A0A087YMB1_POEFO Loading...

Tripartite motif containing 36

AlphaFold DB , UniProt , Accession A0A087YMB1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 743 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.4	Very low	30.9	Very low	236 Å²	236	158.3 Å²	158.3	100%	1.163	87%	0.871	S	S	*	*				0	132.5	0	-80.4	174.1	161.7	0	0	108.5
2	T	35.8	Very low	31.8	Very low	150 Å²	150	160.3 Å²	160.3	92%	0.92	87%	0.865	S	S	*	*			trans	87.6	68	-179.1	71	0	0	0	0	118.1
3	A	28.1	Very low	32.6	Very low	101 Å²	101	155.9 Å²	155.9	84%	0.835	85%	0.854	S	S	*	*	S	Bend	trans	-157.2	8.7	154.3	0	0	0	0	0	115.6
4	E	28.9	Very low	34.2	Very low	196 Å²	196	151.8 Å²	151.8	92%	0.916	84%	0.835	S	S	*	*	S	Bend	trans	-125.5	24.9	-173.1	-77.2	-171.1	132.7	0	0	115.2
5	M	27.4	Very low	35.7	Very low	185 Å²	185	146.9 Å²	146.9	91%	0.911	81%	0.814	S	S	*	*	S	Bend	trans	-123.7	33.7	-179.9	-93	-176.2	148	0	0	114.6
6	R	27.2	Very low	37.1	Very low	243 Å²	243	143.6 Å²	143.6	92%	0.917	79%	0.793	S	S	*	*	S	Bend	trans	-137.7	35.5	173.7	-84.2	-168.7	178.5	-179.2	0.3	114.9
7	R	29.5	Very low	38.2	Very low	251 Å²	251	145.4 Å²	145.4	95%	0.947	79%	0.791	S	S	*	*			trans	-130.7	61.8	166.6	-74.1	-170.6	-174.8	-162.3	3.2	111.4
8	S	29.5	Very low	39.9	Very low	107 Å²	107	143.4 Å²	143.4	75%	0.748	78%	0.78	S	S	*	*			trans	-144.8	62.8	171.4	37.9	0	0	0	0	109.6
9	S	29.7	Very low	42.1	Very low	120 Å²	120	139.6 Å²	139.6	84%	0.839	76%	0.758	S	S	*	*			trans	-164.6	47.8	163.8	22.9	0	0	0	0	109	A11	S9-A11 PolarHBondContact O-N 2.86Å
10	G	27.7	Very low	44.1	Very low	61 Å²	61	136.9 Å²	136.9	63%	0.629	74%	0.74	S	S	*	*			trans	-76.1	103.7	164.4	0	0	0	0	0	108	F12	G10-F12 PolarHBondContact O-N 3.26Å; G10-F12 VanDerWaalsContact O-N 3.08Å
11	A	35.7	Very low	46	Very low	91 Å²	91	140.9 Å²	140.9	75%	0.752	74%	0.744	S	S	*	*			trans	-57.4	111.6	164.8	0	0	0	0	0	107.9	S9 S13	S9-A11 PolarHBondContact O-N 2.86Å; A11-S13 PolarHBondContact O-N 3.37Å
12	F	41	Very low	48.2	Very low	183 Å²	183	136.6 Å²	136.6	80%	0.803	72%	0.721	S	S	*	*			trans	-67.1	85.6	167	-72.2	-85.9	0	0	0	107.7	G10 V14	G10-F12 PolarHBondContact O-N 3.26Å; G10-F12 VanDerWaalsContact O-N 3.08Å; F12-V14 PolarHBondContact O-N 3Å
13	S	43.3	Very low	50.8	Low	103 Å²	103	129.6 Å²	129.6	72%	0.72	68%	0.678	S	S	*	*			trans	-76.5	108.6	173.1	60	0	0	0	0	108.2	A11	A11-S13 PolarHBondContact O-N 3.37Å
14	V	54.3	Low	53.7	Low	98 Å²	98	127.4 Å²	127.4	59%	0.594	65%	0.652	S	S	*	*			trans	-50	130.1	164	179	0	0	0	0	107.7	F12 I16 N18	F12-V14 PolarHBondContact O-N 3Å; V14-I16 PolarHBondContact O-N 3.31Å; V14-N18 HydrophobicContact CG1-CB 3.86Å
15	P	57.2	Low	56.7	Low	79 Å²	79	118 Å²	118	51%	0.513	61%	0.608	S	S	.	*			trans	-54.2	132.3	179.8	-23.1	31.1	0	0	0	109.9	K17 N18	P15-K17 PolarHBondContact O-N 3.44Å; P15-N18 PolarHBondContact O-N 3.02Å
16	I	58.2	Low	59.6	Low	93 Å²	93	111.4 Å²	111.4	48%	0.477	58%	0.579	S	S	.	*	H	α-helix	trans	-52.3	-26.6	-177.5	-68.1	174.5	0	0	0	111.8	V14 N18 I19 Y143 A146	V14-I16 PolarHBondContact O-N 3.31Å; I16-N18 VanDerWaalsContact C-N 3.31Å; I16-N18 PolarHBondContact O-N 3.1Å; I16-I19 VanDerWaalsContact O-CG2 3.29Å; I16-I19 WeakPolarHBondContact O-CG2 3.45Å; I16-Y143 HydrophobicContact CG2-CD2 3.68Å; I16-Y143 HydrophobicContact CG2-CE2 3.42Å; I16-Y143 VanDerWaalsContact CG2-CE2 3.42Å; I16-Y143 WeakPolarHBondContact O-CE2 3.47Å; I16-A146 HydrophobicContact CD1-CB 4Å
17	K	55.8	Low	62.5	Low	174 Å²	174	102.4 Å²	102.4	76%	0.757	55%	0.548	S	S	*	.	H	α-helix	trans	-65.4	-26.3	175.6	-64.8	-175.7	177.7	-177.4	0	114.4	P15	P15-K17 PolarHBondContact O-N 3.44Å
18	N	68.3	Low	65.3	Low	111 Å²	111	92.8 Å²	92.8	59%	0.594	52%	0.519	S	S	*	.	H	α-helix	trans	-84	-18.4	-177	-72.7	-8.4	0	0	0	113.7	V14 P15 I16	V14-N18 HydrophobicContact CG1-CB 3.86Å; P15-N18 PolarHBondContact O-N 3.02Å; I16-N18 VanDerWaalsContact C-N 3.31Å; I16-N18 PolarHBondContact O-N 3.1Å
19	I	81.6	Confident	68.2	Low	70 Å²	70	94.6 Å²	94.6	36%	0.359	51%	0.514	S	S	.	.	H	α-helix	trans	-86	-13.5	176.9	-164.9	167.2	0	0	0	112.7	I16 R21 E22 L23 Y143	I16-I19 VanDerWaalsContact O-CG2 3.29Å; I16-I19 WeakPolarHBondContact O-CG2 3.45Å; I19-R21 VanDerWaalsContact C-N 3.26Å; I19-R21 PolarHBondContact O-N 3.29Å; I19-E22 HydrophobicContact CG1-CB 4.32Å; I19-E22 WeakPolarHBondContact O-CB 3.34Å; I19-E22 PolarHBondContact O-N 3.11Å; I19-L23 HydrophobicContact CG1-CD1 4.47Å; I19-L23 HydrophobicContact CG1-CG 4.34Å; I19-L23 HydrophobicContact CG2-CD1 4.22Å; I19-L23 WeakPolarHBondContact O-CG 3.42Å; I19-L23 PolarHBondContact O-N 3.17Å; I19-Y143 HydrophobicContact CG2-CD2 3.96Å; I19-Y143 HydrophobicContact CG2-CE2 4.05Å
20	E	82.9	Confident	70.9	Confident	86 Å²	86	95.1 Å²	95.1	40%	0.402	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-55.7	-39.1	-174.8	-172.8	171.3	-173.1	0	0	113	E22 L23 I24 Y143	E20-E22 PolarHBondContact O-N 3.42Å; E20-L23 PolarHBondContact O-N 3.47Å; E20-I24 HydrophobicContact CG-CD1 4.08Å; E20-I24 WeakPolarHBondContact O-CG1 3.42Å; E20-I24 PolarHBondContact O-N 3.08Å; E20-Y143 HydrophobicContact CB-CE2 4.36Å; E20-Y143 WeakPolarHBondContact CB-OH 3.23Å; E20-Y143 VanDerWaalsContact CG-OH 3.32Å; E20-Y143 WeakPolarHBondContact CG-OH 3.41Å; E20-Y143 PolarHBondContact OE2-OH 2.96Å
21	R	83.7	Confident	73.8	Confident	220 Å²	220	93.5 Å²	93.5	83%	0.83	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-58.4	-34.9	176.6	-68.7	-175.4	175	-173.9	-1.1	113	I19 L23	I19-R21 VanDerWaalsContact C-N 3.26Å; I19-R21 PolarHBondContact O-N 3.29Å; R21-L23 VanDerWaalsContact C-N 3.27Å; R21-L23 PolarHBondContact O-N 2.63Å
22	E	86.8	Confident	76.2	Confident	146 Å²	146	89.7 Å²	89.7	68%	0.682	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-78.7	-11.1	179.4	-58.9	-61.2	150.5	0	0	112.8	I19 E20	I19-E22 HydrophobicContact CG1-CB 4.32Å; I19-E22 WeakPolarHBondContact O-CB 3.34Å; I19-E22 PolarHBondContact O-N 3.11Å; E20-E22 PolarHBondContact O-N 3.42Å
23	L	90	Very high	78.3	Confident	4 Å²	4	84.2 Å²	84.2	2%	0.021	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-105.2	-0.4	-175.9	-59.9	-176.5	0	0	0	113.5	I19 E20 R21 L31 F32 L136 I139 V140 Y143	I19-L23 HydrophobicContact CG1-CD1 4.47Å; I19-L23 HydrophobicContact CG1-CG 4.34Å; I19-L23 HydrophobicContact CG2-CD1 4.22Å; I19-L23 WeakPolarHBondContact O-CG 3.42Å; I19-L23 PolarHBondContact O-N 3.17Å; E20-L23 PolarHBondContact O-N 3.47Å; R21-L23 VanDerWaalsContact C-N 3.27Å; R21-L23 PolarHBondContact O-N 2.63Å; L23-L31 HydrophobicContact CB-CD2 3.8Å; L23-L31 WeakPolarHBondContact O-CA 3.36Å; L23-F32 VanDerWaalsContact C-CD2 3.5Å; L23-F32 WeakPolarHBondContact O-CD2 3.5Å; L23-F32 PolarHBondContact O-N 3.17Å; L23-F32 VanDerWaalsContact O-N 3.1Å; L23-L136 HydrophobicContact CD2-CD1 3.82Å; L23-I139 HydrophobicContact CD1-CG2 4.39Å; L23-I139 HydrophobicContact CD2-CB 4.43Å; L23-I139 HydrophobicContact CD2-CG2 3.6Å; L23-V140 HydrophobicContact CB-CG2 4.1Å; L23-V140 HydrophobicContact CD2-CG2 3.93Å; L23-V140 HydrophobicContact CG-CG2 4.43Å; L23-Y143 HydrophobicContact CD1-CD1 3.98Å; L23-Y143 HydrophobicContact CD1-CD2 3.49Å; L23-Y143 VanDerWaalsContact CD1-CD2 3.49Å; L23-Y143 HydrophobicContact CD1-CE2 4.18Å; L23-Y143 HydrophobicContact CD1-CG 3.38Å
24	I	90	Very high	80.2	Confident	54 Å²	54	83.3 Å²	83.3	28%	0.277	41%	0.412	S	S	.	.	B	Isolated β-bridge	trans	-97.6	133.2	-178.1	-69.4	165	0	0	0	110.4	E20 K29 F32	E20-I24 HydrophobicContact CG-CD1 4.08Å; E20-I24 WeakPolarHBondContact O-CG1 3.42Å; E20-I24 PolarHBondContact O-N 3.08Å; I24-K29 VanDerWaalsContact CG2-C 3.5Å; I24-K29 WeakPolarHBondContact CG2-O 3.34Å; I24-F32 WeakPolarHBondContact O-CE2 3.44Å; I24-F32 WeakPolarHBondContact O-CZ 3.18Å
25	C	90.3	Very high	82	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	38%	0.384	C	S	.	.			trans	-70.4	129.9	173.1	178.7	0	0	0	0	110.6	I27 C28 K29 E30 F32 C45	C25-I27 PolarHBondContact O-N 3.01Å; C25-I27 VanDerWaalsContact O-N 3.14Å; C25-C28 WeakPolarHBondContact CB-SG 3.43Å; C25-K29 VanDerWaalsContact O-CA 3.27Å; C25-K29 WeakPolarHBondContact O-CA 3.41Å; C25-K29 PolarHBondContact O-N 2.85Å; C25-E30 WeakPolarHBondContact CB-O 3.37Å; C25-E30 PolarHBondContact N-O 2.8Å; C25-F32 HydrophobicContact CB-CD1 3.84Å; C25-F32 HydrophobicContact CB-CE1 3.74Å; C25-F32 HydrophobicContact CB-CG 4.47Å; C25-F32 HydrophobicContact CB-CZ 4.31Å; C25-C45 VanDerWaalsContact CB-SG 3.59Å; C25-C45 VanDerWaalsContact SG-SG 3.63Å
26	P	88.1	Confident	83.5	Confident	45 Å²	45	75.1 Å²	75.1	29%	0.292	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-19.8	-177.2	25.4	-34.5	0	0	0	113.7	K29 V44 P114	P26-K29 VanDerWaalsContact O-CE 3.29Å; P26-K29 WeakPolarHBondContact O-CE 3.48Å; P26-K29 PolarHBondContact O-NZ 3.06Å; P26-V44 HydrophobicContact CG-CG2 4.49Å; P26-P114 HydrophobicContact CB-CB 4.2Å; P26-P114 HydrophobicContact CG-CB 4.15Å
27	I	88.3	Confident	85	Confident	54 Å²	54	73.3 Å²	73.3	28%	0.277	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-63.3	-178.9	-55.7	178	0	0	0	111	C25 K29 V44 C48 L52 P114	C25-I27 PolarHBondContact O-N 3.01Å; C25-I27 VanDerWaalsContact O-N 3.14Å; I27-K29 VanDerWaalsContact C-N 3.3Å; I27-K29 PolarHBondContact O-N 2.84Å; I27-V44 HydrophobicContact CD1-CG1 3.37Å; I27-V44 HydrophobicContact CG1-CG1 4.18Å; I27-C48 HydrophobicContact CB-CB 3.88Å; I27-C48 HydrophobicContact CD1-CB 3.66Å; I27-C48 HydrophobicContact CG1-CB 4.34Å; I27-C48 HydrophobicContact CG2-CB 3.89Å; I27-L52 HydrophobicContact CD1-CD1 3.33Å; I27-L52 HydrophobicContact CD1-CD2 4.46Å; I27-L52 HydrophobicContact CD1-CG 3.86Å; I27-P114 HydrophobicContact CD1-CG 3.73Å; I27-P114 HydrophobicContact CG1-CB 4.17Å; I27-P114 HydrophobicContact CG1-CG 3.63Å
28	C	89.3	Confident	86.5	Confident	50 Å²	50	65.2 Å²	65.2	34%	0.338	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-6.5	-175.7	63.4	0	0	0	0	114	C25 E30	C25-C28 WeakPolarHBondContact CB-SG 3.43Å; C28-E30 PolarHBondContact O-N 3Å
29	K	89.3	Confident	87.2	Confident	145 Å²	145	64.1 Å²	64.1	63%	0.63	32%	0.315	S	S	*	.			trans	55.8	15.6	-176.9	-53.1	-56.2	-171	-167.9	0	115	I24 C25 P26 I27	I24-K29 VanDerWaalsContact CG2-C 3.5Å; I24-K29 WeakPolarHBondContact CG2-O 3.34Å; C25-K29 VanDerWaalsContact O-CA 3.27Å; C25-K29 WeakPolarHBondContact O-CA 3.41Å; C25-K29 PolarHBondContact O-N 2.85Å; P26-K29 VanDerWaalsContact O-CE 3.29Å; P26-K29 WeakPolarHBondContact O-CE 3.48Å; P26-K29 PolarHBondContact O-NZ 3.06Å; I27-K29 VanDerWaalsContact C-N 3.3Å; I27-K29 PolarHBondContact O-N 2.84Å
30	E	88.3	Confident	87.4	Confident	131 Å²	131	62.3 Å²	62.3	61%	0.612	31%	0.309	S	S	*	.	S	Bend	trans	-105.9	162.6	175.9	-68.3	-64.5	157.9	0	0	111	C25 C28 F32	C25-E30 WeakPolarHBondContact CB-O 3.37Å; C25-E30 PolarHBondContact N-O 2.8Å; C28-E30 PolarHBondContact O-N 3Å; E30-F32 PolarHBondContact O-N 2.84Å
31	L	87.2	Confident	87.5	Confident	26 Å²	26	65.4 Å²	65.4	14%	0.136	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-54.2	137.9	171.4	-70.8	176.3	0	0	0	111.2	L23 T33 V140 Y143 R144	L23-L31 HydrophobicContact CB-CD2 3.8Å; L23-L31 WeakPolarHBondContact O-CA 3.36Å; L31-T33 PolarHBondContact O-N 3.08Å; L31-V140 HydrophobicContact CB-CG1 3.92Å; L31-V140 HydrophobicContact CD1-CG1 4.41Å; L31-Y143 HydrophobicContact CD1-CD1 4.17Å; L31-Y143 HydrophobicContact CD1-CE1 4.32Å; L31-Y143 HydrophobicContact CD2-CD1 4.15Å; L31-Y143 HydrophobicContact CD2-CE1 4.16Å; L31-R144 HydrophobicContact CD1-CG 3.82Å
