	25.6 Å²	25.6	22%	0.222	13%	0.133	C	C	.	.	H	α-helix	trans	-66.8	-42.7	174.3	176.1	58.5	0	0	0	112.3	L349 R350 Y351 I355 N356 G357 F358 I439 V441	L349-H353 WeakPolarHBondContact O-CB 3.47Å; L349-H353 PolarHBondContact O-N 3.48Å; R350-H353 WeakPolarHBondContact O-CB 3.33Å; R350-H353 PolarHBondContact O-N 3.37Å; Y351-H353 VanDerWaalsContact C-N 3.3Å; Y351-H353 PolarHBondContact O-N 3.45Å; H353-I355 PolarHBondContact O-N 3.24Å; H353-I355 VanDerWaalsContact O-N 3.12Å; H353-N356 PolarHBondContact O-N 3.08Å; H353-G357 WeakPolarHBondContact O-CA 3.5Å; H353-G357 PolarHBondContact O-N 2.85Å; H353-F358 HydrophobicContact CB-CD2 3.9Å; H353-F358 HydrophobicContact CB-CE2 4.45Å; H353-F358 PolarHBondContact CE1-O 3.23Å; H353-F358 VanDerWaalsContact CE1-O 3.29Å; H353-F358 PolarHBondContact ND1-N 2.99Å; H353-F358 VanDerWaalsContact ND1-N 3.16Å; H353-I439 HydrophobicContact CB-CG2 4.14Å; H353-V441 WeakPolarHBondContact CE1-CG2 3.44Å; H353-V441 VanDerWaalsContact ND1-CG2 3.32Å; H353-V441 WeakPolarHBondContact ND1-CG2 3.49Å; H353-V441 WeakPolarHBondContact NE2-CG2 3.37Å
354	M	90.7	Very high	92.6	Very high	140 Å²	140	25.2 Å²	25.2	69%	0.69	13%	0.132	S	C	*	.	H	α-helix	trans	-55.8	-32.4	178.4	-73.2	174.5	65.3	0	0	113	R350 Y351	R350-M354 WeakPolarHBondContact O-CG 3.49Å; R350-M354 PolarHBondContact O-N 2.87Å; Y351-M354 HydrophobicContact CD2-SD 4.32Å; Y351-M354 PolarHBondContact O-N 3.05Å
355	I	90.1	Very high	92.4	Very high	49 Å²	49	27.1 Å²	27.1	25%	0.251	14%	0.14	S	C	.	.	H	α-helix	trans	-93.3	-38.1	-176.7	-73.5	155	0	0	0	112.2	F265 V266 T278 Y351 H353	F265-I355 HydrophobicContact CB-CD1 3.75Å; F265-I355 HydrophobicContact CB-CG1 4.49Å; F265-I355 HydrophobicContact CB-CG2 4.38Å; F265-I355 HydrophobicContact CD2-CG2 4.47Å; V266-I355 HydrophobicContact CG2-CB 4.16Å; V266-I355 HydrophobicContact CG2-CD1 3.19Å; V266-I355 HydrophobicContact CG2-CG1 4.25Å; V266-I355 HydrophobicContact CG2-CG2 4.34Å; T278-I355 HydrophobicContact CG2-CG2 3.7Å; Y351-I355 HydrophobicContact CD1-CD1 4.26Å; Y351-I355 HydrophobicContact CE1-CD1 3.8Å; Y351-I355 HydrophobicContact CE2-CD1 4.19Å; Y351-I355 PolarHBondContact O-N 2.93Å; H353-I355 PolarHBondContact O-N 3.24Å; H353-I355 VanDerWaalsContact O-N 3.12Å
356	N	90.9	Very high	92.3	Very high	5 Å²	5	27.1 Å²	27.1	3%	0.027	14%	0.14	C	C	.	.	H	α-helix	trans	-92.3	-19.3	-176.2	-65.9	-55.8	0	0	0	114.4	L36 T278 V279 A352 H353 F358	L36-N356 HydrophobicContact CD1-CB 4.21Å; L36-N356 WeakPolarHBondContact CD1-OD1 3.42Å; T278-N356 WeakPolarHBondContact CA-OD1 3.41Å; T278-N356 WeakPolarHBondContact CB-OD1 3.32Å; V279-N356 PolarHBondContact N-OD1 3.14Å; A352-N356 WeakPolarHBondContact O-CB 3.36Å; A352-N356 PolarHBondContact O-N 3.08Å; A352-N356 PolarHBondContact O-ND2 2.68Å; H353-N356 PolarHBondContact O-N 3.08Å; N356-F358 HydrophobicContact CB-CD1 3.89Å; N356-F358 HydrophobicContact CB-CE1 3.43Å; N356-F358 VanDerWaalsContact CB-CE1 3.43Å; N356-F358 HydrophobicContact CB-CE2 4.31Å; N356-F358 HydrophobicContact CB-CG 4.49Å; N356-F358 HydrophobicContact CB-CZ 3.68Å
357	G	92.3	Very high	92.1	Very high	42 Å²	42	28.5 Å²	28.5	43%	0.433	15%	0.147	S	C	.	.			trans	60.4	47.9	-177.6	0	0	0	0	0	113.1	H353 T359	H353-G357 WeakPolarHBondContact O-CA 3.5Å; H353-G357 PolarHBondContact O-N 2.85Å; G357-T359 PolarHBondContact O-N 2.97Å
358	F	94.3	Very high	92	Very high	9 Å²	9	28.3 Å²	28.3	4%	0.039	15%	0.146	C	C	.	.			trans	-53.7	129.8	-178.1	-60.3	-49.2	0	0	0	112.8	L36 A38 V296 G298 A352 H353 N356 V441	L36-F358 HydrophobicContact CB-CE1 4.16Å; L36-F358 HydrophobicContact CD1-CE1 4.44Å; A38-F358 HydrophobicContact CB-CE2 4Å; A38-F358 HydrophobicContact CB-CZ 4.14Å; V296-F358 HydrophobicContact CG1-CD1 3.93Å; V296-F358 HydrophobicContact CG1-CE1 4.3Å; V296-F358 CarbonylContact O-C 3.52Å; V296-F358 WeakPolarHBondContact O-CA 3.49Å; G298-F358 VanDerWaalsContact CA-CD1 3.44Å; G298-F358 VanDerWaalsContact CA-CE1 3.41Å; A352-F358 HydrophobicContact CB-CE2 4.06Å; A352-F358 HydrophobicContact CB-CZ 4.47Å; H353-F358 HydrophobicContact CB-CD2 3.9Å; H353-F358 HydrophobicContact CB-CE2 4.45Å; H353-F358 PolarHBondContact CE1-O 3.23Å; H353-F358 VanDerWaalsContact CE1-O 3.29Å; H353-F358 PolarHBondContact ND1-N 2.99Å; H353-F358 VanDerWaalsContact ND1-N 3.16Å; N356-F358 HydrophobicContact CB-CD1 3.89Å; N356-F358 HydrophobicContact CB-CE1 3.43Å; N356-F358 VanDerWaalsContact CB-CE1 3.43Å; N356-F358 HydrophobicContact CB-CE2 4.31Å; N356-F358 HydrophobicContact CB-CG 4.49Å; N356-F358 HydrophobicContact CB-CZ 3.68Å; F358-V441 HydrophobicContact CB-CG1 4.2Å
359	T	93.9	Very high	92	Very high	57 Å²	57	28.3 Å²	28.3	35%	0.35	15%	0.146	S	C	.	.	S	Bend	trans	-84.3	-33.5	174.5	60.3	0	0	0	0	111.6	D295 V296 G357	D295-T359 PolarHBondContact OD1-OG1 3.4Å; V296-T359 PolarHBondContact N-OG1 3.35Å; V296-T359 VanDerWaalsContact N-OG1 3.15Å; V296-T359 PolarHBondContact O-N 3.36Å; V296-T359 PolarHBondContact O-OG1 3.33Å; G357-T359 PolarHBondContact O-N 2.97Å
360	A	94.5	Very high	91.9	Very high	4 Å²	4	28.4 Å²	28.4	3%	0.033	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	161.9	169.1	0	0	0	0	0	111.7	F297 G298 P442 K444 F459	F297-A360 WeakPolarHBondContact CA-O 3.47Å; F297-A360 HydrophobicContact CD1-CB 3.89Å; F297-A360 HydrophobicContact CE1-CB 3.99Å; G298-A360 PolarHBondContact N-O 2.88Å; A360-P442 CarbonylContact C-O 3.56Å; A360-P442 VanDerWaalsContact CA-O 3.24Å; A360-P442 WeakPolarHBondContact CA-O 3.45Å; A360-P442 HydrophobicContact CB-CG 4.48Å; A360-P442 WeakPolarHBondContact CB-O 3.44Å; A360-K444 HydrophobicContact CB-CB 3.74Å; A360-F459 HydrophobicContact CB-CZ 4.49Å
361	I	94.6	Very high	91.9	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.01	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	141.7	177.3	-69.4	171.7	0	0	0	110.8	G298 I439 V441 P442 I443 K444 W445	G298-I361 CarbonylContact O-C 3.55Å; G298-I361 WeakPolarHBondContact O-CA 3.18Å; G298-I361 WeakPolarHBondContact O-CG2 3.45Å; I361-I439 HydrophobicContact CD1-CD1 3.65Å; I361-I439 HydrophobicContact CD1-CG2 4.01Å; I361-V441 HydrophobicContact CD1-CB 4.09Å; I361-V441 HydrophobicContact CD1-CG1 4.14Å; I361-V441 HydrophobicContact CG1-CB 4.41Å; I361-V441 HydrophobicContact CG1-CG1 3.9Å; I361-P442 PolarHBondContact N-O 3.15Å; I361-I443 HydrophobicContact CB-CG1 4.08Å; I361-I443 HydrophobicContact CG2-CG1 4.16Å; I361-I443 CarbonylContact O-C 3.56Å; I361-I443 WeakPolarHBondContact O-CA 3.33Å; I361-K444 PolarHBondContact O-N 3.1Å; I361-W445 PolarHBondContact O-N 2.99Å
362	A	94.3	Very high	91.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	109	164.6	0	0	0	0	0	108.5	V48 G298 V299 S300 W445	V48-A362 HydrophobicContact CG1-CB 4.47Å; V48-A362 HydrophobicContact CG2-CB 3.68Å; G298-A362 PolarHBondContact O-N 2.9Å; V299-A362 HydrophobicContact CG1-CB 4.46Å; V299-A362 HydrophobicContact CG2-CB 4.29Å; S300-A362 PolarHBondContact N-O 3.18Å; S300-A362 VanDerWaalsContact O-O 3.08Å; A362-W445 CarbonylContact C-O 3.55Å; A362-W445 WeakPolarHBondContact CA-O 3.46Å; A362-W445 HydrophobicContact CB-CB 4.08Å; A362-W445 HydrophobicContact CB-CE3 4.1Å
363	L	93.9	Very high	91.7	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	115.8	177.3	-171.9	69.3	0	0	0	109.5	S300 A302 L366 I432 I435 I443 W445 V446 G447	S300-L363 CarbonylContact O-C 3.52Å; S300-L363 VanDerWaalsContact O-CA 3.26Å; S300-L363 WeakPolarHBondContact O-CA 3.31Å; A302-L363 HydrophobicContact CB-CD1 4.33Å; A302-L363 HydrophobicContact CB-CG 4.44Å; L363-L366 HydrophobicContact CD2-CD1 4.33Å; L363-I432 HydrophobicContact CD2-CG1 3.99Å; L363-I435 HydrophobicContact CD1-CD1 4.24Å; L363-I435 HydrophobicContact CD2-CD1 4.04Å; L363-I443 HydrophobicContact CB-CD1 4.31Å; L363-I443 HydrophobicContact CB-CG2 4.05Å; L363-I443 HydrophobicContact CD2-CD1 4.32Å; L363-W445 PolarHBondContact N-O 3.12Å; L363-V446 CarbonylContact O-C 3.58Å; L363-V446 VanDerWaalsContact O-CA 3.29Å; L363-V446 WeakPolarHBondContact O-CA 3.35Å; L363-G447 PolarHBondContact O-N 3.27Å
364	T	92.3	Very high	91.7	Very high	3 Å²	3	33 Å²	33	2%	0.018	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	158	-175.2	66.9	0	0	0	0	112.5	E43 V299 S300 K301 A302 L366	E43-T364 WeakPolarHBondContact O-CB 3.48Å; E43-T364 WeakPolarHBondContact O-CG2 3.4Å; E43-T364 PolarHBondContact O-OG1 3Å; V299-T364 HydrophobicContact CG1-CG2 3.77Å; S300-T364 PolarHBondContact O-N 3.36Å; S300-T364 PolarHBondContact O-OG1 3.07Å; K301-T364 WeakPolarHBondContact CA-O 3.12Å; K301-T364 WeakPolarHBondContact CA-OG1 2.81Å; A302-T364 PolarHBondContact N-O 3.29Å; T364-L366 PolarHBondContact O-N 3.21Å
365	K	90	Very high	91.8	Very high	41 Å²	41	26.4 Å²	26.4	18%	0.178	15%	0.15	C	C	.	.			trans	60.2	40.4	175.1	-59.3	-163.2	-179.3	-172	0	113.6	K301 Y303 G328 E330 D367 I368 G447	K301-K365 HydrophobicContact CD-CD 4.03Å; K301-K365 HydrophobicContact CG-CB 4.05Å; K301-K365 HydrophobicContact CG-CD 4.2Å; K301-K365 HydrophobicContact CG-CG 4.31Å; Y303-K365 HydrophobicContact CE1-CB 3.94Å; Y303-K365 HydrophobicContact CE1-CD 4.26Å; Y303-K365 VanDerWaalsContact OH-CD 3.27Å; Y303-K365 WeakPolarHBondContact OH-CD 3.43Å; G328-K365 PolarHBondContact O-NZ 3.31Å; E330-K365 IonicContact OE1-NZ 3.87Å; E330-K365 PolarHBondContact OE1-NZ 3.04Å; E330-K365 IonicContact OE2-NZ 3Å; K365-D367 VanDerWaalsContact C-N 3.28Å; K365-D367 WeakPolarHBondContact CA-OD1 3.29Å; K365-I368 HydrophobicContact CB-CG1 3.81Å; K365-I368 HydrophobicContact CD-CG1 4.4Å; K365-I368 PolarHBondContact O-N 3.03Å; K365-G447 PolarHBondContact N-O 3.31Å; K365-G447 VanDerWaalsContact N-O 3.1Å