32	F	87.4	Confident	87.8	Confident	11 Å²	11	58.6 Å²	58.6	5%	0.048	30%	0.3	C	S	.	.			trans	-52.2	136.3	-175.9	-73.5	-79.4	0	0	0	113.4	L23 I24 C25 E30 P35 S43 L136 V140 R144	L23-F32 VanDerWaalsContact C-CD2 3.5Å; L23-F32 WeakPolarHBondContact O-CD2 3.5Å; L23-F32 PolarHBondContact O-N 3.17Å; L23-F32 VanDerWaalsContact O-N 3.1Å; I24-F32 WeakPolarHBondContact O-CE2 3.44Å; I24-F32 WeakPolarHBondContact O-CZ 3.18Å; C25-F32 HydrophobicContact CB-CD1 3.84Å; C25-F32 HydrophobicContact CB-CE1 3.74Å; C25-F32 HydrophobicContact CB-CG 4.47Å; C25-F32 HydrophobicContact CB-CZ 4.31Å; E30-F32 PolarHBondContact O-N 2.84Å; F32-P35 HydrophobicContact CB-CB 4.11Å; F32-P35 HydrophobicContact CB-CG 4.24Å; F32-P35 HydrophobicContact CD1-CB 3.93Å; F32-P35 HydrophobicContact CG-CB 4.2Å; F32-S43 WeakPolarHBondContact CE1-O 3.22Å; F32-S43 WeakPolarHBondContact CZ-O 3.49Å; F32-L136 HydrophobicContact CB-CD2 4.5Å; F32-L136 HydrophobicContact CD1-CD2 4.32Å; F32-L136 HydrophobicContact CD2-CD1 4.14Å; F32-L136 HydrophobicContact CD2-CD2 3.6Å; F32-L136 HydrophobicContact CD2-CG 4Å; F32-L136 HydrophobicContact CE1-CD2 4.47Å; F32-L136 HydrophobicContact CE2-CD2 3.79Å; F32-L136 HydrophobicContact CG-CD2 3.89Å; F32-L136 HydrophobicContact CG-CG 4.36Å; F32-L136 HydrophobicContact CZ-CD2 4.22Å; F32-V140 HydrophobicContact CB-CG2 4.2Å; F32-R144 PolarHBondContact O-NH2 3.32Å
33	T	84.2	Confident	88	Confident	69 Å²	69	52.6 Å²	52.6	42%	0.423	27%	0.274	S	S	.	.	S	Bend	trans	-126.7	119.5	172.3	53.6	0	0	0	0	108.5	L31 C45	L31-T33 PolarHBondContact O-N 3.08Å; T33-C45 PolarHBondContact N-SG 3.38Å; T33-C45 WeakPolarHBondContact O-CB 3.46Å
34	H	84.1	Confident	88	Confident	83 Å²	83	52.5 Å²	52.5	38%	0.384	27%	0.274	S	S	.	.	S	Bend	trans	45.9	60.4	-173.3	-53.3	102.9	0	0	0	113.3	H46 E137 R205	H34-H46 HydrophobicContact CB-CB 4.13Å; H34-H46 WeakPolarHBondContact O-CB 3.37Å; H34-H46 PolarHBondContact O-N 3.24Å; H34-E137 IonicContact CD2-OE1 2.7Å; H34-R205 PolarHBondContact NE2-NH1 3.12Å
35	P	90.3	Very high	88	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.013	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	139.2	-177.1	26.5	-34.2	0	0	0	112.4	F32 V44 N133 L136 E137	F32-P35 HydrophobicContact CB-CB 4.11Å; F32-P35 HydrophobicContact CB-CG 4.24Å; F32-P35 HydrophobicContact CD1-CB 3.93Å; F32-P35 HydrophobicContact CG-CB 4.2Å; P35-V44 WeakPolarHBondContact CA-O 3.13Å; P35-N133 HydrophobicContact CB-CB 4.06Å; P35-N133 HydrophobicContact CG-CB 3.94Å; P35-N133 WeakPolarHBondContact CG-O 3.47Å; P35-N133 PolarHBondContact O-N 2.92Å; P35-L136 HydrophobicContact CB-CD2 3.89Å; P35-L136 HydrophobicContact CB-CG 4.48Å; P35-L136 HydrophobicContact CG-CB 4.17Å; P35-L136 HydrophobicContact CG-CD2 4.16Å; P35-L136 HydrophobicContact CG-CG 4.22Å; P35-E137 HydrophobicContact CG-CB 4.19Å
36	L	89.1	Confident	87.9	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.016	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	141.2	172	-61.2	177.1	0	0	0	109.8	S43 V44 H46 V49 I127 L130 F131 R132	L36-S43 VanDerWaalsContact O-CA 3.25Å; L36-S43 WeakPolarHBondContact O-CA 3.24Å; L36-V44 PolarHBondContact N-O 3.01Å; L36-V44 PolarHBondContact O-N 2.8Å; L36-H46 HydrophobicContact CD1-CB 4.03Å; L36-H46 HydrophobicContact CG-CB 4.15Å; L36-V49 HydrophobicContact CD1-CB 4.49Å; L36-V49 HydrophobicContact CD1-CG2 4.4Å; L36-I127 HydrophobicContact CD1-CG2 3.21Å; L36-L130 HydrophobicContact CB-CB 4.28Å; L36-L130 HydrophobicContact CB-CD1 4.3Å; L36-L130 HydrophobicContact CD1-CD1 4.15Å; L36-F131 CarbonylContact C-O 3.54Å; L36-F131 WeakPolarHBondContact CA-O 3.5Å; L36-R132 HydrophobicContact CD2-CG 3.8Å
37	I	89.5	Confident	87.8	Confident	55 Å²	55	57.8 Å²	57.8	28%	0.282	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	118.3	176.6	-52.5	179.9	0	0	0	108.6	F131 N133	I37-F131 HydrophobicContact CB-CB 4.45Å; I37-F131 HydrophobicContact CD1-CB 4.47Å; I37-F131 PolarHBondContact N-O 3.07Å; I37-N133 HydrophobicContact CD1-CB 3.93Å; I37-N133 HydrophobicContact CG1-CB 3.58Å
38	L	87.8	Confident	87.9	Confident	4 Å²	4	55.4 Å²	55.4	2%	0.021	28%	0.279	C	S	.	.			trans	-76.6	157.7	172.8	-60.7	176.1	0	0	0	110.8	C40 Q41 H42 V44 I111 C113 I120 L130	L38-C40 PolarHBondContact O-N 2.99Å; L38-C40 VanDerWaalsContact O-N 3.15Å; L38-Q41 WeakPolarHBondContact O-CA 3.4Å; L38-Q41 PolarHBondContact O-N 3.29Å; L38-H42 WeakPolarHBondContact CB-O 3.36Å; L38-H42 PolarHBondContact N-O 2.93Å; L38-V44 HydrophobicContact CD1-CG2 3.76Å; L38-V44 HydrophobicContact CG-CG2 4.49Å; L38-I111 HydrophobicContact CD2-CD1 4.35Å; L38-C113 HydrophobicContact CD1-CB 4.37Å; L38-I120 HydrophobicContact CB-CD1 3.69Å; L38-I120 HydrophobicContact CD1-CD1 3.61Å; L38-I120 HydrophobicContact CD2-CD1 4.09Å; L38-I120 HydrophobicContact CG-CD1 3.98Å; L38-L130 HydrophobicContact CD2-CD1 3.85Å; L38-L130 HydrophobicContact CD2-CD2 4.46Å
39	P	82.8	Confident	87.7	Confident	89 Å²	89	53 Å²	53	58%	0.578	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-28.8	176.2	-28.3	39.2	0	0	0	114.2	Q41 I120	P39-Q41 PolarHBondContact O-N 2.91Å; P39-I120 HydrophobicContact CG-CG2 3.69Å
40	C	85.5	Confident	87.4	Confident	32 Å²	32	52 Å²	52	22%	0.216	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	11.7	171.7	68.2	0	0	0	0	114.1	L38 H42 C113	L38-C40 PolarHBondContact O-N 2.99Å; L38-C40 VanDerWaalsContact O-N 3.15Å; C40-H42 PolarHBondContact O-N 3.3Å; C40-H42 VanDerWaalsContact O-N 3.12Å; C40-H42 PolarHBondContact O-ND1 3.28Å; C40-C113 PolarHBondContact SG-SG 3.27Å
41	Q	86.1	Confident	87.2	Confident	151 Å²	151	49.8 Å²	49.8	71%	0.706	25%	0.249	S	C	*	.	S	Bend	trans	66.8	2.2	179.2	-55.3	176.1	27.1	0	0	116.6	L38 P39	L38-Q41 WeakPolarHBondContact O-CA 3.4Å; L38-Q41 PolarHBondContact O-N 3.29Å; P39-Q41 PolarHBondContact O-N 2.91Å
42	H	89.1	Confident	86.8	Confident	77 Å²	77	50.4 Å²	50.4	36%	0.356	25%	0.252	S	S	.	.			trans	-77.4	150.6	172.2	-70.4	89.3	0	0	0	111	L38 C40	L38-H42 WeakPolarHBondContact CB-O 3.36Å; L38-H42 PolarHBondContact N-O 2.93Å; C40-H42 PolarHBondContact O-N 3.3Å; C40-H42 VanDerWaalsContact O-N 3.12Å; C40-H42 PolarHBondContact O-ND1 3.28Å
43	S	90.7	Very high	86.3	Confident	19 Å²	19	51.8 Å²	51.8	13%	0.133	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	140	177.5	-64.9	0	0	0	0	111.6	F32 L36 N133	F32-S43 WeakPolarHBondContact CE1-O 3.22Å; F32-S43 WeakPolarHBondContact CZ-O 3.49Å; L36-S43 VanDerWaalsContact O-CA 3.25Å; L36-S43 WeakPolarHBondContact O-CA 3.24Å; S43-N133 PolarHBondContact OG-ND2 3.08Å
44	V	90.8	Very high	85.6	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.012	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	143.5	176.4	-178.9	0	0	0	0	109.4	P26 I27 P35 L36 L38 C48 V49	P26-V44 HydrophobicContact CG-CG2 4.49Å; I27-V44 HydrophobicContact CD1-CG1 3.37Å; I27-V44 HydrophobicContact CG1-CG1 4.18Å; P35-V44 WeakPolarHBondContact CA-O 3.13Å; L36-V44 PolarHBondContact N-O 3.01Å; L36-V44 PolarHBondContact O-N 2.8Å; L38-V44 HydrophobicContact CD1-CG2 3.76Å; L38-V44 HydrophobicContact CG-CG2 4.49Å; V44-C48 HydrophobicContact CG1-CB 3.89Å; V44-V49 HydrophobicContact CB-CG2 3.66Å; V44-V49 HydrophobicContact CG1-CG2 3.51Å
45	C	90.9	Very high	84.7	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	139.8	175.8	-62.2	0	0	0	0	111.4	C25 T33 K47 C48 V49	C25-C45 VanDerWaalsContact CB-SG 3.59Å; C25-C45 VanDerWaalsContact SG-SG 3.63Å; T33-C45 PolarHBondContact N-SG 3.38Å; T33-C45 WeakPolarHBondContact O-CB 3.46Å; C45-K47 PolarHBondContact O-N 3.47Å; C45-C48 HydrophobicContact CB-CB 4.22Å; C45-C48 PolarHBondContact O-N 3.22Å; C45-V49 PolarHBondContact O-N 3.29Å
46	H	87.8	Confident	83.2	Confident	70 Å²	70	58.2 Å²	58.2	32%	0.324	29%	0.291	S	S	.	.	H	α-helix	trans	-52.5	-40.5	177.3	179.5	-71.4	0	0	0	113	H34 L36 K50	H34-H46 HydrophobicContact CB-CB 4.13Å; H34-H46 WeakPolarHBondContact O-CB 3.37Å; H34-H46 PolarHBondContact O-N 3.24Å; L36-H46 HydrophobicContact CD1-CB 4.03Å; L36-H46 HydrophobicContact CG-CB 4.15Å; H46-K50 WeakPolarHBondContact O-CB 3.35Å; H46-K50 PolarHBondContact O-N 2.93Å; H46-K50 VanDerWaalsContact O-N 3.11Å
47	K	86.6	Confident	81.6	Confident	140 Å²	140	65.9 Å²	65.9	61%	0.609	32%	0.321	S	S	*	.	H	α-helix	trans	-61.9	-45.3	176.6	-177.5	177.2	169.7	-177.6	0	111.4	C45 K50 E51	C45-K47 PolarHBondContact O-N 3.47Å; K47-K50 WeakPolarHBondContact O-CB 3.4Å; K47-K50 PolarHBondContact O-N 3.27Å; K47-E51 WeakPolarHBondContact CE-OE1 3.39Å; K47-E51 IonicContact NZ-OE1 3.77Å; K47-E51 WeakPolarHBondContact O-CG 3.45Å; K47-E51 PolarHBondContact O-N 2.99Å
48	C	88.9	Confident	79.5	Confident	4 Å²	4	70.9 Å²	70.9	3%	0.027	34%	0.343	C	S	.	.	H	α-helix	trans	-69.9	-36.2	-177.7	-55.5	0	0	0	0	112.6	I27 V44 C45 K50 E51 L52	I27-C48 HydrophobicContact CB-CB 3.88Å; I27-C48 HydrophobicContact CD1-CB 3.66Å; I27-C48 HydrophobicContact CG1-CB 4.34Å; I27-C48 HydrophobicContact CG2-CB 3.89Å; V44-C48 HydrophobicContact CG1-CB 3.89Å; C45-C48 HydrophobicContact CB-CB 4.22Å; C45-C48 PolarHBondContact O-N 3.22Å; C48-K50 VanDerWaalsContact C-N 3.32Å; C48-E51 PolarHBondContact O-N 2.63Å; C48-L52 WeakPolarHBondContact O-CG 3.14Å; C48-L52 PolarHBondContact O-N 2.73Å
49	V	85.2	Confident	77.5	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-63.5	-40.7	171.7	178.2	0	0	0	0	110.9	L36 V44 C45 L52 L53 I111 I127 L130	L36-V49 HydrophobicContact CD1-CB 4.49Å; L36-V49 HydrophobicContact CD1-CG2 4.4Å; V44-V49 HydrophobicContact CB-CG2 3.66Å; V44-V49 HydrophobicContact CG1-CG2 3.51Å; C45-V49 PolarHBondContact O-N 3.29Å; V49-L52 PolarHBondContact O-N 2.69Å; V49-L53 HydrophobicContact CG1-CD1 4.34Å; V49-L53 PolarHBondContact O-N 3.38Å; V49-L53 VanDerWaalsContact O-N 3.14Å; V49-I111 HydrophobicContact CG1-CD1 3.86Å; V49-I127 HydrophobicContact CG1-CD1 4.15Å; V49-I127 HydrophobicContact CG1-CG1 4.03Å; V49-I127 HydrophobicContact CG1-CG2 4.19Å; V49-L130 HydrophobicContact CG1-CD1 4.41Å
50	K	83.4	Confident	75.6	Confident	123 Å²	123	76.6 Å²	76.6	54%	0.535	37%	0.374	S	S	.	.	H	α-helix	trans	-64.1	-41	176.7	-171.3	-179.9	178.1	-176.4	0	111.7	H46 K47 C48 L53 M54 I127	H46-K50 WeakPolarHBondContact O-CB 3.35Å; H46-K50 PolarHBondContact O-N 2.93Å; H46-K50 VanDerWaalsContact O-N 3.11Å; K47-K50 WeakPolarHBondContact O-CB 3.4Å; K47-K50 PolarHBondContact O-N 3.27Å; C48-K50 VanDerWaalsContact C-N 3.32Å; K50-L53 PolarHBondContact O-N 2.84Å; K50-M54 VanDerWaalsContact O-CG 3.31Å; K50-M54 WeakPolarHBondContact O-CG 3.16Å; K50-M54 PolarHBondContact O-N 2.92Å; K50-I127 HydrophobicContact CB-CD1 3.85Å; K50-I127 HydrophobicContact CG-CD1 4.26Å
51	E	83.1	Confident	73.5	Confident	86 Å²	86	83.2 Å²	83.2	40%	0.402	40%	0.399	S	S	.	.	H	α-helix	trans	-64.9	-42.5	176.2	-74.3	168.3	174.3	0	0	112.1	K47 C48 L53 M54 L55	K47-E51 WeakPolarHBondContact CE-OE1 3.39Å; K47-E51 IonicContact NZ-OE1 3.77Å; K47-E51 WeakPolarHBondContact O-CG 3.45Å; K47-E51 PolarHBondContact O-N 2.99Å; C48-E51 PolarHBondContact O-N 2.63Å; E51-L53 VanDerWaalsContact C-N 3.3Å; E51-L53 PolarHBondContact O-N 2.93Å; E51-M54 PolarHBondContact O-N 2.93Å; E51-M54 VanDerWaalsContact O-N 3.14Å; E51-L55 WeakPolarHBondContact O-CG 3.17Å; E51-L55 PolarHBondContact O-N 3.04Å