366	L	91.6	Very high	91.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-66.4	-34.4	176.2	-173.1	67.5	0	0	0	111.5	A302 L363 T364 I368 L369 W411 L424 Y431 I432 V446 G447 V448	A302-L366 HydrophobicContact CB-CD1 4.22Å; L363-L366 HydrophobicContact CD2-CD1 4.33Å; T364-L366 PolarHBondContact O-N 3.21Å; L366-I368 PolarHBondContact O-N 3.4Å; L366-L369 HydrophobicContact CD1-CD1 4.44Å; L366-L369 WeakPolarHBondContact O-CB 3.12Å; L366-L369 PolarHBondContact O-N 2.85Å; L366-W411 HydrophobicContact CD1-CH2 3.69Å; L366-W411 HydrophobicContact CD1-CZ2 3.86Å; L366-W411 HydrophobicContact CG-CH2 4.32Å; L366-W411 HydrophobicContact CG-CZ2 3.99Å; L366-L424 HydrophobicContact CD2-CD2 4.46Å; L366-Y431 HydrophobicContact CD1-CD1 4.04Å; L366-Y431 HydrophobicContact CD1-CE1 4.21Å; L366-I432 HydrophobicContact CD2-CD1 3.84Å; L366-I432 HydrophobicContact CD2-CG1 4.44Å; L366-V446 HydrophobicContact CB-CG1 4.23Å; L366-V446 HydrophobicContact CD2-CG1 3.57Å; L366-G447 PolarHBondContact N-O 3.27Å; L366-V448 HydrophobicContact CB-CG1 4.49Å
367	D	89.3	Confident	92.1	Very high	28 Å²	28	27.7 Å²	27.7	15%	0.15	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-57.1	-20.6	177.9	57	-67.4	0	0	0	114.4	R327 K365 L369 D370 V448	R327-D367 PolarHBondContact NH2-O 3.35Å; R327-D367 VanDerWaalsContact NH2-O 3.12Å; K365-D367 VanDerWaalsContact C-N 3.28Å; K365-D367 WeakPolarHBondContact CA-OD1 3.29Å; D367-L369 VanDerWaalsContact C-N 3.28Å; D367-L369 PolarHBondContact O-N 3.48Å; D367-D370 WeakPolarHBondContact CA-OD1 3.18Å; D367-D370 WeakPolarHBondContact O-CB 3.26Å; D367-D370 VanDerWaalsContact O-CG 3.22Å; D367-D370 PolarHBondContact O-N 3.25Å; D367-V448 HydrophobicContact CB-CB 4.5Å; D367-V448 WeakPolarHBondContact CB-O 3.39Å; D367-V448 VanDerWaalsContact CG-C 3.49Å; D367-V448 VanDerWaalsContact OD1-C 3.25Å
368	I	89.9	Confident	92.2	Very high	11 Å²	11	25.7 Å²	25.7	6%	0.056	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-71.8	-28.9	178.2	-54.8	-51.8	0	0	0	111.1	Y303 L324 R327 K365 L366 D370	Y303-I368 HydrophobicContact CD1-CB 4.44Å; Y303-I368 HydrophobicContact CD1-CG2 4.37Å; Y303-I368 HydrophobicContact CE1-CB 3.73Å; Y303-I368 HydrophobicContact CE1-CG1 3.94Å; Y303-I368 HydrophobicContact CE1-CG2 3.69Å; L324-I368 HydrophobicContact CD2-CG2 3.98Å; R327-I368 HydrophobicContact CB-CD1 4.17Å; R327-I368 HydrophobicContact CB-CG2 3.89Å; R327-I368 PolarHBondContact NE-O 2.95Å; R327-I368 WeakPolarHBondContact O-CD1 3.4Å; K365-I368 HydrophobicContact CB-CG1 3.81Å; K365-I368 HydrophobicContact CD-CG1 4.4Å; K365-I368 PolarHBondContact O-N 3.03Å; L366-I368 PolarHBondContact O-N 3.4Å; I368-D370 VanDerWaalsContact C-N 3.32Å
369	L	90.4	Very high	92.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-84	-6.7	-179.1	-54.9	-178	0	0	0	113.1	A302 Y303 L324 L366 D367 V371 L372 I375 W411 Y431	A302-L369 HydrophobicContact CB-CD1 3.76Å; A302-L369 HydrophobicContact CB-CG 4.36Å; Y303-L369 HydrophobicContact CD1-CD2 4.36Å; L324-L369 HydrophobicContact CD2-CD2 3.81Å; L366-L369 HydrophobicContact CD1-CD1 4.44Å; L366-L369 WeakPolarHBondContact O-CB 3.12Å; L366-L369 PolarHBondContact O-N 2.85Å; D367-L369 VanDerWaalsContact C-N 3.28Å; D367-L369 PolarHBondContact O-N 3.48Å; L369-V371 PolarHBondContact O-N 3.3Å; L369-L372 HydrophobicContact CB-CD1 4.38Å; L369-L372 HydrophobicContact CD2-CD1 3.7Å; L369-L372 PolarHBondContact O-N 3.24Å; L369-L372 VanDerWaalsContact O-N 3.13Å; L369-I375 HydrophobicContact CB-CD1 3.93Å; L369-I375 HydrophobicContact CD1-CD1 4.24Å; L369-I375 HydrophobicContact CD1-CG2 4.31Å; L369-W411 HydrophobicContact CB-CH2 3.8Å; L369-W411 HydrophobicContact CB-CZ2 3.67Å; L369-W411 HydrophobicContact CD1-CH2 4.15Å; L369-Y431 HydrophobicContact CD1-CE1 4.1Å
370	D	90.3	Very high	92.1	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.021	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-55.4	-29.6	-174.6	-70.7	-2.2	0	0	0	114.9	D367 I368 W411 K412 T413 D414 T415	D367-D370 WeakPolarHBondContact CA-OD1 3.18Å; D367-D370 WeakPolarHBondContact O-CB 3.26Å; D367-D370 VanDerWaalsContact O-CG 3.22Å; D367-D370 PolarHBondContact O-N 3.25Å; I368-D370 VanDerWaalsContact C-N 3.32Å; D370-W411 PolarHBondContact OD1-NE1 3.38Å; D370-K412 CarbonylContact O-C 3.59Å; D370-K412 WeakPolarHBondContact O-CA 3.35Å; D370-K412 PolarHBondContact O-N 3.17Å; D370-K412 VanDerWaalsContact O-N 3.08Å; D370-T413 VanDerWaalsContact CB-O 3.32Å; D370-T413 WeakPolarHBondContact CB-O 3.45Å; D370-T413 PolarHBondContact O-N 3.34Å; D370-D414 WeakPolarHBondContact OD2-CA 3.33Å; D370-T415 VanDerWaalsContact CG-OG1 3.3Å; D370-T415 WeakPolarHBondContact OD1-CG2 3.35Å; D370-T415 PolarHBondContact OD1-OG1 2.66Å; D370-T415 PolarHBondContact OD2-N 3.46Å; D370-T415 PolarHBondContact OD2-OG1 3.03Å
371	V	90.8	Very high	92	Very high	73 Å²	73	23 Å²	23	44%	0.442	12%	0.116	S	C	.	.	G	3₁₀ helix	trans	-93.8	-10.4	-173.9	175.7	0	0	0	0	113.1	R327 L369	R327-V371 VanDerWaalsContact CZ-CG2 3.47Å; L369-V371 PolarHBondContact O-N 3.3Å
372	L	89.8	Confident	91.9	Very high	12 Å²	12	26 Å²	26	6%	0.063	13%	0.13	C	C	.	.			trans	-74.1	144.9	-176.4	-67.6	170.5	0	0	0	111.4	V320 L323 W343 L369 I375 G410	V320-L372 HydrophobicContact CG1-CD2 4.16Å; L323-L372 HydrophobicContact CD2-CD2 3.7Å; L323-L372 HydrophobicContact CD2-CG 4.49Å; W343-L372 HydrophobicContact CH2-CD1 3.93Å; W343-L372 HydrophobicContact CZ3-CD1 3.81Å; L369-L372 HydrophobicContact CB-CD1 4.38Å; L369-L372 HydrophobicContact CD2-CD1 3.7Å; L369-L372 PolarHBondContact O-N 3.24Å; L369-L372 VanDerWaalsContact O-N 3.13Å; L372-I375 HydrophobicContact CB-CG1 4.09Å; L372-I375 HydrophobicContact CD1-CG1 4.1Å; L372-G410 WeakPolarHBondContact O-CA 3.38Å
373	D	89.5	Confident	91.7	Very high	99 Å²	99	28.3 Å²	28.3	53%	0.529	14%	0.142	S	C	.	.	S	Bend	trans	-79.9	-40.2	173.8	-72.8	19.7	0	0	0	110.9	G410 K412	D373-G410 PolarHBondContact O-N 3.04Å; D373-K412 WeakPolarHBondContact OD1-CE 3.19Å; D373-K412 IonicContact OD1-NZ 3.51Å; D373-K412 PolarHBondContact OD1-NZ 2.98Å; D373-K412 IonicContact OD2-NZ 3.89Å; D373-K412 PolarHBondContact OD2-NZ 3.19Å
374	E	91.9	Very high	91.3	Very high	115 Å²	115	34 Å²	34	54%	0.537	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	141.5	179.2	-65	-175.8	172.2	0	0	109.4	W343 T407 F408	W343-E374 WeakPolarHBondContact CH2-O 3.22Å; E374-T407 HydrophobicContact CB-CG2 4Å; E374-T407 HydrophobicContact CG-CG2 4.28Å; E374-F408 WeakPolarHBondContact CA-O 3.05Å
375	I	92.6	Very high	91	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.8	178.5	-59.9	164.5	0	0	0	107.4	W343 L369 L372 F408 W411 Y431	W343-I375 HydrophobicContact CE3-CG2 4.24Å; W343-I375 HydrophobicContact CZ3-CB 4.31Å; W343-I375 HydrophobicContact CZ3-CG2 3.94Å; L369-I375 HydrophobicContact CB-CD1 3.93Å; L369-I375 HydrophobicContact CD1-CD1 4.24Å; L369-I375 HydrophobicContact CD1-CG2 4.31Å; L372-I375 HydrophobicContact CB-CG1 4.09Å; L372-I375 HydrophobicContact CD1-CG1 4.1Å; I375-F408 PolarHBondContact N-O 2.88Å; I375-F408 PolarHBondContact O-N 2.89Å; I375-W411 HydrophobicContact CD1-CE3 3.88Å; I375-W411 HydrophobicContact CD1-CH2 3.55Å; I375-W411 HydrophobicContact CD1-CZ2 4.38Å; I375-W411 HydrophobicContact CD1-CZ3 3.26Å; I375-Y431 HydrophobicContact CG2-CD2 4.34Å; I375-Y431 HydrophobicContact CG2-CE2 3.63Å
376	K	94	Very high	91	Very high	80 Å²	80	42.5 Å²	42.5	35%	0.348	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	144	176.1	-62.9	-178.2	179.9	179.3	0	110.3	W343 Y405 E406 T407	W343-K376 WeakPolarHBondContact CB-O 3.2Å; W343-K376 HydrophobicContact CD2-CB 3.88Å; W343-K376 HydrophobicContact CE3-CB 4.49Å; W343-K376 VanDerWaalsContact CE3-O 3.29Å; W343-K376 HydrophobicContact CG-CB 3.96Å; W343-K376 HydrophobicContact CZ2-CB 4.35Å; W343-K376 HydrophobicContact CZ2-CG 4.45Å; K376-Y405 HydrophobicContact CB-CD1 3.8Å; K376-Y405 HydrophobicContact CB-CG 4.25Å; K376-E406 CarbonylContact C-O 3.53Å; K376-E406 WeakPolarHBondContact CA-O 3.4Å; K376-T407 HydrophobicContact CG-CG2 4.39Å
377	V	94.6	Very high	91	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	124.4	177	-176.8	0	0	0	0	109	L344 L346 V379 Y405 E406 F408 Y431 F434	L344-V377 HydrophobicContact CB-CG1 4.25Å; L344-V377 HydrophobicContact CD2-CG1 4.35Å; L344-V377 HydrophobicContact CG-CG1 4.36Å; L344-V377 CarbonylContact O-C 3.56Å; L344-V377 WeakPolarHBondContact O-CA 3.32Å; L346-V377 HydrophobicContact CD1-CG1 3.49Å; L346-V377 VanDerWaalsContact CD1-CG1 3.49Å; L346-V377 HydrophobicContact CD2-CG1 4.31Å; L346-V377 HydrophobicContact CG-CG1 3.52Å; V377-V379 PolarHBondContact O-N 3.36Å; V377-Y405 CarbonylContact O-C 3.58Å; V377-Y405 VanDerWaalsContact O-CA 3.3Å; V377-Y405 WeakPolarHBondContact O-CA 3.4Å; V377-E406 PolarHBondContact N-O 3.32Å; V377-E406 PolarHBondContact O-N 2.88Å; V377-F408 HydrophobicContact CB-CE2 4.39Å; V377-F408 HydrophobicContact CG2-CD2 4.05Å; V377-F408 HydrophobicContact CG2-CE2 4.13Å; V377-Y431 HydrophobicContact CG2-CD2 4.37Å; V377-Y431 HydrophobicContact CG2-CE2 3.45Å; V377-Y431 VanDerWaalsContact CG2-CE2 3.45Å; V377-F434 HydrophobicContact CB-CE1 4.3Å; V377-F434 HydrophobicContact CG1-CE1 4.09Å
378	G	93.5	Very high	91.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	113.8	176.5	0	0	0	0	0	110.7	L344 L346 E404	L344-G378 PolarHBondContact O-N 3.32Å; L346-G378 WeakPolarHBondContact CB-O 3.38Å; L346-G378 PolarHBondContact N-O 2.8Å; G378-E404 CarbonylContact C-O 3.54Å; G378-E404 WeakPolarHBondContact CA-O 3.49Å
379	V	93.3	Very high	90.9	Very high	10 Å²	10	54.2 Å²	54.2	6%	0.061	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	-22.5	-174.8	-64.9	0	0	0	0	113.3	L346 V377 E404 E406 F434	L346-V379 HydrophobicContact CD1-CG1 4.31Å; V377-V379 PolarHBondContact O-N 3.36Å; V379-E404 HydrophobicContact CG2-CB 4.28Å; V379-E404 HydrophobicContact CG2-CG 4.02Å; V379-E404 WeakPolarHBondContact CG2-O 3.43Å; V379-E404 PolarHBondContact N-O 2.82Å; V379-E406 HydrophobicContact CG1-CB 3.93Å; V379-F434 HydrophobicContact CG1-CE1 4.2Å; V379-F434 HydrophobicContact CG1-CZ 3.76Å
380	A	92.9	Very high	90.7	Very high	3 Å²	3	59.4 Å²	59.4	3%	0.025	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	158.9	-179.1	0	0	0	0	0	111.9	R387 E404	A380-R387 HydrophobicContact CB-CG 4.05Å; A380-E404 HydrophobicContact CB-CB 4.12Å; A380-E404 PolarHBondContact O-N 3.47Å
381	Y	93.6	Very high	90.5	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	142.5	169.7	-64.5	-17.7	0	0	0	110.6	P313 D345 V347 R387 I388 F391 L398 V401 V403	P313-Y381 HydrophobicContact CB-CE1 3.92Å; P313-Y381 HydrophobicContact CG-CE1 4.33Å; P313-Y381 HydrophobicContact CG-CE2 4.45Å; D345-Y381 VanDerWaalsContact CG-OH 3.25Å; D345-Y381 PolarHBondContact OD1-OH 3.47Å; D345-Y381 WeakPolarHBondContact OD2-CE1 3.1Å; D345-Y381 VanDerWaalsContact OD2-CZ 3.3Å; D345-Y381 PolarHBondContact OD2-OH 3.1Å; V347-Y381 HydrophobicContact CB-CD1 4.41Å; V347-Y381 HydrophobicContact CB-CD2 4.39Å; V347-Y381 HydrophobicContact CB-CE1 4.03Å; V347-Y381 HydrophobicContact CB-CE2 4.05Å; V347-Y381 HydrophobicContact CG1-CD2 3.84Å; V347-Y381 HydrophobicContact CG1-CE2 3.72Å; V347-Y381 HydrophobicContact CG1-CG 4.32Å; V347-Y381 HydrophobicContact CG2-CD1 3.93Å; V347-Y381 HydrophobicContact CG2-CE1 3.9Å; V347-Y381 HydrophobicContact CG2-CG 4.24Å; Y381-R387 WeakPolarHBondContact O-CA 3.37Å; Y381-I388 HydrophobicContact CD2-CD1 4.36Å; Y381-I388 WeakPolarHBondContact O-CG1 3.44Å; Y381-I388 PolarHBondContact O-N 3.04Å; Y381-F391 AromaticContact CE2-CD2 3.79Å; Y381-F391 HydrophobicContact CE2-CD2 3.79Å; Y381-F391 HydrophobicContact CE2-CE2 4Å; Y381-L398 HydrophobicContact CE2-CD1 4.11Å; Y381-V401 HydrophobicContact CD1-CG2 4.39Å; Y381-V401 HydrophobicContact CD2-CG1 4.41Å; Y381-V401 HydrophobicContact CD2-CG2 4.36Å; Y381-V401 HydrophobicContact CG-CB 4.3Å; Y381-V401 HydrophobicContact CG-CG2 4.25Å; Y381-V403 HydrophobicContact CD1-CG2 4.04Å; Y381-V403 HydrophobicContact CE1-CG2 3.94Å
382	K	91.1	Very high	90.4	Very high	66 Å²	66	56.6 Å²	56.6	29%	0.287	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132.4	170.3	-69.8	176.7	-178	165.1	0	109.2	K386 V401 E402 E404	K382-K386 CarbonylContact C-O 3.54Å; K382-K386 VanDerWaalsContact CA-O 3.28Å; K382-K386 WeakPolarHBondContact CA-O 3.43Å; K382-V401 WeakPolarHBondContact O-CA 3.12Å; K382-E402 HydrophobicContact CB-CB 4.24Å; K382-E402 PolarHBondContact N-O 3.02Å; K382-E402 PolarHBondContact O-N 2.72Å; K382-E404 WeakPolarHBondContact CE-OE2 3.4Å; K382-E404 IonicContact NZ-OE2 2.67Å; K382-E404 PolarHBondContact NZ-OE2 3.09Å
383	L	89.9	Confident	90.2	Very high	49 Å²	49	60.4 Å²	60.4	26%	0.257	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	118.2	172.6	-171.7	71.4	0	0	0	107.9	G385 K386 I388 I397 K400	L383-G385 PolarHBondContact O-N 2.95Å; L383-K386 PolarHBondContact N-O 3.23Å; L383-K386 PolarHBondContact O-N 3.31Å; L383-I388 HydrophobicContact CB-CG2 4.11Å; L383-I397 HydrophobicContact CD1-CG2 3.88Å; L383-I397 HydrophobicContact CD2-CG2 3.67Å; L383-I397 HydrophobicContact CG-CG2 4.43Å; L383-K400 HydrophobicContact CD1-CB 4.13Å
384	S	86.6	Confident	90	Very high	119 Å²	119	59.5 Å²	59.5	83%	0.832	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	44	-176.9	-56.3	0	0	0	0	112.7	K386	S384-K386 VanDerWaalsContact C-N 3.29Å; S384-K386 PolarHBondContact O-N 3.2Å
385	G	86.1	Confident	89.6	Confident	60 Å²	60	54.9 Å²	54.9	62%	0.619	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	-5.7	-179.8	0	0	0	0	0	116.1	L383	L383-G385 PolarHBondContact O-N 2.95Å
386	K	90.2	Very high	89.2	Confident	163 Å²	163	59.5 Å²	59.5	71%	0.709	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102	131.2	178.7	-66.4	-177.4	-179.4	178.5	0	111.7	K382 L383 S384 I388	K382-K386 CarbonylContact C-O 3.54Å; K382-K386 VanDerWaalsContact CA-O 3.28Å; K382-K386 WeakPolarHBondContact CA-O 3.43Å; L383-K386 PolarHBondContact N-O 3.23Å; L383-K386 PolarHBondContact O-N 3.31Å; S384-K386 VanDerWaalsContact C-N 3.29Å; S384-K386 PolarHBondContact O-N 3.2Å; K386-I388 PolarHBondContact O-N 3.35Å
387	R	91.6	Very high	88.9	Confident	147 Å²	147	58.9 Å²	58.9	56%	0.555	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	126.3	174.7	-172.7	173.4	179.9	166.3	3.1	110	A380 Y381 E404	A380-R387 HydrophobicContact CB-CG 4.05Å; Y381-R387 WeakPolarHBondContact O-CA 3.37Å; R387-E404 IonicContact CZ-OE1 3.44Å; R387-E404 IonicContact NH1-OE1 3.54Å
388	I	90.1	Very high	88.5	Confident	25 Å²	25	59.1 Å²	59.1	13%	0.128	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	137.1	176.2	59.1	173.4	0	0	0	110.3	Y381 L383 K386 P392 V401	Y381-I388 HydrophobicContact CD2-CD1 4.36Å; Y381-I388 WeakPolarHBondContact O-CG1 3.44Å; Y381-I388 PolarHBondContact O-N 3.04Å; L383-I388 HydrophobicContact CB-CG2 4.11Å; K386-I388 PolarHBondContact O-N 3.35Å; I388-P392 HydrophobicContact CD1-CG 3.55Å; I388-V401 HydrophobicContact CD1-CG1 4.45Å
389	P	85.9	Confident	88.2	Confident	112 Å²	112	64.5 Å²	64.5	73%	0.727	36%	0.357	S	S	*	.	S	Bend	trans	-86.9	-6.9	-179.8	34.3	-36	0	0	0	113.6
390	H	85.7	Confident	88	Confident	109 Å²	109	71.3 Å²	71.3	51%	0.505	39%	0.385	S	S	.	.	S	Bend	trans	-124.3	159.2	-172.9	59.6	-91.7	0	0	0	111.6
391	F	86.7	Confident	87.9	Confident	12 Å²	12	72 Å²	72	5%	0.053	39%	0.389	C	S	.	.			trans	-78.1	124.5	171.8	-173.3	-103.1	0	0	0	110.2	L260 T268 I348 Y351 Y381 A393 L398	L260-F391 HydrophobicContact CD2-CE1 4.49Å; L260-F391 HydrophobicContact CD2-CZ 4.22Å; T268-F391 HydrophobicContact CG2-CE1 4.2Å; T268-F391 HydrophobicContact CG2-CZ 3.9Å; I348-F391 HydrophobicContact CG2-CD2 3.97Å; I348-F391 HydrophobicContact CG2-CE2 3.58Å; I348-F391 HydrophobicContact CG2-CZ 4.43Å; Y351-F391 HydrophobicContact CD1-CB 3.76Å; Y351-F391 HydrophobicContact CD1-CD1 4.11Å; Y351-F391 HydrophobicContact CD1-CG 4.1Å; Y351-F391 HydrophobicContact CD2-CB 4.01Å; Y351-F391 HydrophobicContact CE1-CB 4.12Å; Y351-F391 HydrophobicContact CE1-CD1 4.15Å; Y351-F391 HydrophobicContact CE1-CG 4.48Å; Y351-F391 HydrophobicContact CE2-CB 4.38Å; Y351-F391 HydrophobicContact CG-CB 3.71Å; Y351-F391 HydrophobicContact CG-CG 4.45Å; Y381-F391 AromaticContact CE2-CD2 3.79Å; Y381-F391 HydrophobicContact CE2-CD2 3.79Å; Y381-F391 HydrophobicContact CE2-CE2 4Å; F391-A393 PolarHBondContact O-N 3.4Å; F391-L398 HydrophobicContact CD2-CD1 4.42Å; F391-L398 HydrophobicContact CE1-CD2 4.21Å; F391-L398 HydrophobicContact CE2-CD1 3.71Å; F391-L398 HydrophobicContact CE2-CD2 4.2Å; F391-L398 HydrophobicContact CZ-CD1 3.89Å; F391-L398 HydrophobicContact CZ-CD2 3.55Å; F391-L398 HydrophobicContact CZ-CG 4.41Å
392	P	87.9	Confident	87.8	Confident	7 Å²	7	77.9 Å²	77.9	5%	0.045	42%	0.417	C	S	.	.			trans	-64.8	128.1	177.7	-22.5	32.6	0	0	0	112.6	I388 I397 L398 V401	I388-P392 HydrophobicContact CD1-CG 3.55Å; P392-I397 HydrophobicContact CB-CB 4.17Å; P392-I397 HydrophobicContact CB-CG2 3.79Å; P392-I397 HydrophobicContact CG-CG2 4.09Å; P392-L398 HydrophobicContact CB-CB 4.42Å; P392-L398 HydrophobicContact CB-CD1 4.48Å; P392-L398 HydrophobicContact CG-CD1 4.25Å; P392-V401 HydrophobicContact CG-CG1 3.97Å
393	A	86.1	Confident	88	Confident	92 Å²	92	75.9 Å²	75.9	76%	0.76	41%	0.41	S	S	*	.	S	Bend	trans	-76	-32.1	175.6	0	0	0	0	0	113	F391	F391-A393 PolarHBondContact O-N 3.4Å
394	N	85.7	Confident	88.2	Confident	79 Å²	79	76.1 Å²	76.1	42%	0.422	41%	0.41	S	S	.	.	S	Bend	trans	-83.9	130.4	-179.1	-175.8	-53.5	0	0	0	111.1	D396 I397 L398	N394-D396 PolarHBondContact O-N 3.01Å; N394-D396 WeakPolarHBondContact OD1-CB 3.47Å; N394-D396 PolarHBondContact OD1-N 3.17Å; N394-I397 HydrophobicContact CB-CB 4.39Å; N394-I397 HydrophobicContact CB-CD1 4Å; N394-I397 HydrophobicContact CB-CG1 4.05Å; N394-I397 PolarHBondContact O-N 3.31Å; N394-L398 PolarHBondContact O-N 3.47Å
395	M	82.9	Confident	88.6	Confident	19 Å²	19	74 Å²	74	9%	0.094	38%	0.384	C	S	.	.	H	α-helix	trans	-56.4	-44.8	177.9	-78.9	-68.7	172.7	0	0	114.5	T268 Y269 F271 A311 I397 L398 H399	T268-M395 HydrophobicContact CG2-CE 4.47Å; T268-M395 WeakPolarHBondContact O-CE 3.37Å; Y269-M395 WeakPolarHBondContact O-CE 3.5Å; Y269-M395 WeakPolarHBondContact O-CG 3.48Å; F271-M395 HydrophobicContact CD2-CE 3.47Å; F271-M395 VanDerWaalsContact CD2-CE 3.47Å; F271-M395 HydrophobicContact CD2-SD 4Å; F271-M395 HydrophobicContact CE2-CE 4.15Å; F271-M395 HydrophobicContact CE2-SD 4.19Å; F271-M395 HydrophobicContact CG-CE 4.44Å; A311-M395 HydrophobicContact CB-SD 4.25Å; M395-I397 PolarHBondContact O-N 3.01Å; M395-L398 CarbonylContact O-C 3.56Å; M395-L398 PolarHBondContact O-N 3.41Å; M395-L398 VanDerWaalsContact O-N 3.12Å; M395-H399 PolarHBondContact O-N 2.72Å; M395-H399 PolarHBondContact O-ND1 3.47Å