52	L	79.9	Confident	70.9	Confident	38 Å²	38	83.6 Å²	83.6	20%	0.199	41%	0.406	C	S	.	.	H	α-helix	trans	-59	-39.9	174.7	-75.2	179.1	0	0	0	112.9	I27 C48 V49 M54 L55 N56 P114	I27-L52 HydrophobicContact CD1-CD1 3.33Å; I27-L52 HydrophobicContact CD1-CD2 4.46Å; I27-L52 HydrophobicContact CD1-CG 3.86Å; C48-L52 WeakPolarHBondContact O-CG 3.14Å; C48-L52 PolarHBondContact O-N 2.73Å; V49-L52 PolarHBondContact O-N 2.69Å; L52-M54 VanDerWaalsContact C-N 3.33Å; L52-M54 PolarHBondContact O-N 3.11Å; L52-L55 PolarHBondContact O-N 2.92Å; L52-N56 PolarHBondContact O-N 2.92Å; L52-P114 HydrophobicContact CD1-CG 4.21Å
53	L	76.3	Confident	68.3	Low	41 Å²	41	85.2 Å²	85.2	22%	0.215	43%	0.433	C	S	.	.	H	α-helix	trans	-69.5	-29.6	177.1	-75.9	166.2	0	0	0	113.4	V49 K50 E51 I111 L122 I127	V49-L53 HydrophobicContact CG1-CD1 4.34Å; V49-L53 PolarHBondContact O-N 3.38Å; V49-L53 VanDerWaalsContact O-N 3.14Å; K50-L53 PolarHBondContact O-N 2.84Å; E51-L53 VanDerWaalsContact C-N 3.3Å; E51-L53 PolarHBondContact O-N 2.93Å; L53-I111 HydrophobicContact CD2-CG2 3.46Å; L53-I111 VanDerWaalsContact CD2-CG2 3.46Å; L53-I111 HydrophobicContact CG-CG2 3.87Å; L53-L122 HydrophobicContact CD1-CD1 3.76Å; L53-L122 HydrophobicContact CD2-CD1 3.9Å; L53-L122 HydrophobicContact CG-CD1 4.24Å; L53-I127 HydrophobicContact CD1-CD1 3.57Å; L53-I127 HydrophobicContact CD1-CG1 3.27Å
54	M	70.1	Confident	65.5	Low	123 Å²	123	87.2 Å²	87.2	61%	0.606	46%	0.457	S	S	*	.	H	α-helix	trans	-75	-36.5	175.8	-67.9	-66	-57	0	0	111.5	K50 E51 L52 Y57	K50-M54 VanDerWaalsContact O-CG 3.31Å; K50-M54 WeakPolarHBondContact O-CG 3.16Å; K50-M54 PolarHBondContact O-N 2.92Å; E51-M54 PolarHBondContact O-N 2.93Å; E51-M54 VanDerWaalsContact O-N 3.14Å; L52-M54 VanDerWaalsContact C-N 3.33Å; L52-M54 PolarHBondContact O-N 3.11Å; M54-Y57 WeakPolarHBondContact O-CB 3.39Å; M54-Y57 PolarHBondContact O-N 3.16Å
55	L	64.6	Low	62.6	Low	114 Å²	114	93.2 Å²	93.2	60%	0.597	50%	0.499	S	S	*	.	H	α-helix	trans	-65.6	-41.1	176.5	-70.9	168.1	0	0	0	111.9	E51 L52 Y57 E58	E51-L55 WeakPolarHBondContact O-CG 3.17Å; E51-L55 PolarHBondContact O-N 3.04Å; L52-L55 PolarHBondContact O-N 2.92Å; L55-Y57 PolarHBondContact O-N 3.06Å; L55-E58 PolarHBondContact O-N 2.93Å
56	N	59.4	Low	59.8	Low	52 Å²	52	101.9 Å²	101.9	28%	0.278	54%	0.539	S	S	.	.	H	α-helix	trans	-68.3	-13.9	176.4	-72.8	1.7	0	0	0	113.8	L52 A110	L52-N56 PolarHBondContact O-N 2.92Å; N56-A110 PolarHBondContact ND2-O 3.05Å
57	Y	55	Low	57.1	Low	163 Å²	163	103.4 Å²	103.4	64%	0.639	56%	0.558	S	S	*	*	H	α-helix	trans	-82.3	-27	178.6	-161.5	-101.3	0	0	0	112.5	M54 L55	M54-Y57 WeakPolarHBondContact O-CB 3.39Å; M54-Y57 PolarHBondContact O-N 3.16Å; L55-Y57 PolarHBondContact O-N 3.06Å
58	E	46.1	Very low	54.4	Low	161 Å²	161	102.7 Å²	102.7	75%	0.752	57%	0.571	S	S	*	*	H	α-helix	trans	-78.9	-26.4	178.5	-69.7	-84.9	127.1	0	0	112.3	L55 S60	L55-E58 PolarHBondContact O-N 2.93Å; E58-S60 VanDerWaalsContact C-N 3.28Å; E58-S60 PolarHBondContact O-N 2.8Å
59	D	45.1	Very low	51.8	Low	144 Å²	144	109.2 Å²	109.2	77%	0.77	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-4.4	178.5	-92.2	-13.1	0	0	0	114.4
60	S	43.6	Very low	50	Low	69 Å²	69	115.2 Å²	115.2	48%	0.483	65%	0.649	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89	4.1	-178.1	-65.3	0	0	0	0	114.7	E58	E58-S60 VanDerWaalsContact C-N 3.28Å; E58-S60 PolarHBondContact O-N 2.8Å
61	F	40.5	Very low	47.2	Very low	170 Å²	170	113.1 Å²	113.1	75%	0.746	66%	0.663	S	S	*	*	S	Bend	trans	-129.9	65.6	175.5	-69.5	-76.9	0	0	0	112.2
62	D	32.6	Very low	44.8	Very low	159 Å²	159	114.7 Å²	114.7	85%	0.85	68%	0.683	S	S	*	*				-176.6	105.6	129.9	-120.6	-19.2	0	0	0	110.3
63	A	34	Very low	43.2	Very low	111 Å²	111	118 Å²	118	92%	0.917	71%	0.707	S	S	*	*			trans	-125.8	94	164.7	0	0	0	0	0	107.5
64	G	30.9	Very low	41.1	Very low	61 Å²	61	127.6 Å²	127.6	63%	0.629	74%	0.74	S	S	*	*			trans	177.5	93.7	170.3	0	0	0	0	0	112.6
65	S	30.6	Very low	39.1	Very low	128 Å²	128	126.4 Å²	126.4	90%	0.895	74%	0.744	S	S	*	*			trans	149.1	153	130.1	55	0	0	0	0	114.3
66	E	32.6	Very low	37.5	Very low	182 Å²	182	132.5 Å²	132.5	85%	0.85	76%	0.759	S	S	*	*			trans	-81.6	158.6	-148.4	-61.8	172.8	109.5	0	0	117.5
67	S	30.5	Very low	35.9	Very low	102 Å²	102	136.2 Å²	136.2	71%	0.713	78%	0.783	S	S	*	*			trans	24.8	117.2	148	66	0	0	0	0	120.4
68	S	31.1	Very low	35.1	Very low	126 Å²	126	134 Å²	134	88%	0.881	79%	0.788	S	S	*	*				169.9	142.3	106.9	37.4	0	0	0	0	112.4
69	V	33.5	Very low	34	Very low	141 Å²	141	131.4 Å²	131.4	86%	0.855	79%	0.788	S	S	*	*			trans	-97.3	172.2	170.6	-123.2	0	0	0	0	108.5
70	P	46.2	Very low	33.9	Very low	125 Å²	125	130.1 Å²	130.1	81%	0.812	79%	0.788	S	S	*	*			cis	-137.9	168.6	-7.3	34.6	-14	0	0	0	116
71	G	26.1	Very low	33.1	Very low	80 Å²	80	131.9 Å²	131.9	83%	0.825	80%	0.8	S	S	*	*			trans	176	127.2	164	0	0	0	0	0	114.4
72	S	31.3	Very low	32.5	Very low	118 Å²	118	131.3 Å²	131.3	83%	0.825	80%	0.802	S	S	*	*			trans	-88.4	-170.7	-169.8	-150.3	0	0	0	0	113.2
73	P	47.6	Very low	32.3	Very low	109 Å²	109	131.4 Å²	131.4	71%	0.708	80%	0.797	S	S	*	*				-117.3	160.4	-103.7	37.1	-20.6	0	0	0	115
74	R	31.1	Very low	32.2	Very low	242 Å²	242	137.8 Å²	137.8	91%	0.913	80%	0.797	S	S	*	*			trans	-175.9	120	146.1	-108.5	167.3	-173.8	-172.8	2.8	116.1
75	S	27.9	Very low	32	Very low	97 Å²	97	141.9 Å²	141.9	68%	0.678	80%	0.804	S	S	*	*				47.3	125.3	130	71.9	0	0	0	0	123.4
76	R	30.8	Very low	31.9	Very low	243 Å²	243	140.9 Å²	140.9	92%	0.917	79%	0.789	S	S	*	*			trans	126.5	115	131.9	-79.1	-171.5	-170.8	-170.9	2.9	116.7
77	V	26.4	Very low	31.8	Very low	130 Å²	130	141.6 Å²	141.6	79%	0.788	78%	0.784	S	S	*	*			trans	-54.3	162.2	151.1	-172.2	0	0	0	0	109.8
78	P	38.3	Very low	31.7	Very low	115 Å²	115	143.7 Å²	143.7	75%	0.747	79%	0.786	S	S	*	*			cis	-136.1	171.2	20.3	14.1	14.7	0	0	0	118.6
79	S	24.1	Very low	31.5	Very low	107 Å²	107	142.7 Å²	142.7	75%	0.748	77%	0.774	S	S	*	*			trans	-52	-170.4	155	-32.5	0	0	0	0	113.9
80	P	41.6	Very low	31.3	Very low	117 Å²	117	147 Å²	147	76%	0.76	78%	0.775	S	S	*	*			cis	-141.5	-179.6	-4	34.4	-11.4	0	0	0	116.2
81	S	27.8	Very low	30.5	Very low	106 Å²	106	146.6 Å²	146.6	74%	0.741	78%	0.775	S	S	*	*				121.7	134.1	128.6	90.6	0	0	0	0	120.4
82	M	27.1	Very low	30.5	Very low	159 Å²	159	145.9 Å²	145.9	78%	0.783	77%	0.768	S	S	*	*			trans	63	108.4	145.1	-69.4	-129.1	-172.7	0	0	120.3
83	E	29.3	Very low	30.4	Very low	161 Å²	161	145.8 Å²	145.8	75%	0.752	77%	0.767	S	S	*	*				77.2	110.8	85.5	-104.4	178.2	158.3	0	0	114.6
84	R	31.2	Very low	29.5	Very low	244 Å²	244	148 Å²	148	92%	0.921	77%	0.772	S	S	*	*				-179.4	127.2	122.5	-100.9	171.5	174.3	125.9	-1	114.4
85	L	27.8	Very low	29.3	Very low	148 Å²	148	142 Å²	142	78%	0.775	77%	0.767	S	S	*	*			trans	-25.3	154.3	142	-107.2	64.6	0	0	0	114.1
86	D	27.4	Very low	29.2	Very low	106 Å²	106	143 Å²	143	57%	0.567	77%	0.774	S	S	*	*			cis	-174.1	149.4	42.2	-135.3	-14.5	0	0	0	110.9
87	R	31.1	Very low	29.5	Very low	198 Å²	198	137.8 Å²	137.8	75%	0.747	77%	0.771	S	S	*	*			trans	64	137.3	132.9	-88	169.2	-167.7	-162.4	-1	126.2
88	L	28.3	Very low	29.6	Very low	145 Å²	145	134.5 Å²	134.5	76%	0.759	76%	0.763	S	S	*	*			trans	78.4	144.9	139.3	-69.5	155.8	0	0	0	118
89	V	27	Very low	29.2	Very low	106 Å²	106	140.8 Å²	140.8	64%	0.642	77%	0.772	S	S	*	*			cis	-177.8	144.1	-19.6	117.8	0	0	0	0	106.1
90	R	28.3	Very low	29.5	Very low	232 Å²	232	146.9 Å²	146.9	88%	0.875	78%	0.779	S	S	*	*			trans	54.1	149.9	157.5	-74.1	175.7	174.7	-177.6	-3.4	118.6
91	S	29.4	Very low	28.9	Very low	116 Å²	116	151.9 Å²	151.9	81%	0.811	78%	0.782	S	S	*	*			cis	-177.6	150.2	-5.8	-97.8	0	0	0	0	106
92	G	26.7	Very low	29.2	Very low	64 Å²	64	150.6 Å²	150.6	66%	0.66	79%	0.786	S	S	*	*			trans	147.3	95.1	161.3	0	0	0	0	0	112.2
93	S	30	Very low	29.3	Very low	117 Å²	117	148.3 Å²	148.3	82%	0.818	79%	0.786	S	S	*	*				75.8	122.7	95.9	-64.3	0	0	0	0	111.4
94	I	27.1	Very low	29.6	Very low	156 Å²	156	147.1 Å²	147.1	80%	0.8	79%	0.789	S	S	*	*			cis	-168.1	141.5	26	-87.3	142.2	0	0	0	107.1
95	S	28.8	Very low	29.8	Very low	116 Å²	116	141 Å²	141	81%	0.811	78%	0.779	S	S	*	*				162.1	133.8	126.7	49.6	0	0	0	0	111.3
96	S	25.6	Very low	30.4	Very low	118 Å²	118	139.7 Å²	139.7	83%	0.825	78%	0.78	S	S	*	*			trans	-129.1	153.3	178.3	-87.6	0	0	0	0	105.6
97	P	37.4	Very low	31.5	Very low	133 Å²	133	144.7 Å²	144.7	86%	0.864	79%	0.791	S	S	*	*				-149.1	149.5	62	35.6	-14.5	0	0	0	117.2
98	G	28.6	Very low	32.7	Very low	60 Å²	60	139.6 Å²	139.6	62%	0.619	78%	0.781	S	S	*	*			trans	144.6	70.2	150.1	0	0	0	0	0	116.7
99	W	28.6	Very low	34.4	Very low	247 Å²	247	134.2 Å²	134.2	94%	0.936	75%	0.754	S	S	*	*			trans	-145.9	116.8	164.4	-76	87.4	0	0	0	112.7
100	R	29.8	Very low	36.6	Very low	236 Å²	236	131 Å²	131	89%	0.891	74%	0.739	S	S	*	*			trans	-145.4	95.4	153.9	-89.3	-87.9	-103.2	-96.6	-3.5	108.5
101	R	29.1	Very low	39.2	Very low	221 Å²	221	120 Å²	120	83%	0.834	70%	0.697	S	S	*	*	S	Bend		169.5	139.7	106.5	-161.4	172.5	-69.1	-104.5	6.6	108.3
102	G	35.8	Very low	41.7	Very low	79 Å²	79	117.3 Å²	117.3	81%	0.814	68%	0.677	S	S	*	*			trans	-68.5	146	-154.5	0	0	0	0	0	116.4
103	S	27.6	Very low	44.5	Very low	112 Å²	112	114.3 Å²	114.3	78%	0.783	65%	0.646	S	S	*	*			trans	-113.4	107.3	160.3	-177.6	0	0	0	0	107.2	T105	S103-T105 PolarHBondContact O-N 3.06Å
104	V	35.7	Very low	47	Very low	136 Å²	136	111.4 Å²	111.4	82%	0.824	62%	0.624	S	S	*	*			trans	-78.4	110.6	166.7	177.6	0	0	0	0	105.3
105	T	35	Very low	49.6	Very low	114 Å²	114	106.1 Å²	106.1	70%	0.699	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-58.6	125.5	169.2	49	0	0	0	0	108.8	S103 R107	S103-T105 PolarHBondContact O-N 3.06Å; T105-R107 PolarHBondContact O-N 2.82Å
106	P	41.2	Very low	52.4	Low	122 Å²	122	103.3 Å²	103.3	79%	0.792	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-70.2	124	178.4	25	-24.4	0	0	0	108.7	V108	P106-V108 PolarHBondContact O-N 3.27Å
107	R	51.3	Low	55.2	Low	211 Å²	211	105.9 Å²	105.9	80%	0.796	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-61.8	128.2	166.8	-69.3	179.3	171.2	176.9	-3.4	107	T105 T109	T105-R107 PolarHBondContact O-N 2.82Å; R107-T109 HydrophobicContact CB-CG2 4.3Å; R107-T109 PolarHBondContact O-N 2.83Å
108	V	54.7	Low	57.5	Low	91 Å²	91	105.7 Å²	105.7	55%	0.552	57%	0.574	S	S	*	*			trans	-61.8	105.8	170.9	179.7	0	0	0	0	107.5	P106	P106-V108 PolarHBondContact O-N 3.27Å
109	T	64.7	Low	60	Low	31 Å²	31	108.1 Å²	108.1	19%	0.19	57%	0.573	C	S	.	*			trans	-105.8	4.7	-179.8	46.3	0	0	0	0	112.2	R107 D121 L122 G123	R107-T109 HydrophobicContact CB-CG2 4.3Å; R107-T109 PolarHBondContact O-N 2.83Å; T109-D121 WeakPolarHBondContact CB-OD1 3.42Å; T109-D121 PolarHBondContact OG1-OD1 2.93Å; T109-L122 VanDerWaalsContact O-CB 3.3Å; T109-L122 WeakPolarHBondContact O-CB 3.36Å; T109-L122 WeakPolarHBondContact O-CG 3.4Å; T109-L122 PolarHBondContact O-N 2.81Å; T109-G123 WeakPolarHBondContact CG2-O 3.42Å
110	A	74.2	Confident	62.5	Low	38 Å²	38	96.6 Å²	96.6	31%	0.314	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	132.9	-179.5	0	0	0	0	0	112.4	N56 I120	N56-A110 PolarHBondContact ND2-O 3.05Å; A110-I120 CarbonylContact C-O 3.6Å; A110-I120 WeakPolarHBondContact CA-O 3.48Å