396	D	84.8	Confident	88.9	Confident	97 Å²	97	75 Å²	75	52%	0.519	37%	0.373	S	S	.	.	H	α-helix	trans	-67.2	-31.2	-176.3	-60.5	-32.1	0	0	0	111.1	N394 K400	N394-D396 PolarHBondContact O-N 3.01Å; N394-D396 WeakPolarHBondContact OD1-CB 3.47Å; N394-D396 PolarHBondContact OD1-N 3.17Å; D396-K400 WeakPolarHBondContact O-CD 3.23Å; D396-K400 VanDerWaalsContact O-CG 3.29Å; D396-K400 WeakPolarHBondContact O-CG 3.48Å
397	I	87.2	Confident	89.1	Confident	68 Å²	68	70.6 Å²	70.6	35%	0.349	36%	0.36	S	S	.	.	H	α-helix	trans	-71.1	-46.1	171.6	-58.5	-179	0	0	0	109.4	L383 P392 N394 M395 H399 K400 V401	L383-I397 HydrophobicContact CD1-CG2 3.88Å; L383-I397 HydrophobicContact CD2-CG2 3.67Å; L383-I397 HydrophobicContact CG-CG2 4.43Å; P392-I397 HydrophobicContact CB-CB 4.17Å; P392-I397 HydrophobicContact CB-CG2 3.79Å; P392-I397 HydrophobicContact CG-CG2 4.09Å; N394-I397 HydrophobicContact CB-CB 4.39Å; N394-I397 HydrophobicContact CB-CD1 4Å; N394-I397 HydrophobicContact CB-CG1 4.05Å; N394-I397 PolarHBondContact O-N 3.31Å; M395-I397 PolarHBondContact O-N 3.01Å; I397-H399 PolarHBondContact O-N 3.29Å; I397-K400 PolarHBondContact O-N 3.46Å; I397-V401 WeakPolarHBondContact O-CG1 3.3Å; I397-V401 PolarHBondContact O-N 2.86Å
398	L	87	Confident	89.1	Confident	5 Å²	5	65 Å²	65	3%	0.026	34%	0.34	C	S	.	.	H	α-helix	trans	-62.2	-29.2	179.6	-168.7	61.4	0	0	0	112.9	T268 A311 P313 Y381 F391 P392 N394 M395 K400 V401	T268-L398 HydrophobicContact CG2-CD2 3.93Å; A311-L398 HydrophobicContact CB-CB 3.95Å; A311-L398 HydrophobicContact CB-CD2 3.72Å; A311-L398 HydrophobicContact CB-CG 3.6Å; P313-L398 HydrophobicContact CG-CD1 3.88Å; P313-L398 HydrophobicContact CG-CG 4.31Å; Y381-L398 HydrophobicContact CE2-CD1 4.11Å; F391-L398 HydrophobicContact CD2-CD1 4.42Å; F391-L398 HydrophobicContact CE1-CD2 4.21Å; F391-L398 HydrophobicContact CE2-CD1 3.71Å; F391-L398 HydrophobicContact CE2-CD2 4.2Å; F391-L398 HydrophobicContact CZ-CD1 3.89Å; F391-L398 HydrophobicContact CZ-CD2 3.55Å; F391-L398 HydrophobicContact CZ-CG 4.41Å; P392-L398 HydrophobicContact CB-CB 4.42Å; P392-L398 HydrophobicContact CB-CD1 4.48Å; P392-L398 HydrophobicContact CG-CD1 4.25Å; N394-L398 PolarHBondContact O-N 3.47Å; M395-L398 CarbonylContact O-C 3.56Å; M395-L398 PolarHBondContact O-N 3.41Å; M395-L398 VanDerWaalsContact O-N 3.12Å; L398-K400 VanDerWaalsContact C-N 3.33Å; L398-V401 HydrophobicContact CD1-CG2 4.42Å; L398-V401 VanDerWaalsContact O-CG2 3.25Å; L398-V401 WeakPolarHBondContact O-CG2 3.26Å
399	H	86.6	Confident	89.2	Confident	112 Å²	112	67.4 Å²	67.4	52%	0.519	36%	0.357	S	S	.	.	H	α-helix	trans	-73.4	-23.5	172.5	-74.4	94.3	0	0	0	113.5	A311 M395 I397	A311-H399 WeakPolarHBondContact CA-NE2 3.42Å; A311-H399 PolarHBondContact N-NE2 2.85Å; M395-H399 PolarHBondContact O-N 2.72Å; M395-H399 PolarHBondContact O-ND1 3.47Å; I397-H399 PolarHBondContact O-N 3.29Å
400	K	89.5	Confident	89.4	Confident	153 Å²	153	62.1 Å²	62.1	67%	0.665	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-0.6	-178	-68.3	172.7	-173.9	176.6	0	113.1	L383 D396 I397 L398	L383-K400 HydrophobicContact CD1-CB 4.13Å; D396-K400 WeakPolarHBondContact O-CD 3.23Å; D396-K400 VanDerWaalsContact O-CG 3.29Å; D396-K400 WeakPolarHBondContact O-CG 3.48Å; I397-K400 PolarHBondContact O-N 3.46Å; L398-K400 VanDerWaalsContact C-N 3.33Å
401	V	91.3	Very high	89.7	Confident	17 Å²	17	57.4 Å²	57.4	10%	0.103	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-73.4	136.2	179.6	-55.6	0	0	0	0	110.6	P313 Y381 K382 I388 P392 I397 L398	P313-V401 HydrophobicContact CB-CG2 3.88Å; P313-V401 HydrophobicContact CG-CG2 3.9Å; Y381-V401 HydrophobicContact CD1-CG2 4.39Å; Y381-V401 HydrophobicContact CD2-CG1 4.41Å; Y381-V401 HydrophobicContact CD2-CG2 4.36Å; Y381-V401 HydrophobicContact CG-CB 4.3Å; Y381-V401 HydrophobicContact CG-CG2 4.25Å; K382-V401 WeakPolarHBondContact O-CA 3.12Å; I388-V401 HydrophobicContact CD1-CG1 4.45Å; P392-V401 HydrophobicContact CG-CG1 3.97Å; I397-V401 WeakPolarHBondContact O-CG1 3.3Å; I397-V401 PolarHBondContact O-N 2.86Å; L398-V401 HydrophobicContact CD1-CG2 4.42Å; L398-V401 VanDerWaalsContact O-CG2 3.25Å; L398-V401 WeakPolarHBondContact O-CG2 3.26Å
402	E	91.4	Very high	89.8	Confident	124 Å²	124	63 Å²	63	58%	0.579	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	127.4	167.6	-67	174.2	-178.2	0	0	108.4	K382	K382-E402 HydrophobicContact CB-CB 4.24Å; K382-E402 PolarHBondContact N-O 3.02Å; K382-E402 PolarHBondContact O-N 2.72Å
403	V	93.9	Very high	89.8	Confident	24 Å²	24	66.3 Å²	66.3	15%	0.145	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	127.3	179.9	-176.2	0	0	0	0	110	P313 T314 Y381 Y405	P313-V403 HydrophobicContact CB-CG2 3.47Å; P313-V403 VanDerWaalsContact CB-CG2 3.47Å; P313-V403 WeakPolarHBondContact O-CG2 3.48Å; T314-V403 HydrophobicContact CG2-CG1 4.05Å; T314-V403 HydrophobicContact CG2-CG2 4.28Å; Y381-V403 HydrophobicContact CD1-CG2 4.04Å; Y381-V403 HydrophobicContact CE1-CG2 3.94Å; V403-Y405 HydrophobicContact CB-CD2 4.28Å; V403-Y405 HydrophobicContact CB-CE1 4.42Å; V403-Y405 HydrophobicContact CB-CE2 3.63Å; V403-Y405 HydrophobicContact CG1-CD1 4.15Å; V403-Y405 HydrophobicContact CG1-CD2 4.15Å; V403-Y405 HydrophobicContact CG1-CE1 3.79Å; V403-Y405 HydrophobicContact CG1-CE2 3.79Å; V403-Y405 HydrophobicContact CG1-CG 4.33Å; V403-Y405 WeakPolarHBondContact O-CD2 3.41Å
404	E	94.3	Very high	90	Very high	55 Å²	55	67.3 Å²	67.3	26%	0.257	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	121.6	166.1	-175	170.1	94.4	0	0	108.8	G378 V379 A380 K382 R387	G378-E404 CarbonylContact C-O 3.54Å; G378-E404 WeakPolarHBondContact CA-O 3.49Å; V379-E404 HydrophobicContact CG2-CB 4.28Å; V379-E404 HydrophobicContact CG2-CG 4.02Å; V379-E404 WeakPolarHBondContact CG2-O 3.43Å; V379-E404 PolarHBondContact N-O 2.82Å; A380-E404 HydrophobicContact CB-CB 4.12Å; A380-E404 PolarHBondContact O-N 3.47Å; K382-E404 WeakPolarHBondContact CE-OE2 3.4Å; K382-E404 IonicContact NZ-OE2 2.67Å; K382-E404 PolarHBondContact NZ-OE2 3.09Å; R387-E404 IonicContact CZ-OE1 3.44Å; R387-E404 IonicContact NH1-OE1 3.54Å
405	Y	94.9	Very high	90.1	Very high	74 Å²	74	63.7 Å²	63.7	29%	0.29	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	143.3	-178.9	-67.9	-81.9	0	0	0	111.7	T314 W343 K376 V377 V403	T314-Y405 WeakPolarHBondContact CA-OH 3.37Å; T314-Y405 HydrophobicContact CG2-CE1 3.96Å; W343-Y405 HydrophobicContact CB-CE1 4.02Å; W343-Y405 AromaticContact CD1-CE1 3.83Å; W343-Y405 HydrophobicContact CG-CE1 4.23Å; K376-Y405 HydrophobicContact CB-CD1 3.8Å; K376-Y405 HydrophobicContact CB-CG 4.25Å; V377-Y405 CarbonylContact O-C 3.58Å; V377-Y405 VanDerWaalsContact O-CA 3.3Å; V377-Y405 WeakPolarHBondContact O-CA 3.4Å; V403-Y405 HydrophobicContact CB-CD2 4.28Å; V403-Y405 HydrophobicContact CB-CE1 4.42Å; V403-Y405 HydrophobicContact CB-CE2 3.63Å; V403-Y405 HydrophobicContact CG1-CD1 4.15Å; V403-Y405 HydrophobicContact CG1-CD2 4.15Å; V403-Y405 HydrophobicContact CG1-CE1 3.79Å; V403-Y405 HydrophobicContact CG1-CE2 3.79Å; V403-Y405 HydrophobicContact CG1-CG 4.33Å; V403-Y405 WeakPolarHBondContact O-CD2 3.41Å
406	E	93.9	Very high	90.1	Very high	80 Å²	80	64.9 Å²	64.9	37%	0.374	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.4	162.4	-166.5	168.2	157.8	0	0	109	K376 V377 V379 F408 F434	K376-E406 CarbonylContact C-O 3.53Å; K376-E406 WeakPolarHBondContact CA-O 3.4Å; V377-E406 PolarHBondContact N-O 3.32Å; V377-E406 PolarHBondContact O-N 2.88Å; V379-E406 HydrophobicContact CG1-CB 3.93Å; E406-F408 HydrophobicContact CB-CE2 3.97Å; E406-F408 HydrophobicContact CB-CZ 4.49Å; E406-F408 HydrophobicContact CG-CE2 3.77Å; E406-F408 HydrophobicContact CG-CZ 3.87Å; E406-F408 WeakPolarHBondContact OE1-CZ 3.2Å; E406-F434 HydrophobicContact CB-CZ 4.3Å; E406-F434 VanDerWaalsContact CD-CE2 3.43Å; E406-F434 VanDerWaalsContact CD-CZ 3.5Å; E406-F434 HydrophobicContact CG-CZ 4.38Å; E406-F434 WeakPolarHBondContact OE1-CE2 3.24Å; E406-F434 WeakPolarHBondContact OE2-CE2 3.45Å; E406-F434 WeakPolarHBondContact OE2-CZ 3.44Å
407	T	94.3	Very high	90.2	Very high	72 Å²	72	64 Å²	64	44%	0.442	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	127.7	-175.4	-54.9	0	0	0	0	110	E374 K376	E374-T407 HydrophobicContact CB-CG2 4Å; E374-T407 HydrophobicContact CG-CG2 4.28Å; K376-T407 HydrophobicContact CG-CG2 4.39Å
408	F	91.8	Very high	90.3	Very high	30 Å²	30	61.1 Å²	61.1	13%	0.132	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	143.9	176.5	-67.5	-88.5	0	0	0	110.6	E374 I375 V377 E406 G410 Y431 F434	E374-F408 WeakPolarHBondContact CA-O 3.05Å; I375-F408 PolarHBondContact N-O 2.88Å; I375-F408 PolarHBondContact O-N 2.89Å; V377-F408 HydrophobicContact CB-CE2 4.39Å; V377-F408 HydrophobicContact CG2-CD2 4.05Å; V377-F408 HydrophobicContact CG2-CE2 4.13Å; E406-F408 HydrophobicContact CB-CE2 3.97Å; E406-F408 HydrophobicContact CB-CZ 4.49Å; E406-F408 HydrophobicContact CG-CE2 3.77Å; E406-F408 HydrophobicContact CG-CZ 3.87Å; E406-F408 WeakPolarHBondContact OE1-CZ 3.2Å; F408-G410 PolarHBondContact O-N 3.09Å; F408-Y431 HydrophobicContact CD2-CD2 4.43Å; F408-Y431 HydrophobicContact CG-CD2 4.39Å; F408-F434 HydrophobicContact CE1-CB 4.16Å; F408-F434 HydrophobicContact CE1-CD1 4.34Å; F408-F434 HydrophobicContact CE1-CD2 4.12Å; F408-F434 AromaticContact CE1-CG 3.94Å; F408-F434 HydrophobicContact CE1-CG 3.94Å; F408-F434 AromaticContact CE2-CD1 3.68Å; F408-F434 HydrophobicContact CE2-CD1 3.68Å; F408-F434 HydrophobicContact CE2-CD2 4.45Å; F408-F434 AromaticContact CE2-CE1 3.63Å; F408-F434 HydrophobicContact CE2-CE1 3.63Å; F408-F434 HydrophobicContact CE2-CE2 4.42Å; F408-F434 HydrophobicContact CE2-CG 4.1Å; F408-F434 HydrophobicContact CE2-CZ 4.02Å; F408-F434 HydrophobicContact CZ-CB 4.03Å; F408-F434 AromaticContact CZ-CD1 3.43Å; F408-F434 HydrophobicContact CZ-CD1 3.43Å; F408-F434 VanDerWaalsContact CZ-CD1 3.43Å; F408-F434 AromaticContact CZ-CD2 3.49Å; F408-F434 HydrophobicContact CZ-CD2 3.49Å; F408-F434 VanDerWaalsContact CZ-CD2 3.49Å; F408-F434 AromaticContact CZ-CE1 3.63Å; F408-F434 HydrophobicContact CZ-CE1 3.63Å; F408-F434 AromaticContact CZ-CE2 3.69Å; F408-F434 HydrophobicContact CZ-CE2 3.69Å; F408-F434 AromaticContact CZ-CG 3.34Å; F408-F434 HydrophobicContact CZ-CG 3.34Å; F408-F434 AromaticContact CZ-CZ 3.75Å; F408-F434 HydrophobicContact CZ-CZ 3.75Å
409	P	91.8	Very high	90.3	Very high	74 Å²	74	65.6 Å²	65.6	48%	0.481	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	128.8	171.9	29.3	-33.3	0	0	0	109.5	K427	P409-K427 HydrophobicContact CB-CD 4.3Å; P409-K427 HydrophobicContact CG-CD 4.33Å; P409-K427 HydrophobicContact CG-CG 4.47Å
410	G	89.6	Confident	90.5	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.01	34%	0.342	C	S	.	.			trans	-68.2	160.9	171.3	0	0	0	0	0	112.2	L372 D373 F408 K427	L372-G410 WeakPolarHBondContact O-CA 3.38Å; D373-G410 PolarHBondContact O-N 3.04Å; F408-G410 PolarHBondContact O-N 3.09Å; G410-K427 WeakPolarHBondContact O-CD 3.47Å; G410-K427 PolarHBondContact O-NZ 2.89Å
411	W	91.1	Very high	90.4	Very high	11 Å²	11	61.8 Å²	61.8	4%	0.042	32%	0.318	C	S	.	.			trans	-99.4	-13.8	-172.7	46.8	90.9	0	0	0	115.5	L366 L369 D370 I375 T413 P425 K427 A428 Y431	L366-W411 HydrophobicContact CD1-CH2 3.69Å; L366-W411 HydrophobicContact CD1-CZ2 3.86Å; L366-W411 HydrophobicContact CG-CH2 4.32Å; L366-W411 HydrophobicContact CG-CZ2 3.99Å; L369-W411 HydrophobicContact CB-CH2 3.8Å; L369-W411 HydrophobicContact CB-CZ2 3.67Å; L369-W411 HydrophobicContact CD1-CH2 4.15Å; D370-W411 PolarHBondContact OD1-NE1 3.38Å; I375-W411 HydrophobicContact CD1-CE3 3.88Å; I375-W411 HydrophobicContact CD1-CH2 3.55Å; I375-W411 HydrophobicContact CD1-CZ2 4.38Å; I375-W411 HydrophobicContact CD1-CZ3 3.26Å; W411-T413 PolarHBondContact O-N 3.05Å; W411-T413 PolarHBondContact O-OG1 3.21Å; W411-P425 HydrophobicContact CB-CB 4.06Å; W411-P425 HydrophobicContact CB-CG 4.29Å; W411-P425 HydrophobicContact CG-CG 4.44Å; W411-K427 HydrophobicContact CB-CB 4.07Å; W411-K427 HydrophobicContact CB-CD 4.31Å; W411-K427 HydrophobicContact CE3-CB 4.42Å; W411-A428 HydrophobicContact CD2-CB 3.81Å; W411-A428 HydrophobicContact CE3-CB 3.86Å; W411-A428 HydrophobicContact CG-CB 4.32Å; W411-A428 HydrophobicContact CH2-CB 4.33Å; W411-A428 HydrophobicContact CZ2-CB 4.26Å; W411-A428 HydrophobicContact CZ3-CB 4.12Å; W411-Y431 HydrophobicContact CH2-CD1 4.4Å; W411-Y431 HydrophobicContact CZ3-CG 4.26Å
412	K	89.1	Confident	90.3	Very high	130 Å²	130	67.5 Å²	67.5	57%	0.565	35%	0.348	S	S	*	.			trans	46	33.6	175.7	-56.9	-161.5	-165.3	-151.7	0	114.3	D370 D373	D370-K412 CarbonylContact O-C 3.59Å; D370-K412 WeakPolarHBondContact O-CA 3.35Å; D370-K412 PolarHBondContact O-N 3.17Å; D370-K412 VanDerWaalsContact O-N 3.08Å; D373-K412 WeakPolarHBondContact OD1-CE 3.19Å; D373-K412 IonicContact OD1-NZ 3.51Å; D373-K412 PolarHBondContact OD1-NZ 2.98Å; D373-K412 IonicContact OD2-NZ 3.89Å; D373-K412 PolarHBondContact OD2-NZ 3.19Å
413	T	88.8	Confident	90.3	Very high	76 Å²	76	65.7 Å²	65.7	47%	0.466	34%	0.342	S	S	.	.	S	Bend	trans	-138.6	134.5	-173.5	-54.8	0	0	0	0	108.2	D370 W411 T415 P425	D370-T413 VanDerWaalsContact CB-O 3.32Å; D370-T413 WeakPolarHBondContact CB-O 3.45Å; D370-T413 PolarHBondContact O-N 3.34Å; W411-T413 PolarHBondContact O-N 3.05Å; W411-T413 PolarHBondContact O-OG1 3.21Å; T413-T415 PolarHBondContact O-N 3.33Å; T413-P425 HydrophobicContact CG2-CG 4.28Å
414	D	89.4	Confident	90	Very high	112 Å²	112	64.8 Å²	64.8	60%	0.599	34%	0.337	S	S	*	.			trans	-69.3	122.3	177.4	-174.2	1.2	0	0	0	110.6	D370 S416	D370-D414 WeakPolarHBondContact OD2-CA 3.33Å; D414-S416 VanDerWaalsContact CG-OG 3.3Å; D414-S416 WeakPolarHBondContact OD1-CB 3.15Å; D414-S416 PolarHBondContact OD1-N 3.44Å; D414-S416 PolarHBondContact OD1-OG 2.96Å; D414-S416 PolarHBondContact OD2-OG 3.31Å
415	T	87.6	Confident	89.9	Confident	3 Å²	3	63.6 Å²	63.6	2%	0.018	33%	0.334	C	S	.	.			trans	-103	-0.8	179.7	62.1	0	0	0	0	112.8	D370 T413 A417 A418 L424 P425 V448	D370-T415 VanDerWaalsContact CG-OG1 3.3Å; D370-T415 WeakPolarHBondContact OD1-CG2 3.35Å; D370-T415 PolarHBondContact OD1-OG1 2.66Å; D370-T415 PolarHBondContact OD2-N 3.46Å; D370-T415 PolarHBondContact OD2-OG1 3.03Å; T413-T415 PolarHBondContact O-N 3.33Å; T415-A417 PolarHBondContact O-N 3.03Å; T415-A417 VanDerWaalsContact O-N 3.17Å; T415-A418 WeakPolarHBondContact O-CB 3.48Å; T415-A418 PolarHBondContact O-N 3.2Å; T415-L424 HydrophobicContact CG2-CD2 4.26Å; T415-P425 HydrophobicContact CG2-CG 4.14Å; T415-V448 WeakPolarHBondContact O-CB 3.29Å; T415-V448 WeakPolarHBondContact O-CG2 3.48Å
416	S	84.6	Confident	89.8	Confident	44 Å²	44	63.3 Å²	63.3	31%	0.308	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-27.4	-172.6	65.5	0	0	0	0	115	D414 R419 V448	D414-S416 VanDerWaalsContact CG-OG 3.3Å; D414-S416 WeakPolarHBondContact OD1-CB 3.15Å; D414-S416 PolarHBondContact OD1-N 3.44Å; D414-S416 PolarHBondContact OD1-OG 2.96Å; D414-S416 PolarHBondContact OD2-OG 3.31Å; S416-R419 PolarHBondContact O-NH1 3.36Å; S416-V448 VanDerWaalsContact CA-O 3.28Å; S416-V448 WeakPolarHBondContact CA-O 3.06Å
417	A	86.8	Confident	89.7	Confident	78 Å²	78	64.1 Å²	64.1	65%	0.645	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-8.5	176.7	0	0	0	0	0	113.8	T415 R419	T415-A417 PolarHBondContact O-N 3.03Å; T415-A417 VanDerWaalsContact O-N 3.17Å; A417-R419 VanDerWaalsContact C-NH1 3.27Å; A417-R419 PolarHBondContact O-N 3.32Å; A417-R419 PolarHBondContact O-NH1 3.41Å
418	A	87.9	Confident	89.5	Confident	8 Å²	8	60.7 Å²	60.7	7%	0.066	33%	0.328	C	S	.	.			trans	-64.4	136.4	-178.8	0	0	0	0	0	111	T415 D423 L424 I456	T415-A418 WeakPolarHBondContact O-CB 3.48Å; T415-A418 PolarHBondContact O-N 3.2Å; A418-D423 HydrophobicContact CB-CB 3.84Å; A418-L424 HydrophobicContact CB-CD2 3.85Å; A418-I456 HydrophobicContact CB-CD1 3.76Å
419	R	88.1	Confident	89.5	Confident	99 Å²	99	60.9 Å²	60.9	37%	0.374	33%	0.329	S	S	.	.			trans	-126.2	-17.4	178.3	-63.8	-63.3	178	-89.5	-0.1	112.8	S416 A417 D423 E453 C454	S416-R419 PolarHBondContact O-NH1 3.36Å; A417-R419 VanDerWaalsContact C-NH1 3.27Å; A417-R419 PolarHBondContact O-N 3.32Å; A417-R419 PolarHBondContact O-NH1 3.41Å; R419-D423 PolarHBondContact N-OD2 2.74Å; R419-E453 WeakPolarHBondContact CD-O 3.48Å; R419-E453 PolarHBondContact NE-O 2.9Å; R419-C454 PolarHBondContact NH2-SG 2.89Å
420	K	89.9	Confident	89.5	Confident	144 Å²	144	61.9 Å²	61.9	63%	0.626	33%	0.33	S	S	*	.	S	Bend	trans	-124.1	155.9	177.2	-60.2	176.7	-177.7	175.6	0	110.2	N422 D423	K420-N422 PolarHBondContact O-N 3.1Å; K420-D423 PolarHBondContact N-OD2 3.3Å; K420-D423 WeakPolarHBondContact O-CB 3.46Å; K420-D423 PolarHBondContact O-N 2.94Å
421	W	88.4	Confident	89.7	Confident	41 Å²	41	61.9 Å²	61.9	16%	0.155	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-51.3	-43.6	174	172.3	-106.8	0	0	0	112.8	D423 L424 Q429 I432 R433 M458	W421-D423 PolarHBondContact O-N 3.19Å; W421-L424 HydrophobicContact CE3-CD1 3.81Å; W421-L424 HydrophobicContact CZ3-CD1 4.13Å; W421-L424 WeakPolarHBondContact O-CB 3.37Å; W421-L424 PolarHBondContact O-N 2.91Å; W421-L424 VanDerWaalsContact O-N 3.09Å; W421-Q429 HydrophobicContact CD2-CG 4.19Å; W421-Q429 HydrophobicContact CE3-CG 4.33Å; W421-Q429 HydrophobicContact CH2-CB 3.66Å; W421-Q429 HydrophobicContact CH2-CG 3.83Å; W421-Q429 HydrophobicContact CZ2-CB 3.46Å; W421-Q429 VanDerWaalsContact CZ2-CB 3.46Å; W421-Q429 HydrophobicContact CZ2-CG 3.53Å; W421-Q429 HydrophobicContact CZ3-CB 4.43Å; W421-Q429 HydrophobicContact CZ3-CG 4.2Å; W421-Q429 PolarHBondContact O-NE2 3.4Å; W421-I432 HydrophobicContact CE3-CD1 4.48Å; W421-I432 HydrophobicContact CH2-CB 4.03Å; W421-I432 HydrophobicContact CH2-CD1 4.26Å; W421-I432 HydrophobicContact CH2-CG2 4.06Å; W421-I432 HydrophobicContact CZ3-CB 4.03Å; W421-I432 HydrophobicContact CZ3-CD1 3.56Å; W421-I432 HydrophobicContact CZ3-CG1 4.41Å; W421-I432 HydrophobicContact CZ3-CG2 3.87Å; W421-R433 HydrophobicContact CH2-CG 4.38Å; W421-R433 HydrophobicContact CZ2-CG 4.45Å; W421-M458 HydrophobicContact CB-CE 4.5Å; W421-M458 HydrophobicContact CB-SD 3.91Å; W421-M458 HydrophobicContact CD2-CE 3.51Å; W421-M458 HydrophobicContact CD2-SD 3.76Å; W421-M458 HydrophobicContact CE3-CE 3.19Å; W421-M458 HydrophobicContact CE3-SD 3.19Å; W421-M458 HydrophobicContact CG-CE 4.1Å; W421-M458 HydrophobicContact CG-SD 4.09Å; W421-M458 HydrophobicContact CH2-CE 3.98Å; W421-M458 HydrophobicContact CZ2-CE 4.32Å; W421-M458 HydrophobicContact CZ3-CE 3.42Å; W421-M458 VanDerWaalsContact CZ3-CE 3.42Å; W421-M458 HydrophobicContact CZ3-SD 3.82Å
422	N	89.6	Confident	89.7	Confident	137 Å²	137	61.3 Å²	61.3	73%	0.733	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-69.2	-14.6	-178.3	-65.9	-18.1	0	0	0	113.7	K420 L424	K420-N422 PolarHBondContact O-N 3.1Å; N422-L424 VanDerWaalsContact C-N 3.29Å
423	D	89.6	Confident	89.9	Confident	86 Å²	86	61 Å²	61	46%	0.46	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-78.9	-18.6	175.3	-52.6	-21.8	0	0	0	111.2	A418 R419 K420 W421	A418-D423 HydrophobicContact CB-CB 3.84Å; R419-D423 PolarHBondContact N-OD2 2.74Å; K420-D423 PolarHBondContact N-OD2 3.3Å; K420-D423 WeakPolarHBondContact O-CB 3.46Å; K420-D423 PolarHBondContact O-N 2.94Å; W421-D423 PolarHBondContact O-N 3.19Å