111	I	81	Confident	64.9	Low	2 Å²	2	90.7 Å²	90.7	1%	0.01	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	135.6	170.3	56.8	170.9	0	0	0	111.1	L38 V49 L53 C113 I120 L122	L38-I111 HydrophobicContact CD2-CD1 4.35Å; V49-I111 HydrophobicContact CG1-CD1 3.86Å; L53-I111 HydrophobicContact CD2-CG2 3.46Å; L53-I111 VanDerWaalsContact CD2-CG2 3.46Å; L53-I111 HydrophobicContact CG-CG2 3.87Å; I111-C113 PolarHBondContact O-N 2.87Å; I111-I120 HydrophobicContact CG1-CB 4.27Å; I111-I120 PolarHBondContact N-O 3.4Å; I111-I120 WeakPolarHBondContact O-CB 3.27Å; I111-I120 PolarHBondContact O-N 3.22Å; I111-L122 HydrophobicContact CD1-CD1 4Å; I111-L122 HydrophobicContact CG1-CD1 4.16Å; I111-L122 HydrophobicContact CG1-CG 4.38Å
112	P	83.5	Confident	66.9	Low	60 Å²	60	80.6 Å²	80.6	39%	0.39	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	131.2	172.9	28.2	-32.9	0	0	0	109.9	P114	P112-P114 VanDerWaalsContact O-CD 3.32Å; P112-P114 WeakPolarHBondContact O-CD 3.27Å
113	C	84.9	Confident	68.5	Low	1 Å²	1	78 Å²	78	1%	0.007	45%	0.451	C	S	.	.			trans	-66.3	122.8	174	-180	0	0	0	0	110.6	L38 C40 I111 G115 C116 Q117 H118 I120	L38-C113 HydrophobicContact CD1-CB 4.37Å; C40-C113 PolarHBondContact SG-SG 3.27Å; I111-C113 PolarHBondContact O-N 2.87Å; C113-G115 PolarHBondContact O-N 2.92Å; C113-G115 VanDerWaalsContact O-N 3.11Å; C113-G115 PolarHBondContact SG-N 2.97Å; C113-G115 VanDerWaalsContact SG-N 3.37Å; C113-C116 PolarHBondContact O-N 3.42Å; C113-C116 VanDerWaalsContact SG-SG 3.66Å; C113-Q117 WeakPolarHBondContact O-CA 3.23Å; C113-Q117 PolarHBondContact O-N 3.07Å; C113-H118 PolarHBondContact N-O 3.49Å; C113-I120 HydrophobicContact CB-CD1 3.68Å
114	P	83.3	Confident	70.2	Confident	55 Å²	55	81.7 Å²	81.7	36%	0.357	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-17.4	177.3	-19.5	30.1	0	0	0	114.6	P26 I27 L52 P112	P26-P114 HydrophobicContact CB-CB 4.2Å; P26-P114 HydrophobicContact CG-CB 4.15Å; I27-P114 HydrophobicContact CD1-CG 3.73Å; I27-P114 HydrophobicContact CG1-CB 4.17Å; I27-P114 HydrophobicContact CG1-CG 3.63Å; L52-P114 HydrophobicContact CD1-CG 4.21Å; P112-P114 VanDerWaalsContact O-CD 3.32Å; P112-P114 WeakPolarHBondContact O-CD 3.27Å
115	G	80.8	Confident	71.5	Confident	45 Å²	45	81.2 Å²	81.2	46%	0.464	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-38	-179.3	0	0	0	0	0	113.9	C113	C113-G115 PolarHBondContact O-N 2.92Å; C113-G115 VanDerWaalsContact O-N 3.11Å; C113-G115 PolarHBondContact SG-N 2.97Å; C113-G115 VanDerWaalsContact SG-N 3.37Å
116	C	87.7	Confident	73.4	Confident	58 Å²	58	76.7 Å²	76.7	39%	0.392	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.7	4.6	-174.5	69	0	0	0	0	114.7	C113 H118	C113-C116 PolarHBondContact O-N 3.42Å; C113-C116 VanDerWaalsContact SG-SG 3.66Å; C116-H118 PolarHBondContact O-N 3.26Å
117	Q	84.6	Confident	75.1	Confident	172 Å²	172	72.3 Å²	72.3	80%	0.804	39%	0.386	S	S	*	.			trans	58	16.1	179.1	-57.1	179.1	4.1	0	0	115.3	C113	C113-Q117 WeakPolarHBondContact O-CA 3.23Å; C113-Q117 PolarHBondContact O-N 3.07Å
118	H	84.4	Confident	76.4	Confident	128 Å²	128	66.3 Å²	66.3	59%	0.593	38%	0.376	S	S	*	.			trans	-84.9	135	177.6	-165.9	71.9	0	0	0	111	C113 C116 I120	C113-H118 PolarHBondContact N-O 3.49Å; C116-H118 PolarHBondContact O-N 3.26Å; H118-I120 PolarHBondContact O-N 2.82Å
119	D	82.5	Confident	77.4	Confident	112 Å²	112	65 Å²	65	60%	0.599	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	125.3	176.7	-69.4	-33.5	0	0	0	111.3
120	I	81.4	Confident	78.3	Confident	5 Å²	5	64.3 Å²	64.3	3%	0.026	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	113.6	-177	-66.2	155.5	0	0	0	109.1	L38 P39 A110 I111 C113 H118 L122	L38-I120 HydrophobicContact CB-CD1 3.69Å; L38-I120 HydrophobicContact CD1-CD1 3.61Å; L38-I120 HydrophobicContact CD2-CD1 4.09Å; L38-I120 HydrophobicContact CG-CD1 3.98Å; P39-I120 HydrophobicContact CG-CG2 3.69Å; A110-I120 CarbonylContact C-O 3.6Å; A110-I120 WeakPolarHBondContact CA-O 3.48Å; I111-I120 HydrophobicContact CG1-CB 4.27Å; I111-I120 PolarHBondContact N-O 3.4Å; I111-I120 WeakPolarHBondContact O-CB 3.27Å; I111-I120 PolarHBondContact O-N 3.22Å; C113-I120 HydrophobicContact CB-CD1 3.68Å; H118-I120 PolarHBondContact O-N 2.82Å; I120-L122 HydrophobicContact CG2-CD2 3.8Å
121	D	78.8	Confident	78.7	Confident	111 Å²	111	63.9 Å²	63.9	59%	0.594	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	121	169.5	-173.4	11.9	0	0	0	111.4	T109 G123	T109-D121 WeakPolarHBondContact CB-OD1 3.42Å; T109-D121 PolarHBondContact OG1-OD1 2.93Å; D121-G123 PolarHBondContact OD1-N 3.27Å
122	L	71.8	Confident	78.9	Confident	9 Å²	9	69.1 Å²	69.1	5%	0.047	37%	0.37	C	S	.	.			trans	-91.4	-7.4	178.3	-57.8	178.4	0	0	0	113.3	L53 T109 I111 I120 G126 L130	L53-L122 HydrophobicContact CD1-CD1 3.76Å; L53-L122 HydrophobicContact CD2-CD1 3.9Å; L53-L122 HydrophobicContact CG-CD1 4.24Å; T109-L122 VanDerWaalsContact O-CB 3.3Å; T109-L122 WeakPolarHBondContact O-CB 3.36Å; T109-L122 WeakPolarHBondContact O-CG 3.4Å; T109-L122 PolarHBondContact O-N 2.81Å; I111-L122 HydrophobicContact CD1-CD1 4Å; I111-L122 HydrophobicContact CG1-CD1 4.16Å; I111-L122 HydrophobicContact CG1-CG 4.38Å; I120-L122 HydrophobicContact CG2-CD2 3.8Å; L122-G126 PolarHBondContact O-N 2.84Å; L122-L130 HydrophobicContact CD2-CD1 3.9Å; L122-L130 HydrophobicContact CD2-CD2 3.8Å; L122-L130 HydrophobicContact CD2-CG 4.03Å
123	G	69.2	Low	79.1	Confident	24 Å²	24	67.6 Å²	67.6	25%	0.247	36%	0.359	C	S	.	.			trans	58.7	-170.9	-179.6	0	0	0	0	0	115	T109 D121 R125 G126	T109-G123 WeakPolarHBondContact CG2-O 3.42Å; D121-G123 PolarHBondContact OD1-N 3.27Å; G123-R125 PolarHBondContact O-N 3.48Å; G123-R125 VanDerWaalsContact O-N 3.08Å; G123-G126 PolarHBondContact O-N 3.23Å
124	E	63.2	Low	79.1	Confident	191 Å²	191	69.3 Å²	69.3	89%	0.893	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-23	-169.5	-61.5	-177.2	169.6	0	0	115.2
125	R	62.9	Low	79.2	Confident	126 Å²	126	71.4 Å²	71.4	48%	0.475	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	3	179.3	-64.1	-161.1	-70.2	-117.1	5.8	113.7	G123 S128 M129	G123-R125 PolarHBondContact O-N 3.48Å; G123-R125 VanDerWaalsContact O-N 3.08Å; R125-S128 WeakPolarHBondContact O-CB 3.39Å; R125-S128 PolarHBondContact O-N 3.49Å; R125-M129 HydrophobicContact CB-CE 4.01Å; R125-M129 HydrophobicContact CB-CG 3.76Å; R125-M129 HydrophobicContact CB-SD 4.18Å; R125-M129 HydrophobicContact CG-CE 4.17Å; R125-M129 PolarHBondContact NE-SD 2.87Å; R125-M129 VanDerWaalsContact NE-SD 3.37Å; R125-M129 PolarHBondContact NH2-SD 3.18Å; R125-M129 VanDerWaalsContact NH2-SD 3.44Å
126	G	75.2	Confident	79.4	Confident	19 Å²	19	70.1 Å²	70.1	20%	0.196	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	54.4	-137.8	173.2	0	0	0	0	0	114	L122 G123 S128 M129	L122-G126 PolarHBondContact O-N 2.84Å; G123-G126 PolarHBondContact O-N 3.23Å; G126-S128 PolarHBondContact O-N 3.44Å; G126-M129 PolarHBondContact O-N 3.3Å
127	I	77.9	Confident	79.3	Confident	30 Å²	30	69 Å²	69	15%	0.154	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-56.7	-26	-176.2	-47.1	177.2	0	0	0	112.8	L36 V49 K50 L53 M129 L130	L36-I127 HydrophobicContact CD1-CG2 3.21Å; V49-I127 HydrophobicContact CG1-CD1 4.15Å; V49-I127 HydrophobicContact CG1-CG1 4.03Å; V49-I127 HydrophobicContact CG1-CG2 4.19Å; K50-I127 HydrophobicContact CB-CD1 3.85Å; K50-I127 HydrophobicContact CG-CD1 4.26Å; L53-I127 HydrophobicContact CD1-CD1 3.57Å; L53-I127 HydrophobicContact CD1-CG1 3.27Å; I127-M129 PolarHBondContact O-N 3.12Å; I127-M129 VanDerWaalsContact O-N 3.16Å; I127-L130 HydrophobicContact CG2-CD1 4.29Å; I127-L130 WeakPolarHBondContact O-CB 3.25Å; I127-L130 PolarHBondContact O-N 2.82Å; I127-L130 VanDerWaalsContact O-N 3.08Å
128	S	77.1	Confident	79.2	Confident	85 Å²	85	61.8 Å²	61.8	59%	0.594	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-64.8	-17.6	-178.1	-56.9	0	0	0	0	113.7	R125 G126 L130	R125-S128 WeakPolarHBondContact O-CB 3.39Å; R125-S128 PolarHBondContact O-N 3.49Å; G126-S128 PolarHBondContact O-N 3.44Å; S128-L130 VanDerWaalsContact C-N 3.3Å
129	M	75.4	Confident	79.2	Confident	62 Å²	62	58.1 Å²	58.1	31%	0.305	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-80.8	-8.1	175.9	-67.6	-68.1	-139.2	0	0	113.8	R125 G126 I127 P212 E213	R125-M129 HydrophobicContact CB-CE 4.01Å; R125-M129 HydrophobicContact CB-CG 3.76Å; R125-M129 HydrophobicContact CB-SD 4.18Å; R125-M129 HydrophobicContact CG-CE 4.17Å; R125-M129 PolarHBondContact NE-SD 2.87Å; R125-M129 VanDerWaalsContact NE-SD 3.37Å; R125-M129 PolarHBondContact NH2-SD 3.18Å; R125-M129 VanDerWaalsContact NH2-SD 3.44Å; G126-M129 PolarHBondContact O-N 3.3Å; I127-M129 PolarHBondContact O-N 3.12Å; I127-M129 VanDerWaalsContact O-N 3.16Å; M129-P212 WeakPolarHBondContact O-CB 3.22Å; M129-E213 HydrophobicContact SD-CG 4.47Å
130	L	83.6	Confident	79.3	Confident	18 Å²	18	52.8 Å²	52.8	9%	0.094	27%	0.274	C	S	.	.	S	Bend	trans	-88.6	140	-178.2	-58.7	177.7	0	0	0	111.6	L36 L38 V49 L122 I127 S128	L36-L130 HydrophobicContact CB-CB 4.28Å; L36-L130 HydrophobicContact CB-CD1 4.3Å; L36-L130 HydrophobicContact CD1-CD1 4.15Å; L38-L130 HydrophobicContact CD2-CD1 3.85Å; L38-L130 HydrophobicContact CD2-CD2 4.46Å; V49-L130 HydrophobicContact CG1-CD1 4.41Å; L122-L130 HydrophobicContact CD2-CD1 3.9Å; L122-L130 HydrophobicContact CD2-CD2 3.8Å; L122-L130 HydrophobicContact CD2-CG 4.03Å; I127-L130 HydrophobicContact CG2-CD1 4.29Å; I127-L130 WeakPolarHBondContact O-CB 3.25Å; I127-L130 PolarHBondContact O-N 2.82Å; I127-L130 VanDerWaalsContact O-N 3.08Å; S128-L130 VanDerWaalsContact C-N 3.3Å
131	F	83.8	Confident	79.1	Confident	28 Å²	28	55 Å²	55	12%	0.123	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	138.3	173.8	-75.9	-75.4	0	0	0	111.1	L36 I37 L209 P212 V219 P229	L36-F131 CarbonylContact C-O 3.54Å; L36-F131 WeakPolarHBondContact CA-O 3.5Å; I37-F131 HydrophobicContact CB-CB 4.45Å; I37-F131 HydrophobicContact CD1-CB 4.47Å; I37-F131 PolarHBondContact N-O 3.07Å; F131-L209 HydrophobicContact CD1-CD1 3.7Å; F131-L209 HydrophobicContact CD1-CD2 4.21Å; F131-L209 HydrophobicContact CD1-CG 4.02Å; F131-L209 HydrophobicContact CE1-CD1 4.37Å; F131-L209 HydrophobicContact CE1-CD2 4.33Å; F131-L209 HydrophobicContact CE1-CG 4.2Å; F131-P212 HydrophobicContact CD1-CG 3.7Å; F131-P212 HydrophobicContact CD2-CG 4.13Å; F131-P212 HydrophobicContact CE1-CG 3.58Å; F131-P212 HydrophobicContact CE2-CG 3.97Å; F131-P212 HydrophobicContact CG-CG 4.01Å; F131-P212 HydrophobicContact CZ-CG 3.71Å; F131-V219 HydrophobicContact CE1-CG1 4.15Å; F131-P229 HydrophobicContact CE1-CG 4.33Å; F131-P229 HydrophobicContact CE2-CG 4.38Å; F131-P229 HydrophobicContact CZ-CG 4.07Å; F131-P229 WeakPolarHBondContact CZ-O 3.19Å
132	R	84.9	Confident	79.1	Confident	112 Å²	112	56.6 Å²	56.6	42%	0.423	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	134.6	166.4	-67.3	-177.5	-179.1	-176.8	2.4	110.3	L36 F134	L36-R132 HydrophobicContact CD2-CG 3.8Å; R132-F134 HydrophobicContact CB-CD2 4.37Å; R132-F134 HydrophobicContact CB-CE1 4.09Å; R132-F134 HydrophobicContact CB-CE2 3.94Å; R132-F134 HydrophobicContact CB-CZ 3.79Å; R132-F134 HydrophobicContact CG-CZ 4.45Å; R132-F134 PolarHBondContact O-N 3.48Å