424	L	89.4	Confident	90.1	Very high	5 Å²	5	58.9 Å²	58.9	3%	0.026	31%	0.308	C	S	.	.	S	Bend	trans	-75.6	140	180	-65.4	174.2	0	0	0	111	L366 T415 A418 W421 N422 Q429 I432 V446 V448 I456	L366-L424 HydrophobicContact CD2-CD2 4.46Å; T415-L424 HydrophobicContact CG2-CD2 4.26Å; A418-L424 HydrophobicContact CB-CD2 3.85Å; W421-L424 HydrophobicContact CE3-CD1 3.81Å; W421-L424 HydrophobicContact CZ3-CD1 4.13Å; W421-L424 WeakPolarHBondContact O-CB 3.37Å; W421-L424 PolarHBondContact O-N 2.91Å; W421-L424 VanDerWaalsContact O-N 3.09Å; N422-L424 VanDerWaalsContact C-N 3.29Å; L424-Q429 HydrophobicContact CB-CG 3.95Å; L424-Q429 PolarHBondContact O-NE2 3.3Å; L424-I432 HydrophobicContact CD1-CD1 3.83Å; L424-V446 HydrophobicContact CD1-CG1 4.48Å; L424-V448 HydrophobicContact CD2-CG1 4.22Å; L424-I456 HydrophobicContact CD1-CD1 4.19Å; L424-I456 HydrophobicContact CD2-CD1 3.96Å; L424-I456 HydrophobicContact CG-CD1 4.07Å
425	P	91.9	Very high	90.2	Very high	30 Å²	30	53.6 Å²	53.6	20%	0.195	28%	0.279	C	S	.	.			trans	-57.5	145.7	174.2	-23.5	32.2	0	0	0	112.1	W411 T413 T415 K427 A428 Q429	W411-P425 HydrophobicContact CB-CB 4.06Å; W411-P425 HydrophobicContact CB-CG 4.29Å; W411-P425 HydrophobicContact CG-CG 4.44Å; T413-P425 HydrophobicContact CG2-CG 4.28Å; T415-P425 HydrophobicContact CG2-CG 4.14Å; P425-K427 PolarHBondContact O-N 3.31Å; P425-A428 HydrophobicContact CB-CB 4.47Å; P425-A428 WeakPolarHBondContact O-CA 3.47Å; P425-A428 WeakPolarHBondContact O-CB 3.21Å; P425-A428 PolarHBondContact O-N 2.98Å; P425-Q429 PolarHBondContact O-N 3.06Å
426	A	91.5	Very high	90.4	Very high	68 Å²	68	55.2 Å²	55.2	56%	0.562	29%	0.287	S	S	*	.	H	α-helix	trans	-53.4	-34.8	-179.8	0	0	0	0	0	113.4	Q429 N430	A426-Q429 PolarHBondContact O-N 3.31Å; A426-N430 WeakPolarHBondContact O-CB 3.5Å; A426-N430 PolarHBondContact O-N 3.45Å; A426-N430 PolarHBondContact O-ND2 3.02Å; A426-N430 PolarHBondContact O-OD1 2.84Å
427	K	92.3	Very high	90.7	Very high	98 Å²	98	59.5 Å²	59.5	43%	0.426	31%	0.306	S	S	.	.	H	α-helix	trans	-66.8	-40.1	175.6	-65.6	177.7	178.4	179.1	0	112.7	P409 G410 W411 P425 N430 Y431	P409-K427 HydrophobicContact CB-CD 4.3Å; P409-K427 HydrophobicContact CG-CD 4.33Å; P409-K427 HydrophobicContact CG-CG 4.47Å; G410-K427 WeakPolarHBondContact O-CD 3.47Å; G410-K427 PolarHBondContact O-NZ 2.89Å; W411-K427 HydrophobicContact CB-CB 4.07Å; W411-K427 HydrophobicContact CB-CD 4.31Å; W411-K427 HydrophobicContact CE3-CB 4.42Å; P425-K427 PolarHBondContact O-N 3.31Å; K427-N430 PolarHBondContact O-N 3.36Å; K427-Y431 PolarHBondContact O-N 3.2Å
428	A	90.4	Very high	90.9	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-68.3	-40	175.2	0	0	0	0	0	111	W411 P425 N430 Y431 I432	W411-A428 HydrophobicContact CD2-CB 3.81Å; W411-A428 HydrophobicContact CE3-CB 3.86Å; W411-A428 HydrophobicContact CG-CB 4.32Å; W411-A428 HydrophobicContact CH2-CB 4.33Å; W411-A428 HydrophobicContact CZ2-CB 4.26Å; W411-A428 HydrophobicContact CZ3-CB 4.12Å; P425-A428 HydrophobicContact CB-CB 4.47Å; P425-A428 WeakPolarHBondContact O-CA 3.47Å; P425-A428 WeakPolarHBondContact O-CB 3.21Å; P425-A428 PolarHBondContact O-N 2.98Å; A428-N430 VanDerWaalsContact C-N 3.34Å; A428-N430 PolarHBondContact O-N 3.16Å; A428-Y431 WeakPolarHBondContact O-CB 3.5Å; A428-Y431 PolarHBondContact O-N 2.92Å; A428-I432 WeakPolarHBondContact O-CG1 3.35Å; A428-I432 PolarHBondContact O-N 3.42Å
429	Q	91.9	Very high	90.9	Very high	34 Å²	34	58.3 Å²	58.3	16%	0.159	29%	0.286	C	S	.	.	H	α-helix	trans	-60	-43.8	173.1	-66.8	-174.8	22.8	0	0	111.9	W421 L424 P425 A426 Y431 I432 R433	W421-Q429 HydrophobicContact CD2-CG 4.19Å; W421-Q429 HydrophobicContact CE3-CG 4.33Å; W421-Q429 HydrophobicContact CH2-CB 3.66Å; W421-Q429 HydrophobicContact CH2-CG 3.83Å; W421-Q429 HydrophobicContact CZ2-CB 3.46Å; W421-Q429 VanDerWaalsContact CZ2-CB 3.46Å; W421-Q429 HydrophobicContact CZ2-CG 3.53Å; W421-Q429 HydrophobicContact CZ3-CB 4.43Å; W421-Q429 HydrophobicContact CZ3-CG 4.2Å; W421-Q429 PolarHBondContact O-NE2 3.4Å; L424-Q429 HydrophobicContact CB-CG 3.95Å; L424-Q429 PolarHBondContact O-NE2 3.3Å; P425-Q429 PolarHBondContact O-N 3.06Å; A426-Q429 PolarHBondContact O-N 3.31Å; Q429-Y431 VanDerWaalsContact C-N 3.33Å; Q429-Y431 PolarHBondContact O-N 2.92Å; Q429-I432 PolarHBondContact O-N 3.47Å; Q429-R433 WeakPolarHBondContact O-CG 3.28Å; Q429-R433 PolarHBondContact O-N 3.02Å
430	N	92.4	Very high	91	Very high	94 Å²	94	56.6 Å²	56.6	50%	0.503	30%	0.3	S	S	.	.	H	α-helix	trans	-62.9	-39.4	176.3	-72	-15.3	0	0	0	112.1	A426 K427 A428 R433 F434	A426-N430 WeakPolarHBondContact O-CB 3.5Å; A426-N430 PolarHBondContact O-N 3.45Å; A426-N430 PolarHBondContact O-ND2 3.02Å; A426-N430 PolarHBondContact O-OD1 2.84Å; K427-N430 PolarHBondContact O-N 3.36Å; A428-N430 VanDerWaalsContact C-N 3.34Å; A428-N430 PolarHBondContact O-N 3.16Å; N430-R433 PolarHBondContact O-N 3.08Å; N430-F434 VanDerWaalsContact O-CB 3.32Å; N430-F434 WeakPolarHBondContact O-CB 3.26Å; N430-F434 PolarHBondContact O-N 2.87Å
431	Y	92.1	Very high	91.1	Very high	1 Å²	1	50 Å²	50	0%	0.004	27%	0.271	C	S	.	.	H	α-helix	trans	-60.5	-45.2	174.9	-178.3	-99.8	0	0	0	112.1	A302 L344 L366 L369 I375 V377 F408 W411 K427 A428 Q429 F434 I435	A302-Y431 PolarHBondContact O-OH 3.49Å; L344-Y431 WeakPolarHBondContact CD2-OH 3.5Å; L366-Y431 HydrophobicContact CD1-CD1 4.04Å; L366-Y431 HydrophobicContact CD1-CE1 4.21Å; L369-Y431 HydrophobicContact CD1-CE1 4.1Å; I375-Y431 HydrophobicContact CG2-CD2 4.34Å; I375-Y431 HydrophobicContact CG2-CE2 3.63Å; V377-Y431 HydrophobicContact CG2-CD2 4.37Å; V377-Y431 HydrophobicContact CG2-CE2 3.45Å; V377-Y431 VanDerWaalsContact CG2-CE2 3.45Å; F408-Y431 HydrophobicContact CD2-CD2 4.43Å; F408-Y431 HydrophobicContact CG-CD2 4.39Å; W411-Y431 HydrophobicContact CH2-CD1 4.4Å; W411-Y431 HydrophobicContact CZ3-CG 4.26Å; K427-Y431 PolarHBondContact O-N 3.2Å; A428-Y431 WeakPolarHBondContact O-CB 3.5Å; A428-Y431 PolarHBondContact O-N 2.92Å; Q429-Y431 VanDerWaalsContact C-N 3.33Å; Q429-Y431 PolarHBondContact O-N 2.92Å; Y431-F434 WeakPolarHBondContact O-CB 3.39Å; Y431-F434 PolarHBondContact O-N 3.28Å; Y431-I435 HydrophobicContact CD1-CD1 3.79Å; Y431-I435 HydrophobicContact CE1-CD1 3.37Å; Y431-I435 HydrophobicContact CE1-CG1 4.49Å; Y431-I435 WeakPolarHBondContact O-CG1 3.41Å; Y431-I435 PolarHBondContact O-N 2.95Å
432	I	91.6	Very high	91.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.3	-48.3	178.1	-65.1	163.7	0	0	0	110.6	L363 L366 W421 L424 A428 Q429 F434 I435 E436 I443 V446	L363-I432 HydrophobicContact CD2-CG1 3.99Å; L366-I432 HydrophobicContact CD2-CD1 3.84Å; L366-I432 HydrophobicContact CD2-CG1 4.44Å; W421-I432 HydrophobicContact CE3-CD1 4.48Å; W421-I432 HydrophobicContact CH2-CB 4.03Å; W421-I432 HydrophobicContact CH2-CD1 4.26Å; W421-I432 HydrophobicContact CH2-CG2 4.06Å; W421-I432 HydrophobicContact CZ3-CB 4.03Å; W421-I432 HydrophobicContact CZ3-CD1 3.56Å; W421-I432 HydrophobicContact CZ3-CG1 4.41Å; W421-I432 HydrophobicContact CZ3-CG2 3.87Å; L424-I432 HydrophobicContact CD1-CD1 3.83Å; A428-I432 WeakPolarHBondContact O-CG1 3.35Å; A428-I432 PolarHBondContact O-N 3.42Å; Q429-I432 PolarHBondContact O-N 3.47Å; I432-F434 VanDerWaalsContact C-N 3.26Å; I432-F434 PolarHBondContact O-N 3.34Å; I432-I435 WeakPolarHBondContact O-CB 3.5Å; I432-I435 PolarHBondContact O-N 2.94Å; I432-I435 VanDerWaalsContact O-N 3.12Å; I432-E436 WeakPolarHBondContact O-CG 3.32Å; I432-E436 PolarHBondContact O-N 2.91Å; I432-I443 HydrophobicContact CG2-CB 4.23Å; I432-I443 HydrophobicContact CG2-CD1 3.68Å; I432-I443 HydrophobicContact CG2-CG2 4.3Å; I432-V446 HydrophobicContact CD1-CG1 4.09Å; I432-V446 HydrophobicContact CD1-CG2 4.02Å
433	R	93.1	Very high	91.5	Very high	122 Å²	122	44.2 Å²	44.2	46%	0.46	25%	0.246	S	C	.	.	H	α-helix	trans	-60.1	-36.8	177.3	-73.2	-179.8	179.9	-168	2.3	112.6	W421 Q429 N430 E436 N437	W421-R433 HydrophobicContact CH2-CG 4.38Å; W421-R433 HydrophobicContact CZ2-CG 4.45Å; Q429-R433 WeakPolarHBondContact O-CG 3.28Å; Q429-R433 PolarHBondContact O-N 3.02Å; N430-R433 PolarHBondContact O-N 3.08Å; R433-E436 PolarHBondContact O-N 3.18Å; R433-N437 WeakPolarHBondContact O-CB 3.3Å; R433-N437 PolarHBondContact O-N 3.38Å; R433-N437 PolarHBondContact O-ND2 3.33Å