133	N	87.6	Confident	79.6	Confident	28 Å²	28	57.3 Å²	57.3	15%	0.15	28%	0.284	C	S	.	.			trans	-90.2	73.1	177.6	-162	-20.7	0	0	0	111.5	P35 I37 S43 T135 L136 E137	P35-N133 HydrophobicContact CB-CB 4.06Å; P35-N133 HydrophobicContact CG-CB 3.94Å; P35-N133 WeakPolarHBondContact CG-O 3.47Å; P35-N133 PolarHBondContact O-N 2.92Å; I37-N133 HydrophobicContact CD1-CB 3.93Å; I37-N133 HydrophobicContact CG1-CB 3.58Å; S43-N133 PolarHBondContact OG-ND2 3.08Å; N133-T135 PolarHBondContact O-N 3.35Å; N133-L136 HydrophobicContact CB-CB 4.01Å; N133-L136 WeakPolarHBondContact ND2-CB 3.41Å; N133-L136 PolarHBondContact O-N 3.12Å; N133-L136 WeakPolarHBondContact OD1-CB 3.4Å; N133-L136 PolarHBondContact OD1-N 3.39Å; N133-E137 PolarHBondContact O-N 3.19Å
134	F	84.4	Confident	80	Confident	37 Å²	37	59.2 Å²	59.2	16%	0.162	28%	0.284	C	S	.	.	H	α-helix	trans	-61.1	-27.1	179.3	-61.6	-65.9	0	0	0	113.3	R132 S138 L209	R132-F134 HydrophobicContact CB-CD2 4.37Å; R132-F134 HydrophobicContact CB-CE1 4.09Å; R132-F134 HydrophobicContact CB-CE2 3.94Å; R132-F134 HydrophobicContact CB-CZ 3.79Å; R132-F134 HydrophobicContact CG-CZ 4.45Å; R132-F134 PolarHBondContact O-N 3.48Å; F134-S138 WeakPolarHBondContact O-CB 3.37Å; F134-S138 PolarHBondContact O-N 3.44Å; F134-S138 PolarHBondContact O-OG 2.97Å; F134-L209 HydrophobicContact CD2-CD1 4.05Å; F134-L209 HydrophobicContact CE2-CD1 3.89Å
135	T	85.4	Confident	80.5	Confident	99 Å²	99	55.8 Å²	55.8	61%	0.607	27%	0.268	S	S	*	.	H	α-helix	trans	-67.8	-49.9	176.7	-56.4	0	0	0	0	110.4	N133 S138 I139	N133-T135 PolarHBondContact O-N 3.35Å; T135-S138 PolarHBondContact O-N 3.25Å; T135-I139 HydrophobicContact CG2-CD1 3.93Å; T135-I139 VanDerWaalsContact O-CG1 3.25Å; T135-I139 WeakPolarHBondContact O-CG1 3.36Å; T135-I139 PolarHBondContact O-N 3.48Å
136	L	86.4	Confident	81	Confident	19 Å²	19	52.8 Å²	52.8	10%	0.099	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-43.3	175.8	-178.3	58.6	0	0	0	111.5	L23 F32 P35 N133 S138 I139 V140	L23-L136 HydrophobicContact CD2-CD1 3.82Å; F32-L136 HydrophobicContact CB-CD2 4.5Å; F32-L136 HydrophobicContact CD1-CD2 4.32Å; F32-L136 HydrophobicContact CD2-CD1 4.14Å; F32-L136 HydrophobicContact CD2-CD2 3.6Å; F32-L136 HydrophobicContact CD2-CG 4Å; F32-L136 HydrophobicContact CE1-CD2 4.47Å; F32-L136 HydrophobicContact CE2-CD2 3.79Å; F32-L136 HydrophobicContact CG-CD2 3.89Å; F32-L136 HydrophobicContact CG-CG 4.36Å; F32-L136 HydrophobicContact CZ-CD2 4.22Å; P35-L136 HydrophobicContact CB-CD2 3.89Å; P35-L136 HydrophobicContact CB-CG 4.48Å; P35-L136 HydrophobicContact CG-CB 4.17Å; P35-L136 HydrophobicContact CG-CD2 4.16Å; P35-L136 HydrophobicContact CG-CG 4.22Å; N133-L136 HydrophobicContact CB-CB 4.01Å; N133-L136 WeakPolarHBondContact ND2-CB 3.41Å; N133-L136 PolarHBondContact O-N 3.12Å; N133-L136 WeakPolarHBondContact OD1-CB 3.4Å; N133-L136 PolarHBondContact OD1-N 3.39Å; L136-S138 VanDerWaalsContact C-N 3.28Å; L136-S138 PolarHBondContact O-N 3.5Å; L136-I139 PolarHBondContact O-N 3.35Å; L136-I139 VanDerWaalsContact O-N 3.14Å; L136-V140 HydrophobicContact CD1-CG2 4.22Å; L136-V140 HydrophobicContact CG-CG2 4.47Å; L136-V140 WeakPolarHBondContact O-CB 3.44Å; L136-V140 VanDerWaalsContact O-CG2 3.31Å; L136-V140 WeakPolarHBondContact O-CG2 3.28Å; L136-V140 PolarHBondContact O-N 3.43Å
137	E	83.9	Confident	80.8	Confident	33 Å²	33	54.7 Å²	54.7	15%	0.154	28%	0.284	C	S	.	.	H	α-helix	trans	-56.5	-43.3	173.6	-174.9	173.1	-147.4	0	0	111.7	H34 P35 N133 E141	H34-E137 IonicContact CD2-OE1 2.7Å; P35-E137 HydrophobicContact CG-CB 4.19Å; N133-E137 PolarHBondContact O-N 3.19Å; E137-E141 WeakPolarHBondContact O-CB 3.42Å; E137-E141 PolarHBondContact O-N 3.04Å
138	S	82.6	Confident	80	Confident	22 Å²	22	60.7 Å²	60.7	15%	0.154	31%	0.305	C	S	.	.	H	α-helix	trans	-70.6	-32.8	177.3	-56.9	0	0	0	0	113.1	F134 T135 L136 R142 K207	F134-S138 WeakPolarHBondContact O-CB 3.37Å; F134-S138 PolarHBondContact O-N 3.44Å; F134-S138 PolarHBondContact O-OG 2.97Å; T135-S138 PolarHBondContact O-N 3.25Å; L136-S138 VanDerWaalsContact C-N 3.28Å; L136-S138 PolarHBondContact O-N 3.5Å; S138-R142 WeakPolarHBondContact O-CG 3.46Å; S138-R142 PolarHBondContact O-N 3.3Å; S138-R142 VanDerWaalsContact O-N 3.07Å; S138-R142 PolarHBondContact O-NH1 3.38Å; S138-K207 PolarHBondContact OG-NZ 3.38Å
139	I	84.8	Confident	79	Confident	50 Å²	50	62 Å²	62	26%	0.256	32%	0.321	S	S	.	.	H	α-helix	trans	-68.7	-47.2	174.7	-67.1	160.3	0	0	0	109.8	L23 T135 L136 E141 R142 Y143	L23-I139 HydrophobicContact CD1-CG2 4.39Å; L23-I139 HydrophobicContact CD2-CB 4.43Å; L23-I139 HydrophobicContact CD2-CG2 3.6Å; T135-I139 HydrophobicContact CG2-CD1 3.93Å; T135-I139 VanDerWaalsContact O-CG1 3.25Å; T135-I139 WeakPolarHBondContact O-CG1 3.36Å; T135-I139 PolarHBondContact O-N 3.48Å; L136-I139 PolarHBondContact O-N 3.35Å; L136-I139 VanDerWaalsContact O-N 3.14Å; I139-E141 VanDerWaalsContact C-N 3.27Å; I139-E141 PolarHBondContact O-N 3.06Å; I139-R142 VanDerWaalsContact CG1-NH2 3.27Å; I139-R142 PolarHBondContact O-N 3.4Å; I139-Y143 WeakPolarHBondContact O-CB 3.31Å; I139-Y143 PolarHBondContact O-N 2.85Å
140	V	84.3	Confident	78	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-60.1	-39.9	176.1	172.9	0	0	0	0	110.8	L23 L31 F32 L136 Y143 R144	L23-V140 HydrophobicContact CB-CG2 4.1Å; L23-V140 HydrophobicContact CD2-CG2 3.93Å; L23-V140 HydrophobicContact CG-CG2 4.43Å; L31-V140 HydrophobicContact CB-CG1 3.92Å; L31-V140 HydrophobicContact CD1-CG1 4.41Å; F32-V140 HydrophobicContact CB-CG2 4.2Å; L136-V140 HydrophobicContact CD1-CG2 4.22Å; L136-V140 HydrophobicContact CG-CG2 4.47Å; L136-V140 WeakPolarHBondContact O-CB 3.44Å; L136-V140 VanDerWaalsContact O-CG2 3.31Å; L136-V140 WeakPolarHBondContact O-CG2 3.28Å; L136-V140 PolarHBondContact O-N 3.43Å; V140-Y143 WeakPolarHBondContact O-CB 3.13Å; V140-Y143 PolarHBondContact O-N 3.32Å; V140-R144 HydrophobicContact CG1-CG 4.43Å; V140-R144 VanDerWaalsContact CG1-CZ 3.41Å; V140-R144 WeakPolarHBondContact O-CG 3.13Å; V140-R144 PolarHBondContact O-N 3.16Å
141	E	77.7	Confident	76.8	Confident	52 Å²	52	68.1 Å²	68.1	24%	0.243	37%	0.37	C	S	.	.	H	α-helix	trans	-65.5	-45	177.2	-170.3	55.8	-150.6	0	0	112.1	E137 I139 Y143 R144 Q145	E137-E141 WeakPolarHBondContact O-CB 3.42Å; E137-E141 PolarHBondContact O-N 3.04Å; I139-E141 VanDerWaalsContact C-N 3.27Å; I139-E141 PolarHBondContact O-N 3.06Å; E141-Y143 VanDerWaalsContact C-N 3.28Å; E141-Y143 PolarHBondContact O-N 3.13Å; E141-R144 PolarHBondContact O-N 3.17Å; E141-R144 IonicContact OE2-NH1 3.65Å; E141-Q145 VanDerWaalsContact O-CG 3.27Å; E141-Q145 WeakPolarHBondContact O-CG 3.47Å; E141-Q145 PolarHBondContact O-N 2.82Å; E141-Q145 PolarHBondContact OE1-NE2 3.26Å
142	R	79.8	Confident	76.1	Confident	144 Å²	144	68.7 Å²	68.7	54%	0.543	38%	0.379	S	S	.	.	H	α-helix	trans	-61.1	-38.7	172.3	-72.8	-167.6	-55.2	-86.4	4.4	112	S138 I139 Q145 A146	S138-R142 WeakPolarHBondContact O-CG 3.46Å; S138-R142 PolarHBondContact O-N 3.3Å; S138-R142 VanDerWaalsContact O-N 3.07Å; S138-R142 PolarHBondContact O-NH1 3.38Å; I139-R142 VanDerWaalsContact CG1-NH2 3.27Å; I139-R142 PolarHBondContact O-N 3.4Å; R142-Q145 PolarHBondContact O-N 3.08Å; R142-A146 VanDerWaalsContact O-CB 3.31Å; R142-A146 WeakPolarHBondContact O-CB 3.44Å; R142-A146 PolarHBondContact O-N 2.79Å
143	Y	81.2	Confident	75.7	Confident	25 Å²	25	65.5 Å²	65.5	10%	0.098	37%	0.37	C	S	.	.	H	α-helix	trans	-64	-44.3	175.6	179.5	-89.3	0	0	0	111.4	I16 I19 E20 L23 L31 I139 V140 E141 Q145 A146 A147	I16-Y143 HydrophobicContact CG2-CD2 3.68Å; I16-Y143 HydrophobicContact CG2-CE2 3.42Å; I16-Y143 VanDerWaalsContact CG2-CE2 3.42Å; I16-Y143 WeakPolarHBondContact O-CE2 3.47Å; I19-Y143 HydrophobicContact CG2-CD2 3.96Å; I19-Y143 HydrophobicContact CG2-CE2 4.05Å; E20-Y143 HydrophobicContact CB-CE2 4.36Å; E20-Y143 WeakPolarHBondContact CB-OH 3.23Å; E20-Y143 VanDerWaalsContact CG-OH 3.32Å; E20-Y143 WeakPolarHBondContact CG-OH 3.41Å; E20-Y143 PolarHBondContact OE2-OH 2.96Å; L23-Y143 HydrophobicContact CD1-CD1 3.98Å; L23-Y143 HydrophobicContact CD1-CD2 3.49Å; L23-Y143 VanDerWaalsContact CD1-CD2 3.49Å; L23-Y143 HydrophobicContact CD1-CE2 4.18Å; L23-Y143 HydrophobicContact CD1-CG 3.38Å; L31-Y143 HydrophobicContact CD1-CD1 4.17Å; L31-Y143 HydrophobicContact CD1-CE1 4.32Å; L31-Y143 HydrophobicContact CD2-CD1 4.15Å; L31-Y143 HydrophobicContact CD2-CE1 4.16Å; I139-Y143 WeakPolarHBondContact O-CB 3.31Å; I139-Y143 PolarHBondContact O-N 2.85Å; V140-Y143 WeakPolarHBondContact O-CB 3.13Å; V140-Y143 PolarHBondContact O-N 3.32Å; E141-Y143 VanDerWaalsContact C-N 3.28Å; E141-Y143 PolarHBondContact O-N 3.13Å; Y143-Q145 VanDerWaalsContact C-N 3.33Å; Y143-Q145 PolarHBondContact O-N 2.63Å; Y143-A146 PolarHBondContact O-N 3.43Å; Y143-A147 HydrophobicContact CE1-CB 4.22Å; Y143-A147 WeakPolarHBondContact O-CB 3.49Å; Y143-A147 PolarHBondContact O-N 3.45Å
144	R	78.3	Confident	75.6	Confident	64 Å²	64	67.5 Å²	67.5	24%	0.242	38%	0.38	C	S	.	.	H	α-helix	trans	-58.8	-44	174.4	-75.6	179.2	-176.1	128.7	5.8	111.6	L31 F32 V140 E141 R148	L31-R144 HydrophobicContact CD1-CG 3.82Å; F32-R144 PolarHBondContact O-NH2 3.32Å; V140-R144 HydrophobicContact CG1-CG 4.43Å; V140-R144 VanDerWaalsContact CG1-CZ 3.41Å; V140-R144 WeakPolarHBondContact O-CG 3.13Å; V140-R144 PolarHBondContact O-N 3.16Å; E141-R144 PolarHBondContact O-N 3.17Å; E141-R144 IonicContact OE2-NH1 3.65Å; R144-R148 WeakPolarHBondContact O-CB 3.19Å; R144-R148 PolarHBondContact O-N 3.13Å
145	Q	73.3	Confident	75.8	Confident	118 Å²	118	65.8 Å²	65.8	55%	0.551	37%	0.372	S	S	*	.	H	α-helix	trans	-67.3	-37.7	178.3	-69.5	170.3	4.1	0	0	112.4	E141 R142 Y143 R148	E141-Q145 VanDerWaalsContact O-CG 3.27Å; E141-Q145 WeakPolarHBondContact O-CG 3.47Å; E141-Q145 PolarHBondContact O-N 2.82Å; E141-Q145 PolarHBondContact OE1-NE2 3.26Å; R142-Q145 PolarHBondContact O-N 3.08Å; Y143-Q145 VanDerWaalsContact C-N 3.33Å; Y143-Q145 PolarHBondContact O-N 2.63Å; Q145-R148 CarbonylContact O-C 3.58Å; Q145-R148 VanDerWaalsContact O-O 3.11Å
146	A	73.6	Confident	75.9	Confident	64 Å²	64	66.2 Å²	66.2	53%	0.529	37%	0.371	S	S	.	.	H	α-helix	trans	-75.9	-34.5	177.3	0	0	0	0	0	113	I16 R142 Y143	I16-A146 HydrophobicContact CD1-CB 4Å; R142-A146 VanDerWaalsContact O-CB 3.31Å; R142-A146 WeakPolarHBondContact O-CB 3.44Å; R142-A146 PolarHBondContact O-N 2.79Å; Y143-A146 PolarHBondContact O-N 3.43Å
147	A	70	Confident	75.8	Confident	58 Å²	58	67.9 Å²	67.9	48%	0.479	38%	0.382	S	S	.	.	H	α-helix	trans	-80.6	-26.7	178.8	0	0	0	0	0	113	Y143	Y143-A147 HydrophobicContact CE1-CB 4.22Å; Y143-A147 WeakPolarHBondContact O-CB 3.49Å; Y143-A147 PolarHBondContact O-N 3.45Å
148	R	61.5	Low	76.1	Confident	156 Å²	156	67.4 Å²	67.4	59%	0.589	38%	0.382	S	S	*	.			trans	-128.2	105.8	176.2	-61.4	-175.3	-179	98.3	-0.5	109.9	R144 Q145 A150	R144-R148 WeakPolarHBondContact O-CB 3.19Å; R144-R148 PolarHBondContact O-N 3.13Å; Q145-R148 CarbonylContact O-C 3.58Å; Q145-R148 VanDerWaalsContact O-O 3.11Å; R148-A150 PolarHBondContact O-N 3.29Å
149	A	55.9	Low	75.9	Confident	114 Å²	114	74.9 Å²	74.9	94%	0.942	41%	0.412	S	S	*	.	S	Bend	trans	-63.8	11.1	165	0	0	0	0	0	114.4
150	A	54.2	Low	75.5	Confident	73 Å²	73	77.7 Å²	77.7	60%	0.603	43%	0.433	S	S	*	.			trans	-155.2	101.5	-169.3	0	0	0	0	0	114.4	R148	R148-A150 PolarHBondContact O-N 3.29Å
151	V	60.2	Low	74.3	Confident	134 Å²	134	83.8 Å²	83.8	81%	0.812	47%	0.473	S	S	*	.				-149.5	108.3	125	178.9	0	0	0	0	105.4	I153	V151-I153 PolarHBondContact O-N 3.11Å
152	A	67.9	Low	74.2	Confident	40 Å²	40	87.8 Å²	87.8	33%	0.331	50%	0.496	S	S	.	.			trans	-66	126.9	176	0	0	0	0	0	109.6	M154 E165	A152-M154 HydrophobicContact CB-SD 4.2Å; A152-M154 PolarHBondContact O-N 2.76Å; A152-E165 HydrophobicContact CB-CB 4.34Å; A152-E165 HydrophobicContact CB-CG 3.66Å; A152-E165 WeakPolarHBondContact CB-OE1 3.38Å
153	I	77.6	Confident	74.3	Confident	45 Å²	45	85.1 Å²	85.1	23%	0.231	49%	0.489	C	S	.	.			trans	-72.5	115.8	172.9	-66	170.2	0	0	0	106.6	V151 A166 S176 P200 T202	V151-I153 PolarHBondContact O-N 3.11Å; I153-A166 HydrophobicContact CG2-CB 4.27Å; I153-A166 WeakPolarHBondContact O-CA 3.37Å; I153-A166 WeakPolarHBondContact O-CB 3.29Å; I153-A166 PolarHBondContact O-N 3.45Å; I153-S176 WeakPolarHBondContact CG2-OG 3.36Å; I153-P200 HydrophobicContact CB-CB 3.95Å; I153-P200 HydrophobicContact CD1-CB 3.87Å; I153-P200 WeakPolarHBondContact CD1-O 3.15Å; I153-P200 HydrophobicContact CG1-CB 4.41Å; I153-P200 HydrophobicContact CG2-CB 4.37Å; I153-T202 HydrophobicContact CD1-CG2 4.05Å; I153-T202 HydrophobicContact CG1-CG2 4.2Å
154	M	85.2	Confident	74.4	Confident	71 Å²	71	88.3 Å²	88.3	35%	0.35	51%	0.505	S	S	.	.	B	Isolated β-bridge	trans	-81	150.8	-175.2	-56.4	-54.9	-72.9	0	0	111.9	A152 N156 Q163 E165	A152-M154 HydrophobicContact CB-SD 4.2Å; A152-M154 PolarHBondContact O-N 2.76Å; M154-N156 PolarHBondContact O-N 2.92Å; M154-Q163 HydrophobicContact CB-CG 4.25Å; M154-Q163 HydrophobicContact CE-CB 4.17Å; M154-Q163 HydrophobicContact CE-CG 4.05Å; M154-Q163 VanDerWaalsContact CE-O 3.27Å; M154-Q163 WeakPolarHBondContact CE-O 3.46Å; M154-E165 HydrophobicContact SD-CG 4.17Å
155	C	88.6	Confident	74.7	Confident	0 Å²	0	91.3 Å²	91.3	0%	0	52%	0.522	C	S	.	.			trans	-61.4	129.4	173.5	-178.4	0	0	0	0	110.7	V157 C158 Q163 Q164 S176 C178	C155-V157 VanDerWaalsContact C-N 3.25Å; C155-V157 PolarHBondContact O-N 3.43Å; C155-V157 PolarHBondContact SG-N 3.44Å; C155-C158 HydrophobicContact CB-CB 4.19Å; C155-Q163 PolarHBondContact O-NE2 3.23Å; C155-Q164 WeakPolarHBondContact CB-O 3.28Å; C155-Q164 PolarHBondContact N-O 3.45Å; C155-S176 WeakPolarHBondContact CA-O 3.21Å; C155-C178 HydrophobicContact CB-CB 4.05Å; C155-C178 PolarHBondContact SG-N 3.33Å
156	N	86.4	Confident	75.3	Confident	108 Å²	108	86.1 Å²	86.1	58%	0.578	50%	0.499	S	S	*	.	S	Bend	trans	-75.1	-12.9	179	-66.3	105.8	0	0	0	113.7	M154 A175 S176	M154-N156 PolarHBondContact O-N 2.92Å; N156-A175 HydrophobicContact CB-CB 4.48Å; N156-S176 PolarHBondContact N-O 2.9Å; N156-S176 PolarHBondContact OD1-N 2.79Å; N156-S176 PolarHBondContact OD1-O 3.46Å
157	V	85.9	Confident	75.8	Confident	54 Å²	54	86.3 Å²	86.3	33%	0.327	49%	0.494	S	S	.	.	S	Bend	trans	-102.6	-31	-173.6	-178.6	0	0	0	0	112.5	C155 K159 Y177 C181 H185	C155-V157 VanDerWaalsContact C-N 3.25Å; C155-V157 PolarHBondContact O-N 3.43Å; C155-V157 PolarHBondContact SG-N 3.44Å; V157-K159 PolarHBondContact O-N 3.16Å; V157-Y177 HydrophobicContact CG2-CD1 3.59Å; V157-Y177 HydrophobicContact CG2-CE1 3.47Å; V157-Y177 VanDerWaalsContact CG2-CE1 3.47Å; V157-C181 HydrophobicContact CB-CB 4.11Å; V157-C181 HydrophobicContact CG1-CB 4.34Å; V157-H185 WeakPolarHBondContact CG1-NE2 3.09Å
158	C	88.6	Confident	76.6	Confident	23 Å²	23	86 Å²	86	16%	0.155	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-66.5	128.7	178.7	-63.9	0	0	0	0	110.4	C155 Q163	C155-C158 HydrophobicContact CB-CB 4.19Å; C158-Q163 HydrophobicContact CB-CB 4.48Å; C158-Q163 HydrophobicContact CB-CG 4.1Å
159	K	79.3	Confident	77.7	Confident	180 Å²	180	78.6 Å²	78.6	78%	0.783	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-87.8	147.2	173.8	-65.1	-174.7	-179	-179.2	0	110.9	V157 N162	V157-K159 PolarHBondContact O-N 3.16Å; K159-N162 PolarHBondContact O-N 2.77Å
160	P	76.4	Confident	79.2	Confident	109 Å²	109	73.2 Å²	73.2	71%	0.708	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	144.7	173.3	-20.3	31.8	0	0	0	111.3
161	P	59.8	Low	80.5	Confident	128 Å²	128	71.4 Å²	71.4	83%	0.831	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	cis	-92.2	-8	12.5	34	-34.1	0	0	0	116	Q163	P161-Q163 PolarHBondContact O-N 2.91Å
162	N	75	Confident	81.5	Confident	136 Å²	136	69.4 Å²	69.4	73%	0.727	37%	0.373	S	S	*	.	S	Bend	trans	-93.7	51.1	-175	-68	-21.5	0	0	0	112.8	K159 Q164	K159-N162 PolarHBondContact O-N 2.77Å; N162-Q164 PolarHBondContact O-N 2.95Å
163	Q	81	Confident	82.3	Confident	87 Å²	87	69.4 Å²	69.4	41%	0.407	37%	0.371	S	S	.	.			trans	-77.6	115.4	178.7	-159.4	173.7	13.6	0	0	110.5	M154 C155 C158 P161	M154-Q163 HydrophobicContact CB-CG 4.25Å; M154-Q163 HydrophobicContact CE-CB 4.17Å; M154-Q163 HydrophobicContact CE-CG 4.05Å; M154-Q163 VanDerWaalsContact CE-O 3.27Å; M154-Q163 WeakPolarHBondContact CE-O 3.46Å; C155-Q163 PolarHBondContact O-NE2 3.23Å; C158-Q163 HydrophobicContact CB-CB 4.48Å; C158-Q163 HydrophobicContact CB-CG 4.1Å; P161-Q163 PolarHBondContact O-N 2.91Å
164	Q	83.5	Confident	82.6	Confident	92 Å²	92	74.6 Å²	74.6	43%	0.43	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-91.5	154.1	179.2	-68.4	-176	-7.1	0	0	112	C155 N162 C178	C155-Q164 WeakPolarHBondContact CB-O 3.28Å; C155-Q164 PolarHBondContact N-O 3.45Å; N162-Q164 PolarHBondContact O-N 2.95Å; Q164-C178 HydrophobicContact CB-CB 3.77Å; Q164-C178 PolarHBondContact OE1-SG 2.98Å
165	E	85.6	Confident	82.6	Confident	128 Å²	128	71.9 Å²	71.9	60%	0.598	38%	0.38	S	S	*	.	B	Isolated β-bridge	trans	-63.4	137.2	170	-57.1	-174.3	172.9	0	0	110.2	A152 M154 C178	A152-E165 HydrophobicContact CB-CB 4.34Å; A152-E165 HydrophobicContact CB-CG 3.66Å; A152-E165 WeakPolarHBondContact CB-OE1 3.38Å; M154-E165 HydrophobicContact SD-CG 4.17Å; E165-C178 WeakPolarHBondContact O-CB 3.27Å
166	A	85.6	Confident	82.6	Confident	8 Å²	8	72 Å²	72	7%	0.066	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-70.6	136.4	173.5	0	0	0	0	0	109.5	I153 S176 Y177 P200	I153-A166 HydrophobicContact CG2-CB 4.27Å; I153-A166 WeakPolarHBondContact O-CA 3.37Å; I153-A166 WeakPolarHBondContact O-CB 3.29Å; I153-A166 PolarHBondContact O-N 3.45Å; A166-S176 VanDerWaalsContact CB-CB 3.49Å; A166-Y177 CarbonylContact C-O 3.59Å; A166-Y177 WeakPolarHBondContact CA-O 3.21Å; A166-P200 WeakPolarHBondContact O-CG 3.29Å
167	T	84.7	Confident	82.7	Confident	69 Å²	69	67.6 Å²	67.6	42%	0.423	36%	0.356	S	S	.	.	S	Bend	trans	-107.5	-19.4	174.7	58.2	0	0	0	0	111.6	Y177 N179	T167-Y177 PolarHBondContact N-O 2.91Å; T167-N179 PolarHBondContact OG1-N 3.44Å
168	K	85.6	Confident	82.9	Confident	52 Å²	52	65 Å²	65	23%	0.226	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	143.7	-179	-62	-177.5	179.1	-170.7	0	110.3	S176 Y177 F182 Y197	K168-S176 CarbonylContact O-C 3.45Å; K168-S176 WeakPolarHBondContact O-CA 3.06Å; K168-Y177 PolarHBondContact N-O 3.48Å; K168-Y177 VanDerWaalsContact N-O 3.15Å; K168-Y177 PolarHBondContact O-N 3.44Å; K168-F182 HydrophobicContact CB-CD2 3.89Å; K168-F182 HydrophobicContact CB-CE2 4.21Å; K168-F182 HydrophobicContact CB-CG 4.24Å; K168-F182 HydrophobicContact CD-CB 4.5Å; K168-F182 HydrophobicContact CD-CD1 3.69Å; K168-F182 HydrophobicContact CD-CD2 4.16Å; K168-F182 HydrophobicContact CD-CE1 3.89Å; K168-F182 HydrophobicContact CD-CE2 4.33Å; K168-F182 HydrophobicContact CD-CG 3.84Å; K168-F182 HydrophobicContact CD-CZ 4.21Å; K168-Y197 HydrophobicContact CB-CD2 4.36Å; K168-Y197 HydrophobicContact CD-CD2 3.93Å; K168-Y197 HydrophobicContact CD-CE2 3.93Å; K168-Y197 HydrophobicContact CG-CD2 4.23Å; K168-Y197 HydrophobicContact CG-CE2 4.5Å
169	S	85.6	Confident	82.9	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	123.8	174.1	-75.1	0	0	0	0	109	A175 S176 Y197 V198 P200 T201	S169-A175 WeakPolarHBondContact CA-O 3.44Å; S169-S176 WeakPolarHBondContact OG-CB 3.12Å; S169-S176 PolarHBondContact OG-OG 2.71Å; S169-Y197 CarbonylContact O-C 3.56Å; S169-Y197 WeakPolarHBondContact O-CA 3.26Å; S169-Y197 WeakPolarHBondContact O-CB 3.41Å; S169-V198 PolarHBondContact N-O 2.72Å; S169-V198 PolarHBondContact O-N 3.01Å; S169-P200 WeakPolarHBondContact OG-CA 3.38Å; S169-T201 PolarHBondContact OG-N 2.93Å; S169-T201 VanDerWaalsContact OG-N 3.14Å
170	C	86.6	Confident	83.3	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	122.2	179.6	177.8	0	0	0	0	109.2	D172 C173 K174 A175 Y177 F182 H186 H195 F204	C170-D172 VanDerWaalsContact C-N 3.33Å; C170-C173 HydrophobicContact CB-CB 3.86Å; C170-C173 PolarHBondContact SG-N 3.17Å; C170-C173 VanDerWaalsContact SG-SG 3.62Å; C170-K174 WeakPolarHBondContact O-CA 3.22Å; C170-K174 PolarHBondContact O-N 2.91Å; C170-A175 PolarHBondContact N-O 3.28Å; C170-A175 PolarHBondContact O-N 2.98Å; C170-Y177 HydrophobicContact CB-CD2 4.36Å; C170-Y177 HydrophobicContact CB-CE2 3.85Å; C170-F182 HydrophobicContact CB-CE2 4.44Å; C170-H186 PolarHBondContact SG-NE2 2.81Å; C170-H195 WeakPolarHBondContact SG-CB 3.47Å; C170-F204 WeakPolarHBondContact O-CD1 3.49Å; C170-F204 WeakPolarHBondContact O-CE1 3.33Å
171	M	80.7	Confident	83.8	Confident	35 Å²	35	60.5 Å²	60.5	17%	0.172	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-34.8	-177.4	-62.6	-62.3	-80.6	0	0	111.4	K174 E196 V198 T201 F204	M171-K174 WeakPolarHBondContact O-CG 3.42Å; M171-E196 WeakPolarHBondContact CB-O 3.34Å; M171-E196 PolarHBondContact N-O 3.23Å; M171-V198 HydrophobicContact CG-CG1 4.38Å; M171-V198 HydrophobicContact CG-CG2 4.14Å; M171-V198 HydrophobicContact SD-CG2 3.67Å; M171-T201 HydrophobicContact SD-CG2 4.42Å; M171-F204 HydrophobicContact SD-CB 4.4Å; M171-F204 HydrophobicContact SD-CD1 4.13Å
172	D	82.8	Confident	85.2	Confident	92 Å²	92	55.2 Å²	55.2	49%	0.492	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-41.3	179.1	-58.1	-58.4	0	0	0	112.3	C170 K174 H195 E196	C170-D172 VanDerWaalsContact C-N 3.33Å; D172-K174 VanDerWaalsContact C-N 3.29Å; D172-K174 PolarHBondContact O-N 2.79Å; D172-H195 HydrophobicContact CB-CB 3.97Å; D172-H195 WeakPolarHBondContact OD2-CA 3.38Å; D172-H195 VanDerWaalsContact OD2-CB 3.27Å; D172-H195 WeakPolarHBondContact OD2-CB 3.19Å; D172-H195 IonicContact OD2-CD2 3.31Å; D172-H195 IonicContact OD2-CG 2.82Å; D172-E196 PolarHBondContact OD2-N 3.23Å
173	C	84	Confident	85.7	Confident	41 Å²	41	55.1 Å²	55.1	28%	0.277	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-12.1	175.7	-66.5	0	0	0	0	113.4	C170 A175 Y177 H186 H195	C170-C173 HydrophobicContact CB-CB 3.86Å; C170-C173 PolarHBondContact SG-N 3.17Å; C170-C173 VanDerWaalsContact SG-SG 3.62Å; C173-A175 PolarHBondContact O-N 2.72Å; C173-Y177 HydrophobicContact CB-CE2 4.22Å; C173-Y177 VanDerWaalsContact CB-OH 3.31Å; C173-Y177 WeakPolarHBondContact CB-OH 3.37Å; C173-H186 PolarHBondContact SG-NE2 2.8Å; C173-H186 VanDerWaalsContact SG-NE2 3.36Å; C173-H195 VanDerWaalsContact SG-CE1 3.5Å; C173-H195 PolarHBondContact SG-ND1 2.79Å
174	K	84.1	Confident	86	Confident	153 Å²	153	57 Å²	57	67%	0.665	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	39.8	-176.3	-58.1	178.4	-176.8	170.8	0	113.3	C170 M171 D172 F204	C170-K174 WeakPolarHBondContact O-CA 3.22Å; C170-K174 PolarHBondContact O-N 2.91Å; M171-K174 WeakPolarHBondContact O-CG 3.42Å; D172-K174 VanDerWaalsContact C-N 3.29Å; D172-K174 PolarHBondContact O-N 2.79Å; K174-F204 HydrophobicContact CB-CB 4.2Å; K174-F204 HydrophobicContact CB-CD2 4.37Å; K174-F204 HydrophobicContact CB-CG 4.16Å; K174-F204 HydrophobicContact CG-CB 4.04Å