434	F	92.8	Very high	91.7	Very high	33 Å²	33	42.1 Å²	42.1	15%	0.145	23%	0.233	C	C	.	.	H	α-helix	trans	-61.7	-44.9	175.9	175.9	-101.6	0	0	0	111.6	L346 V377 V379 E406 F408 N430 Y431 I432 N437 H438	L346-F434 HydrophobicContact CD1-CD1 4.27Å; L346-F434 HydrophobicContact CD1-CE1 3.59Å; L346-F434 HydrophobicContact CD1-CZ 4.28Å; V377-F434 HydrophobicContact CB-CE1 4.3Å; V377-F434 HydrophobicContact CG1-CE1 4.09Å; V379-F434 HydrophobicContact CG1-CE1 4.2Å; V379-F434 HydrophobicContact CG1-CZ 3.76Å; E406-F434 HydrophobicContact CB-CZ 4.3Å; E406-F434 VanDerWaalsContact CD-CE2 3.43Å; E406-F434 VanDerWaalsContact CD-CZ 3.5Å; E406-F434 HydrophobicContact CG-CZ 4.38Å; E406-F434 WeakPolarHBondContact OE1-CE2 3.24Å; E406-F434 WeakPolarHBondContact OE2-CE2 3.45Å; E406-F434 WeakPolarHBondContact OE2-CZ 3.44Å; F408-F434 HydrophobicContact CE1-CB 4.16Å; F408-F434 HydrophobicContact CE1-CD1 4.34Å; F408-F434 HydrophobicContact CE1-CD2 4.12Å; F408-F434 AromaticContact CE1-CG 3.94Å; F408-F434 HydrophobicContact CE1-CG 3.94Å; F408-F434 AromaticContact CE2-CD1 3.68Å; F408-F434 HydrophobicContact CE2-CD1 3.68Å; F408-F434 HydrophobicContact CE2-CD2 4.45Å; F408-F434 AromaticContact CE2-CE1 3.63Å; F408-F434 HydrophobicContact CE2-CE1 3.63Å; F408-F434 HydrophobicContact CE2-CE2 4.42Å; F408-F434 HydrophobicContact CE2-CG 4.1Å; F408-F434 HydrophobicContact CE2-CZ 4.02Å; F408-F434 HydrophobicContact CZ-CB 4.03Å; F408-F434 AromaticContact CZ-CD1 3.43Å; F408-F434 HydrophobicContact CZ-CD1 3.43Å; F408-F434 VanDerWaalsContact CZ-CD1 3.43Å; F408-F434 AromaticContact CZ-CD2 3.49Å; F408-F434 HydrophobicContact CZ-CD2 3.49Å; F408-F434 VanDerWaalsContact CZ-CD2 3.49Å; F408-F434 AromaticContact CZ-CE1 3.63Å; F408-F434 HydrophobicContact CZ-CE1 3.63Å; F408-F434 AromaticContact CZ-CE2 3.69Å; F408-F434 HydrophobicContact CZ-CE2 3.69Å; F408-F434 AromaticContact CZ-CG 3.34Å; F408-F434 HydrophobicContact CZ-CG 3.34Å; F408-F434 AromaticContact CZ-CZ 3.75Å; F408-F434 HydrophobicContact CZ-CZ 3.75Å; N430-F434 VanDerWaalsContact O-CB 3.32Å; N430-F434 WeakPolarHBondContact O-CB 3.26Å; N430-F434 PolarHBondContact O-N 2.87Å; Y431-F434 WeakPolarHBondContact O-CB 3.39Å; Y431-F434 PolarHBondContact O-N 3.28Å; I432-F434 VanDerWaalsContact C-N 3.26Å; I432-F434 PolarHBondContact O-N 3.34Å; F434-N437 PolarHBondContact O-N 3.46Å; F434-H438 WeakPolarHBondContact O-CB 3.48Å; F434-H438 PolarHBondContact O-N 2.85Å
435	I	91.6	Very high	91.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.7	-47.4	176.2	-64	166.6	0	0	0	110.6	L344 L346 L363 Y431 I432 N437 H438 I439 I443	L344-I435 HydrophobicContact CD2-CD1 3.4Å; L344-I435 HydrophobicContact CD2-CG1 3.72Å; L346-I435 HydrophobicContact CD2-CG1 4.35Å; L346-I435 HydrophobicContact CD2-CG2 4.15Å; L363-I435 HydrophobicContact CD1-CD1 4.24Å; L363-I435 HydrophobicContact CD2-CD1 4.04Å; Y431-I435 HydrophobicContact CD1-CD1 3.79Å; Y431-I435 HydrophobicContact CE1-CD1 3.37Å; Y431-I435 HydrophobicContact CE1-CG1 4.49Å; Y431-I435 WeakPolarHBondContact O-CG1 3.41Å; Y431-I435 PolarHBondContact O-N 2.95Å; I432-I435 WeakPolarHBondContact O-CB 3.5Å; I432-I435 PolarHBondContact O-N 2.94Å; I432-I435 VanDerWaalsContact O-N 3.12Å; I435-N437 PolarHBondContact O-N 2.95Å; I435-H438 PolarHBondContact O-N 3.35Å; I435-I439 HydrophobicContact CG2-CD1 3.48Å; I435-I439 VanDerWaalsContact CG2-CD1 3.48Å; I435-I439 HydrophobicContact CG2-CG1 4.39Å; I435-I439 VanDerWaalsContact O-CG1 3.3Å; I435-I439 WeakPolarHBondContact O-CG1 3.44Å; I435-I439 PolarHBondContact O-N 2.92Å; I435-I443 HydrophobicContact CB-CD1 4.14Å; I435-I443 HydrophobicContact CG2-CD1 3.96Å
436	E	91.9	Very high	91.9	Very high	37 Å²	37	40.7 Å²	40.7	17%	0.173	22%	0.224	C	C	.	.	H	α-helix	trans	-56.8	-50	177.5	-70.1	178.7	130.3	0	0	111.8	I432 R433 H438 I439 G440 I443	I432-E436 WeakPolarHBondContact O-CG 3.32Å; I432-E436 PolarHBondContact O-N 2.91Å; R433-E436 PolarHBondContact O-N 3.18Å; E436-H438 VanDerWaalsContact C-N 3.31Å; E436-H438 PolarHBondContact O-N 3.44Å; E436-I439 PolarHBondContact O-N 3.14Å; E436-G440 WeakPolarHBondContact O-CA 3.5Å; E436-G440 PolarHBondContact O-N 3.03Å; E436-I443 HydrophobicContact CG-CB 3.95Å; E436-I443 HydrophobicContact CG-CD1 3.72Å; E436-I443 HydrophobicContact CG-CG1 3.61Å; E436-I443 PolarHBondContact OE1-N 3.45Å
437	N	92.3	Very high	91.9	Very high	134 Å²	134	37.6 Å²	37.6	72%	0.717	20%	0.198	S	C	*	.	H	α-helix	trans	-63.4	-37.4	-178.6	-71.9	-22.4	0	0	0	112.3	R433 F434 I435	R433-N437 WeakPolarHBondContact O-CB 3.3Å; R433-N437 PolarHBondContact O-N 3.38Å; R433-N437 PolarHBondContact O-ND2 3.33Å; F434-N437 PolarHBondContact O-N 3.46Å; I435-N437 PolarHBondContact O-N 2.95Å
438	H	89.3	Confident	91.7	Very high	48 Å²	48	32.9 Å²	32.9	22%	0.222	18%	0.178	C	C	.	.	H	α-helix	trans	-77	-33.5	-177.3	-162.7	93.9	0	0	0	112.6	L346 R350 F434 I435 E436	L346-H438 HydrophobicContact CD1-CB 3.81Å; R350-H438 VanDerWaalsContact CD-CD2 3.43Å; R350-H438 WeakPolarHBondContact CD-CD2 3.21Å; R350-H438 WeakPolarHBondContact CD-O 3.39Å; F434-H438 WeakPolarHBondContact O-CB 3.48Å; F434-H438 PolarHBondContact O-N 2.85Å; I435-H438 PolarHBondContact O-N 3.35Å; E436-H438 VanDerWaalsContact C-N 3.31Å; E436-H438 PolarHBondContact O-N 3.44Å
439	I	88.3	Confident	91.3	Very high	13 Å²	13	33.5 Å²	33.5	7%	0.067	18%	0.183	C	C	.	.	H	α-helix	trans	-85.7	-30.7	178.8	-57.6	169.1	0	0	0	111.3	L346 L349 R350 H353 I361 I435 E436 V441	L346-I439 HydrophobicContact CD2-CD1 4.23Å; L346-I439 HydrophobicContact CD2-CG1 4.29Å; L349-I439 HydrophobicContact CB-CD1 3.99Å; L349-I439 HydrophobicContact CB-CG1 4.43Å; L349-I439 HydrophobicContact CD2-CD1 3.41Å; L349-I439 VanDerWaalsContact CD2-CD1 3.41Å; L349-I439 HydrophobicContact CG-CD1 4.36Å; R350-I439 HydrophobicContact CG-CG1 4.38Å; H353-I439 HydrophobicContact CB-CG2 4.14Å; I361-I439 HydrophobicContact CD1-CD1 3.65Å; I361-I439 HydrophobicContact CD1-CG2 4.01Å; I435-I439 HydrophobicContact CG2-CD1 3.48Å; I435-I439 VanDerWaalsContact CG2-CD1 3.48Å; I435-I439 HydrophobicContact CG2-CG1 4.39Å; I435-I439 VanDerWaalsContact O-CG1 3.3Å; I435-I439 WeakPolarHBondContact O-CG1 3.44Å; I435-I439 PolarHBondContact O-N 2.92Å; E436-I439 PolarHBondContact O-N 3.14Å; I439-V441 HydrophobicContact CG2-CB 4.06Å; I439-V441 HydrophobicContact CG2-CG2 3.85Å
440	G	90.4	Very high	90.5	Very high	64 Å²	64	39.3 Å²	39.3	66%	0.66	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.1	18.6	-173.2	0	0	0	0	0	113.5	E436	E436-G440 WeakPolarHBondContact O-CA 3.5Å; E436-G440 PolarHBondContact O-N 3.03Å
441	V	92.1	Very high	89.6	Confident	5 Å²	5	37.5 Å²	37.5	3%	0.03	20%	0.203	C	C	.	.	S	Bend	trans	-128.1	132.4	-177.6	-179.9	0	0	0	0	109.3	H353 F358 I361 I439	H353-V441 WeakPolarHBondContact CE1-CG2 3.44Å; H353-V441 VanDerWaalsContact ND1-CG2 3.32Å; H353-V441 WeakPolarHBondContact ND1-CG2 3.49Å; H353-V441 WeakPolarHBondContact NE2-CG2 3.37Å; F358-V441 HydrophobicContact CB-CG1 4.2Å; I361-V441 HydrophobicContact CD1-CB 4.09Å; I361-V441 HydrophobicContact CD1-CG1 4.14Å; I361-V441 HydrophobicContact CG1-CB 4.41Å; I361-V441 HydrophobicContact CG1-CG1 3.9Å; I439-V441 HydrophobicContact CG2-CB 4.06Å; I439-V441 HydrophobicContact CG2-CG2 3.85Å
442	P	93.3	Very high	88.6	Confident	56 Å²	56	42.4 Å²	42.4	36%	0.364	22%	0.222	S	C	.	.			trans	-69.6	145	179.5	29.7	-35.9	0	0	0	111.9	A360 I361 F459	A360-P442 CarbonylContact C-O 3.56Å; A360-P442 VanDerWaalsContact CA-O 3.24Å; A360-P442 WeakPolarHBondContact CA-O 3.45Å; A360-P442 HydrophobicContact CB-CG 4.48Å; A360-P442 WeakPolarHBondContact CB-O 3.44Å; I361-P442 PolarHBondContact N-O 3.15Å; P442-F459 HydrophobicContact CB-CE1 3.95Å; P442-F459 HydrophobicContact CB-CZ 3.88Å; P442-F459 HydrophobicContact CG-CZ 4.07Å
443	I	93.6	Very high	87.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	115.1	172.1	-69.5	171.4	0	0	0	107.7	I361 L363 I432 I435 E436 W445 V446 M458 F459	I361-I443 HydrophobicContact CB-CG1 4.08Å; I361-I443 HydrophobicContact CG2-CG1 4.16Å; I361-I443 CarbonylContact O-C 3.56Å; I361-I443 WeakPolarHBondContact O-CA 3.33Å; L363-I443 HydrophobicContact CB-CD1 4.31Å; L363-I443 HydrophobicContact CB-CG2 4.05Å; L363-I443 HydrophobicContact CD2-CD1 4.32Å; I432-I443 HydrophobicContact CG2-CB 4.23Å; I432-I443 HydrophobicContact CG2-CD1 3.68Å; I432-I443 HydrophobicContact CG2-CG2 4.3Å; I435-I443 HydrophobicContact CB-CD1 4.14Å; I435-I443 HydrophobicContact CG2-CD1 3.96Å; E436-I443 HydrophobicContact CG-CB 3.95Å; E436-I443 HydrophobicContact CG-CD1 3.72Å; E436-I443 HydrophobicContact CG-CG1 3.61Å; E436-I443 PolarHBondContact OE1-N 3.45Å; I443-W445 WeakPolarHBondContact CG2-O 3.31Å; I443-V446 HydrophobicContact CG2-CG2 3.83Å; I443-M458 WeakPolarHBondContact O-CB 3.35Å; I443-M458 WeakPolarHBondContact O-CG 3.43Å; I443-F459 WeakPolarHBondContact O-CE1 3.36Å
444	K	93.1	Very high	87.4	Confident	43 Å²	43	44.1 Å²	44.1	19%	0.187	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-33.6	-179.6	-175.9	168.2	-178.5	174.3	0	112.7	F297 A360 I361 Q457 M458 F459	F297-K444 HydrophobicContact CE1-CD 4.19Å; A360-K444 HydrophobicContact CB-CB 3.74Å; I361-K444 PolarHBondContact O-N 3.1Å; K444-Q457 WeakPolarHBondContact O-CA 3.24Å; K444-M458 WeakPolarHBondContact O-CB 3.49Å; K444-M458 PolarHBondContact O-N 3.36Å; K444-F459 HydrophobicContact CB-CE1 4.1Å; K444-F459 HydrophobicContact CB-CE2 4.23Å; K444-F459 HydrophobicContact CB-CZ 3.75Å; K444-F459 HydrophobicContact CD-CD2 4.5Å; K444-F459 HydrophobicContact CD-CE2 4.01Å; K444-F459 HydrophobicContact CD-CZ 4.38Å; K444-F459 WeakPolarHBondContact CE-O 3.27Å; K444-F459 HydrophobicContact CG-CD2 4.43Å; K444-F459 HydrophobicContact CG-CE1 4.45Å; K444-F459 HydrophobicContact CG-CE2 4.06Å; K444-F459 HydrophobicContact CG-CZ 4.07Å