175	A	86.1	Confident	85.9	Confident	14 Å²	14	56.2 Å²	56.2	12%	0.116	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	149.2	-175.8	0	0	0	0	0	111.6	N156 S169 C170 C173 Y177	N156-A175 HydrophobicContact CB-CB 4.48Å; S169-A175 WeakPolarHBondContact CA-O 3.44Å; C170-A175 PolarHBondContact N-O 3.28Å; C170-A175 PolarHBondContact O-N 2.98Å; C173-A175 PolarHBondContact O-N 2.72Å; A175-Y177 HydrophobicContact CB-CE1 4.48Å; A175-Y177 HydrophobicContact CB-CE2 3.76Å; A175-Y177 WeakPolarHBondContact O-CD2 3.48Å; A175-Y177 VanDerWaalsContact O-CE2 3.26Å; A175-Y177 WeakPolarHBondContact O-CE2 3.46Å
176	S	87.9	Confident	86	Confident	3 Å²	3	50.8 Å²	50.8	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	133	176.7	-54.8	0	0	0	0	109.9	I153 C155 N156 A166 K168 S169 F204	I153-S176 WeakPolarHBondContact CG2-OG 3.36Å; C155-S176 WeakPolarHBondContact CA-O 3.21Å; N156-S176 PolarHBondContact N-O 2.9Å; N156-S176 PolarHBondContact OD1-N 2.79Å; N156-S176 PolarHBondContact OD1-O 3.46Å; A166-S176 VanDerWaalsContact CB-CB 3.49Å; K168-S176 CarbonylContact O-C 3.45Å; K168-S176 WeakPolarHBondContact O-CA 3.06Å; S169-S176 WeakPolarHBondContact OG-CB 3.12Å; S169-S176 PolarHBondContact OG-OG 2.71Å; S176-F204 WeakPolarHBondContact OG-CZ 3.48Å
177	Y	88.9	Confident	86.1	Confident	15 Å²	15	53.1 Å²	53.1	6%	0.059	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	141.3	-173.8	-57.3	-89.3	0	0	0	110.3	V157 A166 T167 K168 C170 C173 A175 C181 F182 H185 H186	V157-Y177 HydrophobicContact CG2-CD1 3.59Å; V157-Y177 HydrophobicContact CG2-CE1 3.47Å; V157-Y177 VanDerWaalsContact CG2-CE1 3.47Å; A166-Y177 CarbonylContact C-O 3.59Å; A166-Y177 WeakPolarHBondContact CA-O 3.21Å; T167-Y177 PolarHBondContact N-O 2.91Å; K168-Y177 PolarHBondContact N-O 3.48Å; K168-Y177 VanDerWaalsContact N-O 3.15Å; K168-Y177 PolarHBondContact O-N 3.44Å; C170-Y177 HydrophobicContact CB-CD2 4.36Å; C170-Y177 HydrophobicContact CB-CE2 3.85Å; C173-Y177 HydrophobicContact CB-CE2 4.22Å; C173-Y177 VanDerWaalsContact CB-OH 3.31Å; C173-Y177 WeakPolarHBondContact CB-OH 3.37Å; A175-Y177 HydrophobicContact CB-CE1 4.48Å; A175-Y177 HydrophobicContact CB-CE2 3.76Å; A175-Y177 WeakPolarHBondContact O-CD2 3.48Å; A175-Y177 VanDerWaalsContact O-CE2 3.26Å; A175-Y177 WeakPolarHBondContact O-CE2 3.46Å; Y177-C181 HydrophobicContact CD1-CB 4.22Å; Y177-F182 AromaticContact CD2-CD2 3.96Å; Y177-F182 HydrophobicContact CD2-CD2 3.96Å; Y177-F182 HydrophobicContact CG-CB 4.45Å; Y177-F182 HydrophobicContact CG-CD2 4.25Å; Y177-H185 HydrophobicContact CD1-CB 4.43Å; Y177-H185 HydrophobicContact CE1-CB 3.94Å; Y177-H185 AromaticContact CE1-CD2 3.9Å; Y177-H185 AromaticContact CE1-CG 3.81Å; Y177-H186 AromaticContact CE2-CE1 3.63Å; Y177-H186 AromaticContact CZ-CE1 3.84Å
178	C	90.4	Very high	85.8	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.007	30%	0.295	C	S	.	.			trans	-67.4	165.2	159.9	75	0	0	0	0	109.5	C155 Q164 E165 E180 C181 F182	C155-C178 HydrophobicContact CB-CB 4.05Å; C155-C178 PolarHBondContact SG-N 3.33Å; Q164-C178 HydrophobicContact CB-CB 3.77Å; Q164-C178 PolarHBondContact OE1-SG 2.98Å; E165-C178 WeakPolarHBondContact O-CB 3.27Å; C178-E180 PolarHBondContact O-N 3.42Å; C178-E180 VanDerWaalsContact O-N 3.16Å; C178-C181 PolarHBondContact O-N 2.83Å; C178-C181 PolarHBondContact SG-N 3.12Å; C178-C181 VanDerWaalsContact SG-N 3.4Å; C178-F182 WeakPolarHBondContact O-CB 3.32Å; C178-F182 PolarHBondContact O-N 3.4Å
179	N	87.4	Confident	85.5	Confident	77 Å²	77	62.5 Å²	62.5	41%	0.412	32%	0.317	S	S	.	.	H	α-helix	trans	-59.2	-33.6	-174.2	-160.7	12.9	0	0	0	112.6	T167 K183	T167-N179 PolarHBondContact OG1-N 3.44Å; N179-K183 WeakPolarHBondContact O-CG 3.24Å; N179-K183 PolarHBondContact O-N 3.24Å
180	E	87.3	Confident	85.4	Confident	124 Å²	124	64.9 Å²	64.9	58%	0.579	33%	0.332	S	S	*	.	H	α-helix	trans	-74.8	-50.4	179.4	-169.9	163.8	-160.9	0	0	112	C178 F182 K183 L184	C178-E180 PolarHBondContact O-N 3.42Å; C178-E180 VanDerWaalsContact O-N 3.16Å; E180-F182 PolarHBondContact O-N 3.39Å; E180-K183 PolarHBondContact O-N 3.44Å; E180-L184 HydrophobicContact CG-CD1 4.43Å; E180-L184 WeakPolarHBondContact O-CG 3.41Å; E180-L184 PolarHBondContact O-N 3.17Å; E180-L184 VanDerWaalsContact O-N 3.16Å
181	C	87.9	Confident	85.1	Confident	15 Å²	15	69.9 Å²	69.9	10%	0.101	36%	0.364	C	S	.	.	H	α-helix	trans	-61.9	-32.5	175.6	-70.6	0	0	0	0	112.2	V157 Y177 C178 L184 H185	V157-C181 HydrophobicContact CB-CB 4.11Å; V157-C181 HydrophobicContact CG1-CB 4.34Å; Y177-C181 HydrophobicContact CD1-CB 4.22Å; C178-C181 PolarHBondContact O-N 2.83Å; C178-C181 PolarHBondContact SG-N 3.12Å; C178-C181 VanDerWaalsContact SG-N 3.4Å; C181-L184 PolarHBondContact O-N 2.94Å; C181-H185 WeakPolarHBondContact O-CB 3.49Å; C181-H185 PolarHBondContact O-CD2 3.06Å; C181-H185 PolarHBondContact O-N 2.64Å
182	F	88.4	Confident	85.2	Confident	17 Å²	17	73.2 Å²	73.2	8%	0.075	38%	0.377	C	S	.	.	H	α-helix	trans	-63.7	-47.2	177.2	-173.5	-95.4	0	0	0	111.3	K168 C170 Y177 C178 E180 L184 H185 H186 Y197	K168-F182 HydrophobicContact CB-CD2 3.89Å; K168-F182 HydrophobicContact CB-CE2 4.21Å; K168-F182 HydrophobicContact CB-CG 4.24Å; K168-F182 HydrophobicContact CD-CB 4.5Å; K168-F182 HydrophobicContact CD-CD1 3.69Å; K168-F182 HydrophobicContact CD-CD2 4.16Å; K168-F182 HydrophobicContact CD-CE1 3.89Å; K168-F182 HydrophobicContact CD-CE2 4.33Å; K168-F182 HydrophobicContact CD-CG 3.84Å; K168-F182 HydrophobicContact CD-CZ 4.21Å; C170-F182 HydrophobicContact CB-CE2 4.44Å; Y177-F182 AromaticContact CD2-CD2 3.96Å; Y177-F182 HydrophobicContact CD2-CD2 3.96Å; Y177-F182 HydrophobicContact CG-CB 4.45Å; Y177-F182 HydrophobicContact CG-CD2 4.25Å; C178-F182 WeakPolarHBondContact O-CB 3.32Å; C178-F182 PolarHBondContact O-N 3.4Å; E180-F182 PolarHBondContact O-N 3.39Å; F182-L184 VanDerWaalsContact C-N 3.31Å; F182-L184 PolarHBondContact O-N 2.83Å; F182-H185 PolarHBondContact O-N 3.26Å; F182-H186 AromaticContact CD2-ND1 3.76Å; F182-H186 HydrophobicContact CE1-CB 4.18Å; F182-H186 AromaticContact CE2-CE1 3.93Å; F182-H186 AromaticContact CE2-CG 3.96Å; F182-H186 AromaticContact CE2-ND1 3.74Å; F182-H186 HydrophobicContact CZ-CB 4.18Å; F182-H186 WeakPolarHBondContact O-CB 3.27Å; F182-H186 PolarHBondContact O-N 2.86Å; F182-H186 PolarHBondContact O-ND1 3.1Å; F182-Y197 HydrophobicContact CE1-CD1 4.27Å; F182-Y197 HydrophobicContact CE1-CE1 4.38Å; F182-Y197 HydrophobicContact CE2-CD1 4.33Å; F182-Y197 HydrophobicContact CE2-CG 4.09Å; F182-Y197 AromaticContact CZ-CD1 3.51Å; F182-Y197 HydrophobicContact CZ-CD1 3.51Å; F182-Y197 HydrophobicContact CZ-CD2 4.36Å; F182-Y197 HydrophobicContact CZ-CE1 4.06Å; F182-Y197 AromaticContact CZ-CG 3.67Å; F182-Y197 HydrophobicContact CZ-CG 3.67Å
183	K	86.3	Confident	85.2	Confident	134 Å²	134	70.8 Å²	70.8	58%	0.583	37%	0.371	S	S	*	.	H	α-helix	trans	-63.2	-37.2	178.4	-70.9	175	-176.1	-178.4	0	112.4	N179 E180 H186 P187	N179-K183 WeakPolarHBondContact O-CG 3.24Å; N179-K183 PolarHBondContact O-N 3.24Å; E180-K183 PolarHBondContact O-N 3.44Å; K183-H186 CarbonylContact O-C 3.52Å; K183-P187 WeakPolarHBondContact O-CA 3.5Å
184	L	85.8	Confident	85	Confident	128 Å²	128	77.2 Å²	77.2	67%	0.67	40%	0.397	S	S	*	.	H	α-helix	trans	-69.8	-38.4	177.7	-68.4	168.8	0	0	0	112.3	E180 C181 F182	E180-L184 HydrophobicContact CG-CD1 4.43Å; E180-L184 WeakPolarHBondContact O-CG 3.41Å; E180-L184 PolarHBondContact O-N 3.17Å; E180-L184 VanDerWaalsContact O-N 3.16Å; C181-L184 PolarHBondContact O-N 2.94Å; F182-L184 VanDerWaalsContact C-N 3.31Å; F182-L184 PolarHBondContact O-N 2.83Å
185	H	82.2	Confident	85.1	Confident	75 Å²	75	72.2 Å²	72.2	35%	0.347	38%	0.375	S	S	.	.	H	α-helix	trans	-85.3	-20.8	179.3	-83.5	-85	0	0	0	114.5	V157 Y177 C181 F182 K192	V157-H185 WeakPolarHBondContact CG1-NE2 3.09Å; Y177-H185 HydrophobicContact CD1-CB 4.43Å; Y177-H185 HydrophobicContact CE1-CB 3.94Å; Y177-H185 AromaticContact CE1-CD2 3.9Å; Y177-H185 AromaticContact CE1-CG 3.81Å; C181-H185 WeakPolarHBondContact O-CB 3.49Å; C181-H185 PolarHBondContact O-CD2 3.06Å; C181-H185 PolarHBondContact O-N 2.64Å; F182-H185 PolarHBondContact O-N 3.26Å; H185-K192 WeakPolarHBondContact O-CD 3.21Å
186	H	88.2	Confident	84.8	Confident	13 Å²	13	77.9 Å²	77.9	6%	0.06	40%	0.399	C	S	.	.	S	Bend	trans	-127.9	61.1	178.9	-53	73.4	0	0	0	110.3	C170 C173 Y177 F182 K183 K192 H195	C170-H186 PolarHBondContact SG-NE2 2.81Å; C173-H186 PolarHBondContact SG-NE2 2.8Å; C173-H186 VanDerWaalsContact SG-NE2 3.36Å; Y177-H186 AromaticContact CE2-CE1 3.63Å; Y177-H186 AromaticContact CZ-CE1 3.84Å; F182-H186 AromaticContact CD2-ND1 3.76Å; F182-H186 HydrophobicContact CE1-CB 4.18Å; F182-H186 AromaticContact CE2-CE1 3.93Å; F182-H186 AromaticContact CE2-CG 3.96Å; F182-H186 AromaticContact CE2-ND1 3.74Å; F182-H186 HydrophobicContact CZ-CB 4.18Å; F182-H186 WeakPolarHBondContact O-CB 3.27Å; F182-H186 PolarHBondContact O-N 2.86Å; F182-H186 PolarHBondContact O-ND1 3.1Å; K183-H186 CarbonylContact O-C 3.52Å; H186-K192 PolarHBondContact CD2-O 3.27Å; H186-H195 AromaticContact CD2-ND1 3.89Å; H186-H195 AromaticContact NE2-ND1 3.66Å
187	P	86.1	Confident	84.6	Confident	58 Å²	58	83.5 Å²	83.5	38%	0.377	42%	0.421	S	S	.	.			trans	-68.8	140.2	179.5	26.9	-31.6	0	0	0	110.7	K183 G189 T190	K183-P187 WeakPolarHBondContact O-CA 3.5Å; P187-G189 PolarHBondContact O-N 3.39Å; P187-T190 HydrophobicContact CG-CG2 3.78Å; P187-T190 PolarHBondContact O-N 3.43Å; P187-T190 PolarHBondContact O-OG1 2.79Å
188	W	79.6	Confident	84.2	Confident	250 Å²	250	85.4 Å²	85.4	95%	0.947	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	135.9	-177.2	-173.2	84.5	0	0	0	111.5
189	G	79.4	Confident	83.5	Confident	68 Å²	68	87.5 Å²	87.5	70%	0.701	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	0.7	-177.7	0	0	0	0	0	115.7	P187	P187-G189 PolarHBondContact O-N 3.39Å
190	T	83.8	Confident	82.9	Confident	50 Å²	50	86.5 Å²	86.5	31%	0.307	45%	0.453	S	S	.	.	S	Bend	trans	-98.3	157.5	173.8	64.3	0	0	0	0	112.5	P187 K192 A193	P187-T190 HydrophobicContact CG-CG2 3.78Å; P187-T190 PolarHBondContact O-N 3.43Å; P187-T190 PolarHBondContact O-OG1 2.79Å; T190-K192 PolarHBondContact O-N 2.91Å; T190-K192 VanDerWaalsContact O-N 3.15Å; T190-A193 VanDerWaalsContact O-CB 3.3Å; T190-A193 WeakPolarHBondContact O-CB 3.31Å; T190-A193 PolarHBondContact O-N 2.68Å; T190-A193 PolarHBondContact OG1-N 2.99Å
191	P	80.5	Confident	82.1	Confident	104 Å²	104	82.1 Å²	82.1	68%	0.675	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-54.7	-32	172.6	-26.4	34.7	0	0	0	112.8	A193 Q194	P191-A193 VanDerWaalsContact C-N 3.29Å; P191-A193 PolarHBondContact O-N 2.83Å; P191-Q194 PolarHBondContact O-N 3.33Å
192	K	82.6	Confident	81.1	Confident	105 Å²	105	85.8 Å²	85.8	46%	0.457	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-65.7	-28.5	175.6	-66.7	-169.1	175.9	-177.5	0	112.8	H185 H186 T190 Q194 H195	H185-K192 WeakPolarHBondContact O-CD 3.21Å; H186-K192 PolarHBondContact CD2-O 3.27Å; T190-K192 PolarHBondContact O-N 2.91Å; T190-K192 VanDerWaalsContact O-N 3.15Å; K192-Q194 PolarHBondContact O-N 2.75Å; K192-Q194 VanDerWaalsContact O-N 3.17Å; K192-H195 VanDerWaalsContact O-CB 3.31Å; K192-H195 WeakPolarHBondContact O-CB 3.36Å; K192-H195 PolarHBondContact O-N 3.27Å