445	W	93.7	Very high	87	Confident	5 Å²	5	43.6 Å²	43.6	2%	0.019	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	139.4	-178.4	-64.4	-74.7	0	0	0	112.1	V48 L52 F297 I361 A362 L363 I443 M455 I456	V48-W445 HydrophobicContact CG1-CE3 4.43Å; V48-W445 HydrophobicContact CG1-CZ3 4.42Å; L52-W445 HydrophobicContact CD1-CH2 4.32Å; L52-W445 HydrophobicContact CD2-CH2 3.98Å; L52-W445 HydrophobicContact CD2-CZ2 3.98Å; F297-W445 HydrophobicContact CB-CZ3 4.31Å; F297-W445 HydrophobicContact CD1-CH2 4.21Å; F297-W445 AromaticContact CD1-CZ3 3.65Å; F297-W445 HydrophobicContact CD1-CZ3 3.65Å; F297-W445 AromaticContact CD2-CH2 3.91Å; F297-W445 HydrophobicContact CD2-CH2 3.91Å; F297-W445 AromaticContact CD2-CZ3 3.8Å; F297-W445 HydrophobicContact CD2-CZ3 3.8Å; F297-W445 AromaticContact CE1-CH2 3.96Å; F297-W445 HydrophobicContact CE1-CH2 3.96Å; F297-W445 AromaticContact CE1-CZ3 3.82Å; F297-W445 HydrophobicContact CE1-CZ3 3.82Å; F297-W445 AromaticContact CE2-CH2 3.61Å; F297-W445 HydrophobicContact CE2-CH2 3.61Å; F297-W445 AromaticContact CE2-CZ3 3.94Å; F297-W445 HydrophobicContact CE2-CZ3 3.94Å; F297-W445 HydrophobicContact CG-CH2 4.2Å; F297-W445 AromaticContact CG-CZ3 3.64Å; F297-W445 HydrophobicContact CG-CZ3 3.64Å; F297-W445 AromaticContact CZ-CH2 3.66Å; F297-W445 HydrophobicContact CZ-CH2 3.66Å; F297-W445 AromaticContact CZ-CZ3 3.97Å; F297-W445 HydrophobicContact CZ-CZ3 3.97Å; I361-W445 PolarHBondContact O-N 2.99Å; A362-W445 CarbonylContact C-O 3.55Å; A362-W445 WeakPolarHBondContact CA-O 3.46Å; A362-W445 HydrophobicContact CB-CB 4.08Å; A362-W445 HydrophobicContact CB-CE3 4.1Å; L363-W445 PolarHBondContact N-O 3.12Å; I443-W445 WeakPolarHBondContact CG2-O 3.31Å; W445-M455 HydrophobicContact CB-CG 3.95Å; W445-M455 HydrophobicContact CB-SD 3.92Å; W445-M455 HydrophobicContact CG-CG 4.19Å; W445-I456 CarbonylContact C-O 3.53Å; W445-I456 VanDerWaalsContact CA-O 3.28Å; W445-I456 WeakPolarHBondContact CA-O 3.27Å
446	V	92.8	Very high	86.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	114	175.1	-176.3	0	0	0	0	109.2	L363 L366 L424 I432 I443 V448 I456 M458	L363-V446 CarbonylContact O-C 3.58Å; L363-V446 VanDerWaalsContact O-CA 3.29Å; L363-V446 WeakPolarHBondContact O-CA 3.35Å; L366-V446 HydrophobicContact CB-CG1 4.23Å; L366-V446 HydrophobicContact CD2-CG1 3.57Å; L424-V446 HydrophobicContact CD1-CG1 4.48Å; I432-V446 HydrophobicContact CD1-CG1 4.09Å; I432-V446 HydrophobicContact CD1-CG2 4.02Å; I443-V446 HydrophobicContact CG2-CG2 3.83Å; V446-V448 HydrophobicContact CG1-CG1 4.36Å; V446-I456 HydrophobicContact CB-CB 4.31Å; V446-I456 PolarHBondContact N-O 2.99Å; V446-I456 PolarHBondContact O-N 2.82Å; V446-M458 HydrophobicContact CG2-CG 4.37Å; V446-M458 HydrophobicContact CG2-SD 4.47Å
447	G	90.8	Very high	86.7	Confident	2 Å²	2	47.1 Å²	47.1	2%	0.021	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	119	178.9	0	0	0	0	0	111.6	L363 K365 L366 C454 M455	L363-G447 PolarHBondContact O-N 3.27Å; K365-G447 PolarHBondContact N-O 3.31Å; K365-G447 VanDerWaalsContact N-O 3.1Å; L366-G447 PolarHBondContact N-O 3.27Å; G447-C454 WeakPolarHBondContact CA-O 3.32Å; G447-M455 VanDerWaalsContact CA-SD 3.58Å
448	V	88.5	Confident	86.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.229	C	C	.	.			trans	-114.3	15.1	179	-62.6	0	0	0	0	112.8	L366 D367 T415 S416 L424 V446 C454 I456	L366-V448 HydrophobicContact CB-CG1 4.49Å; D367-V448 HydrophobicContact CB-CB 4.5Å; D367-V448 WeakPolarHBondContact CB-O 3.39Å; D367-V448 VanDerWaalsContact CG-C 3.49Å; D367-V448 VanDerWaalsContact OD1-C 3.25Å; T415-V448 WeakPolarHBondContact O-CB 3.29Å; T415-V448 WeakPolarHBondContact O-CG2 3.48Å; S416-V448 VanDerWaalsContact CA-O 3.28Å; S416-V448 WeakPolarHBondContact CA-O 3.06Å; L424-V448 HydrophobicContact CD2-CG1 4.22Å; V446-V448 HydrophobicContact CG1-CG1 4.36Å; V448-C454 HydrophobicContact CG2-CB 4.1Å; V448-C454 WeakPolarHBondContact CG2-O 3.32Å; V448-C454 PolarHBondContact N-O 3.45Å; V448-I456 HydrophobicContact CG1-CD1 4.06Å; V448-I456 HydrophobicContact CG2-CD1 4.32Å; V448-I456 HydrophobicContact CG2-CG1 4.45Å
449	G	82.6	Confident	86	Confident	12 Å²	12	47.9 Å²	47.9	12%	0.124	25%	0.249	C	C	.	.	S	Bend	trans	177.2	-174	-179.2	0	0	0	0	0	114.6	K47	K47-G449 PolarHBondContact NZ-O 3.46Å
450	K	73.7	Confident	85.9	Confident	156 Å²	156	49.6 Å²	49.6	68%	0.678	26%	0.258	S	S	*	.	S	Bend	trans	-82.3	-36.6	-175.8	-71.9	-174.4	-177.7	176.8	0	114.2	K47	K47-K450 VanDerWaalsContact CE-O 3.28Å; K47-K450 WeakPolarHBondContact CE-O 3.26Å
451	S	73.7	Confident	85.7	Confident	57 Å²	57	48.8 Å²	48.8	40%	0.399	24%	0.237	S	C	.	.	S	Bend	trans	-72.1	160.7	-178.3	68.5	0	0	0	0	111.5	E453 C454	S451-E453 VanDerWaalsContact C-N 3.26Å; S451-E453 PolarHBondContact O-N 2.82Å; S451-C454 WeakPolarHBondContact O-CB 3.48Å; S451-C454 PolarHBondContact O-N 3.5Å; S451-C454 PolarHBondContact OG-N 2.97Å; S451-C454 PolarHBondContact OG-SG 2.94Å
452	R	72.1	Confident	85.3	Confident	103 Å²	103	51.3 Å²	51.3	39%	0.389	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-61.9	-34.8	175.2	-177.2	175.8	171.4	171.7	-0.3	112.7	L51 T54 C454 M455	L51-R452 HydrophobicContact CD1-CG 4.27Å; L51-R452 PolarHBondContact O-NH2 2.85Å; T54-R452 VanDerWaalsContact CB-NH2 3.28Å; T54-R452 PolarHBondContact OG1-NH1 3.36Å; T54-R452 PolarHBondContact OG1-NH2 3.08Å; R452-C454 PolarHBondContact O-N 3.4Å; R452-M455 WeakPolarHBondContact O-CB 3.35Å; R452-M455 PolarHBondContact O-N 3.28Å
453	E	76.9	Confident	84.9	Confident	147 Å²	147	51 Å²	51	69%	0.687	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-69.6	-21.4	178.4	-60.8	-179.1	175.7	0	0	113.1	R419 S451 M455	R419-E453 WeakPolarHBondContact CD-O 3.48Å; R419-E453 PolarHBondContact NE-O 2.9Å; S451-E453 VanDerWaalsContact C-N 3.26Å; S451-E453 PolarHBondContact O-N 2.82Å; E453-M455 PolarHBondContact O-N 3.48Å; E453-M455 VanDerWaalsContact O-N 3.09Å
454	C	81	Confident	84.3	Confident	12 Å²	12	54.2 Å²	54.2	8%	0.081	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-79	24.3	175.1	-69.1	0	0	0	0	112.8	R419 G447 V448 S451 R452	R419-C454 PolarHBondContact NH2-SG 2.89Å; G447-C454 WeakPolarHBondContact CA-O 3.32Å; V448-C454 HydrophobicContact CG2-CB 4.1Å; V448-C454 WeakPolarHBondContact CG2-O 3.32Å; V448-C454 PolarHBondContact N-O 3.45Å; S451-C454 WeakPolarHBondContact O-CB 3.48Å; S451-C454 PolarHBondContact O-N 3.5Å; S451-C454 PolarHBondContact OG-N 2.97Å; S451-C454 PolarHBondContact OG-SG 2.94Å; R452-C454 PolarHBondContact O-N 3.4Å
455	M	84.8	Confident	83.7	Confident	22 Å²	22	54.9 Å²	54.9	11%	0.108	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	101.5	174	-164.7	72.1	69.6	0	0	109	K47 V48 L51 W445 G447 R452 E453 Q457	K47-M455 HydrophobicContact CB-CE 3.86Å; K47-M455 HydrophobicContact CD-CE 4.33Å; V48-M455 HydrophobicContact CG2-CE 4.3Å; L51-M455 HydrophobicContact CD2-CG 4.27Å; W445-M455 HydrophobicContact CB-CG 3.95Å; W445-M455 HydrophobicContact CB-SD 3.92Å; W445-M455 HydrophobicContact CG-CG 4.19Å; G447-M455 VanDerWaalsContact CA-SD 3.58Å; R452-M455 WeakPolarHBondContact O-CB 3.35Å; R452-M455 PolarHBondContact O-N 3.28Å; E453-M455 PolarHBondContact O-N 3.48Å; E453-M455 VanDerWaalsContact O-N 3.09Å; M455-Q457 PolarHBondContact O-N 3.47Å
456	I	87.9	Confident	83	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	121.2	179.9	-55.9	173.9	0	0	0	108.1	A418 L424 W445 V446 V448	A418-I456 HydrophobicContact CB-CD1 3.76Å; L424-I456 HydrophobicContact CD1-CD1 4.19Å; L424-I456 HydrophobicContact CD2-CD1 3.96Å; L424-I456 HydrophobicContact CG-CD1 4.07Å; W445-I456 CarbonylContact C-O 3.53Å; W445-I456 VanDerWaalsContact CA-O 3.28Å; W445-I456 WeakPolarHBondContact CA-O 3.27Å; V446-I456 HydrophobicContact CB-CB 4.31Å; V446-I456 PolarHBondContact N-O 2.99Å; V446-I456 PolarHBondContact O-N 2.82Å; V448-I456 HydrophobicContact CG1-CD1 4.06Å; V448-I456 HydrophobicContact CG2-CD1 4.32Å; V448-I456 HydrophobicContact CG2-CG1 4.45Å
457	Q	89.8	Confident	82.3	Confident	110 Å²	110	63 Å²	63	51%	0.514	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	129.6	171.3	-175.1	175.6	-12.2	0	0	109.9	K444 M455 F459	K444-Q457 WeakPolarHBondContact O-CA 3.24Å; M455-Q457 PolarHBondContact O-N 3.47Å; Q457-F459 WeakPolarHBondContact CG-O 3.46Å; Q457-F459 PolarHBondContact NE2-O 3.22Å
458	M	85.3	Confident	81.6	Confident	53 Å²	53	68.1 Å²	68.1	26%	0.261	32%	0.323	S	S	.	.			trans	-85.9	-39.1	-176	-68	-70.1	-71.4	0	0	112.8	W421 I443 K444 V446	W421-M458 HydrophobicContact CB-CE 4.5Å; W421-M458 HydrophobicContact CB-SD 3.91Å; W421-M458 HydrophobicContact CD2-CE 3.51Å; W421-M458 HydrophobicContact CD2-SD 3.76Å; W421-M458 HydrophobicContact CE3-CE 3.19Å; W421-M458 HydrophobicContact CE3-SD 3.19Å; W421-M458 HydrophobicContact CG-CE 4.1Å; W421-M458 HydrophobicContact CG-SD 4.09Å; W421-M458 HydrophobicContact CH2-CE 3.98Å; W421-M458 HydrophobicContact CZ2-CE 4.32Å; W421-M458 HydrophobicContact CZ3-CE 3.42Å; W421-M458 VanDerWaalsContact CZ3-CE 3.42Å; W421-M458 HydrophobicContact CZ3-SD 3.82Å; I443-M458 WeakPolarHBondContact O-CB 3.35Å; I443-M458 WeakPolarHBondContact O-CG 3.43Å; K444-M458 WeakPolarHBondContact O-CB 3.49Å; K444-M458 PolarHBondContact O-N 3.36Å; V446-M458 HydrophobicContact CG2-CG 4.37Å; V446-M458 HydrophobicContact CG2-SD 4.47Å
459	F	82.5	Confident	80.9	Confident	145 Å²	145	74.3 Å²	74.3	64%	0.636	35%	0.352	S	S	*	.			trans	-155.1	0	-179.3	56.2	-92.3	0	0	0	112.3	A360 P442 I443 K444 Q457	A360-F459 HydrophobicContact CB-CZ 4.49Å; P442-F459 HydrophobicContact CB-CE1 3.95Å; P442-F459 HydrophobicContact CB-CZ 3.88Å; P442-F459 HydrophobicContact CG-CZ 4.07Å; I443-F459 WeakPolarHBondContact O-CE1 3.36Å; K444-F459 HydrophobicContact CB-CE1 4.1Å; K444-F459 HydrophobicContact CB-CE2 4.23Å; K444-F459 HydrophobicContact CB-CZ 3.75Å; K444-F459 HydrophobicContact CD-CD2 4.5Å; K444-F459 HydrophobicContact CD-CE2 4.01Å; K444-F459 HydrophobicContact CD-CZ 4.38Å; K444-F459 WeakPolarHBondContact CE-O 3.27Å; K444-F459 HydrophobicContact CG-CD2 4.43Å; K444-F459 HydrophobicContact CG-CE1 4.45Å; K444-F459 HydrophobicContact CG-CE2 4.06Å; K444-F459 HydrophobicContact CG-CZ 4.07Å; Q457-F459 WeakPolarHBondContact CG-O 3.46Å; Q457-F459 PolarHBondContact NE2-O 3.22Å

Retrieved 459 of 459 residues in 142 ms (Link to these results)

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