193	A	81.7	Confident	80	Confident	42 Å²	42	87.8 Å²	87.8	35%	0.347	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-65.5	-17.1	176.3	0	0	0	0	0	113.5	T190 P191 H195	T190-A193 VanDerWaalsContact O-CB 3.3Å; T190-A193 WeakPolarHBondContact O-CB 3.31Å; T190-A193 PolarHBondContact O-N 2.68Å; T190-A193 PolarHBondContact OG1-N 2.99Å; P191-A193 VanDerWaalsContact C-N 3.29Å; P191-A193 PolarHBondContact O-N 2.83Å; A193-H195 VanDerWaalsContact C-N 3.32Å
194	Q	80.4	Confident	79	Confident	176 Å²	176	83.1 Å²	83.1	82%	0.822	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-86.6	-1.9	175.5	-60.7	-176.4	-5.1	0	0	113.2	P191 K192	P191-Q194 PolarHBondContact O-N 3.33Å; K192-Q194 PolarHBondContact O-N 2.75Å; K192-Q194 VanDerWaalsContact O-N 3.17Å
195	H	85.9	Confident	77.9	Confident	48 Å²	48	84.1 Å²	84.1	22%	0.222	44%	0.443	C	S	.	.	S	Bend	trans	-64.3	139.8	177.6	-67.2	-178.1	0	0	0	111.7	C170 D172 C173 H186 K192 A193 Y197	C170-H195 WeakPolarHBondContact SG-CB 3.47Å; D172-H195 HydrophobicContact CB-CB 3.97Å; D172-H195 WeakPolarHBondContact OD2-CA 3.38Å; D172-H195 VanDerWaalsContact OD2-CB 3.27Å; D172-H195 WeakPolarHBondContact OD2-CB 3.19Å; D172-H195 IonicContact OD2-CD2 3.31Å; D172-H195 IonicContact OD2-CG 2.82Å; C173-H195 VanDerWaalsContact SG-CE1 3.5Å; C173-H195 PolarHBondContact SG-ND1 2.79Å; H186-H195 AromaticContact CD2-ND1 3.89Å; H186-H195 AromaticContact NE2-ND1 3.66Å; K192-H195 VanDerWaalsContact O-CB 3.31Å; K192-H195 WeakPolarHBondContact O-CB 3.36Å; K192-H195 PolarHBondContact O-N 3.27Å; A193-H195 VanDerWaalsContact C-N 3.32Å; H195-Y197 PolarHBondContact O-N 3.26Å
196	E	79.9	Confident	76.9	Confident	132 Å²	132	85.4 Å²	85.4	62%	0.617	46%	0.458	S	S	*	.			trans	-72.2	122.7	176.7	-170.2	-179.1	173.6	0	0	109.3	M171 D172	M171-E196 WeakPolarHBondContact CB-O 3.34Å; M171-E196 PolarHBondContact N-O 3.23Å; D172-E196 PolarHBondContact OD2-N 3.23Å
197	Y	83.3	Confident	75.7	Confident	121 Å²	121	91 Å²	91	48%	0.475	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	143.8	176.1	70.5	-92.7	0	0	0	111.7	K168 S169 F182 H195	K168-Y197 HydrophobicContact CB-CD2 4.36Å; K168-Y197 HydrophobicContact CD-CD2 3.93Å; K168-Y197 HydrophobicContact CD-CE2 3.93Å; K168-Y197 HydrophobicContact CG-CD2 4.23Å; K168-Y197 HydrophobicContact CG-CE2 4.5Å; S169-Y197 CarbonylContact O-C 3.56Å; S169-Y197 WeakPolarHBondContact O-CA 3.26Å; S169-Y197 WeakPolarHBondContact O-CB 3.41Å; F182-Y197 HydrophobicContact CE1-CD1 4.27Å; F182-Y197 HydrophobicContact CE1-CE1 4.38Å; F182-Y197 HydrophobicContact CE2-CD1 4.33Å; F182-Y197 HydrophobicContact CE2-CG 4.09Å; F182-Y197 AromaticContact CZ-CD1 3.51Å; F182-Y197 HydrophobicContact CZ-CD1 3.51Å; F182-Y197 HydrophobicContact CZ-CD2 4.36Å; F182-Y197 HydrophobicContact CZ-CE1 4.06Å; F182-Y197 AromaticContact CZ-CG 3.67Å; F182-Y197 HydrophobicContact CZ-CG 3.67Å; H195-Y197 PolarHBondContact O-N 3.26Å
198	V	81	Confident	75.1	Confident	55 Å²	55	90.9 Å²	90.9	33%	0.333	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	175.1	178	-65.6	0	0	0	0	109.8	S169 M171 T201	S169-V198 PolarHBondContact N-O 2.72Å; S169-V198 PolarHBondContact O-N 3.01Å; M171-V198 HydrophobicContact CG-CG1 4.38Å; M171-V198 HydrophobicContact CG-CG2 4.14Å; M171-V198 HydrophobicContact SD-CG2 3.67Å; V198-T201 HydrophobicContact CG2-CG2 3.66Å
199	G	76	Confident	75.2	Confident	45 Å²	45	81.6 Å²	81.6	46%	0.464	45%	0.449	S	S	.	.	S	Bend	trans	-57.8	167.1	169	0	0	0	0	0	111.9	T201	G199-T201 PolarHBondContact O-N 2.89Å; G199-T201 VanDerWaalsContact O-N 3.11Å
200	P	74.6	Confident	75.3	Confident	56 Å²	56	81.6 Å²	81.6	36%	0.364	43%	0.432	S	S	.	.	S	Bend	trans	-53	120.8	-177	-23.9	35.1	0	0	0	111.4	I153 A166 S169	I153-P200 HydrophobicContact CB-CB 3.95Å; I153-P200 HydrophobicContact CD1-CB 3.87Å; I153-P200 WeakPolarHBondContact CD1-O 3.15Å; I153-P200 HydrophobicContact CG1-CB 4.41Å; I153-P200 HydrophobicContact CG2-CB 4.37Å; A166-P200 WeakPolarHBondContact O-CG 3.29Å; S169-P200 WeakPolarHBondContact OG-CA 3.38Å
201	T	70	Confident	75.3	Confident	32 Å²	32	79.4 Å²	79.4	20%	0.196	42%	0.419	C	S	.	.			trans	-142.4	142.8	-179.5	-178.4	0	0	0	0	109.7	S169 M171 V198 G199 N203 F204	S169-T201 PolarHBondContact OG-N 2.93Å; S169-T201 VanDerWaalsContact OG-N 3.14Å; M171-T201 HydrophobicContact SD-CG2 4.42Å; V198-T201 HydrophobicContact CG2-CG2 3.66Å; G199-T201 PolarHBondContact O-N 2.89Å; G199-T201 VanDerWaalsContact O-N 3.11Å; T201-N203 VanDerWaalsContact C-N 3.27Å; T201-N203 PolarHBondContact OG1-N 2.71Å; T201-N203 PolarHBondContact OG1-O 3.34Å; T201-F204 HydrophobicContact CG2-CD1 4.43Å; T201-F204 HydrophobicContact CG2-CE1 4.44Å; T201-F204 VanDerWaalsContact O-CZ 3.3Å; T201-F204 WeakPolarHBondContact O-CZ 3.35Å
202	T	68.1	Low	75.4	Confident	93 Å²	93	75.3 Å²	75.3	57%	0.571	39%	0.392	S	S	*	.	S	Bend	trans	-85.7	-5.7	168.6	52.4	0	0	0	0	111.9	I153	I153-T202 HydrophobicContact CD1-CG2 4.05Å; I153-T202 HydrophobicContact CG1-CG2 4.2Å
203	N	65.6	Low	75.2	Confident	58 Å²	58	72.7 Å²	72.7	31%	0.31	38%	0.381	S	S	.	.			trans	-114	91.4	-173.3	-67.6	-50.6	0	0	0	111.6	T201 R205	T201-N203 VanDerWaalsContact C-N 3.27Å; T201-N203 PolarHBondContact OG1-N 2.71Å; T201-N203 PolarHBondContact OG1-O 3.34Å; N203-R205 VanDerWaalsContact C-N 3.34Å; N203-R205 PolarHBondContact O-N 3.31Å
204	F	64.6	Low	75.3	Confident	36 Å²	36	73.2 Å²	73.2	16%	0.158	38%	0.377	C	S	.	.			trans	-90.4	17.1	-178.9	-56.9	-87	0	0	0	114.6	C170 M171 K174 S176 T201	C170-F204 WeakPolarHBondContact O-CD1 3.49Å; C170-F204 WeakPolarHBondContact O-CE1 3.33Å; M171-F204 HydrophobicContact SD-CB 4.4Å; M171-F204 HydrophobicContact SD-CD1 4.13Å; K174-F204 HydrophobicContact CB-CB 4.2Å; K174-F204 HydrophobicContact CB-CD2 4.37Å; K174-F204 HydrophobicContact CB-CG 4.16Å; K174-F204 HydrophobicContact CG-CB 4.04Å; S176-F204 WeakPolarHBondContact OG-CZ 3.48Å; T201-F204 HydrophobicContact CG2-CD1 4.43Å; T201-F204 HydrophobicContact CG2-CE1 4.44Å; T201-F204 VanDerWaalsContact O-CZ 3.3Å; T201-F204 WeakPolarHBondContact O-CZ 3.35Å
205	R	63.2	Low	75.1	Confident	149 Å²	149	72 Å²	72	56%	0.562	37%	0.371	S	S	*	.	S	Bend	trans	-92	133.3	-176.6	-70.3	-178.1	178.1	149.4	-0.7	110.8	H34 N203 K207	H34-R205 PolarHBondContact NE2-NH1 3.12Å; N203-R205 VanDerWaalsContact C-N 3.34Å; N203-R205 PolarHBondContact O-N 3.31Å; R205-K207 PolarHBondContact O-N 3.12Å
206	P	59.7	Low	74.8	Confident	102 Å²	102	78.1 Å²	78.1	66%	0.662	40%	0.402	S	S	*	.			trans	-58.7	124	170.1	-21.2	31.6	0	0	0	110.3	V208	P206-V208 HydrophobicContact CB-CG2 4.26Å; P206-V208 PolarHBondContact O-N 2.95Å
207	K	64.4	Low	75	Confident	131 Å²	131	75.1 Å²	75.1	57%	0.57	39%	0.388	S	S	*	.			trans	-81.3	57.4	178	-64.4	-178	-178.6	179.9	0	110.8	S138 R205	S138-K207 PolarHBondContact OG-NZ 3.38Å; R205-K207 PolarHBondContact O-N 3.12Å
208	V	72.9	Confident	75.1	Confident	56 Å²	56	74.8 Å²	74.8	34%	0.339	39%	0.389	S	S	.	.			trans	-101.9	123.7	175.5	-175.2	0	0	0	0	108.2	P206 M210 K218	P206-V208 HydrophobicContact CB-CG2 4.26Å; P206-V208 PolarHBondContact O-N 2.95Å; V208-M210 HydrophobicContact CB-SD 4.34Å; V208-M210 HydrophobicContact CG1-SD 3.74Å; V208-M210 PolarHBondContact O-N 2.92Å; V208-K218 HydrophobicContact CG1-CB 4.47Å; V208-K218 HydrophobicContact CG1-CD 3.75Å; V208-K218 HydrophobicContact CG1-CG 3.75Å
209	L	80.8	Confident	75.4	Confident	54 Å²	54	72.8 Å²	72.8	28%	0.283	38%	0.377	S	S	.	.			trans	-76.4	107.9	176.3	-167.2	63.4	0	0	0	108.7	F131 F134 V219 P229	F131-L209 HydrophobicContact CD1-CD1 3.7Å; F131-L209 HydrophobicContact CD1-CD2 4.21Å; F131-L209 HydrophobicContact CD1-CG 4.02Å; F131-L209 HydrophobicContact CE1-CD1 4.37Å; F131-L209 HydrophobicContact CE1-CD2 4.33Å; F131-L209 HydrophobicContact CE1-CG 4.2Å; F134-L209 HydrophobicContact CD2-CD1 4.05Å; F134-L209 HydrophobicContact CE2-CD1 3.89Å; L209-V219 HydrophobicContact CB-CG2 3.71Å; L209-V219 HydrophobicContact CD2-CG2 3.47Å; L209-V219 VanDerWaalsContact CD2-CG2 3.47Å; L209-V219 HydrophobicContact CG-CG2 3.54Å; L209-V219 WeakPolarHBondContact O-CG2 3.33Å; L209-V219 PolarHBondContact O-N 2.76Å; L209-V219 VanDerWaalsContact O-N 3.15Å; L209-P229 HydrophobicContact CD2-CG 4.15Å
210	M	82.9	Confident	75.9	Confident	68 Å²	68	74.6 Å²	74.6	34%	0.335	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-89.9	151.7	175.7	-56.7	-53.5	-67.8	0	0	110.1	V208 P212 E215 M216 K218	V208-M210 HydrophobicContact CB-SD 4.34Å; V208-M210 HydrophobicContact CG1-SD 3.74Å; V208-M210 PolarHBondContact O-N 2.92Å; M210-P212 WeakPolarHBondContact O-CD 3.48Å; M210-E215 WeakPolarHBondContact CE-O 3.37Å; M210-M216 VanDerWaalsContact CE-O 3.29Å; M210-M216 WeakPolarHBondContact CE-O 3.16Å; M210-K218 HydrophobicContact CE-CG 4.27Å; M210-K218 HydrophobicContact SD-CG 3.93Å
211	C	84.3	Confident	76.6	Confident	4 Å²	4	73.9 Å²	73.9	3%	0.027	37%	0.368	C	S	.	.			trans	-71.8	127.6	177.9	-176	0	0	0	0	110.6	E213 H214 E215 E217 V219 C231 C234	C211-E213 PolarHBondContact O-N 2.97Å; C211-E213 PolarHBondContact SG-N 3.16Å; C211-H214 HydrophobicContact CB-CB 4.07Å; C211-H214 WeakPolarHBondContact CB-O 3.49Å; C211-H214 CarbonylContact O-C 3.6Å; C211-H214 PolarHBondContact O-N 3.45Å; C211-E215 PolarHBondContact O-N 2.92Å; C211-E217 PolarHBondContact N-O 2.8Å; C211-V219 HydrophobicContact CB-CG1 3.89Å; C211-C231 HydrophobicContact CB-CB 3.93Å; C211-C231 VanDerWaalsContact SG-SG 3.65Å; C211-C234 PolarHBondContact SG-SG 2.74Å
212	P	81.1	Confident	77.6	Confident	19 Å²	19	74.2 Å²	74.2	12%	0.123	37%	0.366	C	S	.	.	S	Bend	trans	-64.8	-23	176.3	-20.6	31.2	0	0	0	113.4	M129 F131 M210	M129-P212 WeakPolarHBondContact O-CB 3.22Å; F131-P212 HydrophobicContact CD1-CG 3.7Å; F131-P212 HydrophobicContact CD2-CG 4.13Å; F131-P212 HydrophobicContact CE1-CG 3.58Å; F131-P212 HydrophobicContact CE2-CG 3.97Å; F131-P212 HydrophobicContact CG-CG 4.01Å; F131-P212 HydrophobicContact CZ-CG 3.71Å; M210-P212 WeakPolarHBondContact O-CD 3.48Å
213	E	79.6	Confident	78.6	Confident	49 Å²	49	69.8 Å²	69.8	23%	0.229	34%	0.339	C	S	.	.	S	Bend	trans	-88.8	-27.3	176.6	-64.9	170.4	-152.5	0	0	112.5	M129 C211 R228	M129-E213 HydrophobicContact SD-CG 4.47Å; C211-E213 PolarHBondContact O-N 2.97Å; C211-E213 PolarHBondContact SG-N 3.16Å; E213-R228 IonicContact OE1-CZ 3.54Å; E213-R228 IonicContact OE1-NH1 2.83Å; E213-R228 IonicContact OE1-NH2 2.79Å; E213-R228 PolarHBondContact OE1-NH2 2.95Å
214	H	82.6	Confident	79.7	Confident	53 Å²	53	70.6 Å²	70.6	25%	0.245	34%	0.341	C	S	.	.	S	Bend	trans	-134.9	85.3	-175.9	-55.8	98.9	0	0	0	109.5	C211 M216 E217 C231 L233 C234	C211-H214 HydrophobicContact CB-CB 4.07Å; C211-H214 WeakPolarHBondContact CB-O 3.49Å; C211-H214 CarbonylContact O-C 3.6Å; C211-H214 PolarHBondContact O-N 3.45Å; H214-M216 PolarHBondContact O-N 3.26Å; H214-E217 HydrophobicContact CB-CB 3.95Å; H214-E217 HydrophobicContact CB-CG 4.07Å; H214-E217 PolarHBondContact O-N 2.79Å; H214-C231 PolarHBondContact ND1-SG 3.15Å; H214-L233 HydrophobicContact CB-CD1 4.35Å; H214-C234 PolarHBondContact ND1-SG 2.81Å; H214-C234 VanDerWaalsContact ND1-SG 3.39Å
215	E	76.2	Confident	80.9	Confident	151 Å²	151	73 Å²	73	71%	0.706	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-24.6	-165.9	-62	-177.6	172.3	0	0	114.9	M210 C211	M210-E215 WeakPolarHBondContact CE-O 3.37Å; C211-E215 PolarHBondContact O-N 2.92Å
216	M	79.6	Confident	81.8	Confident	176 Å²	176	68.3 Å²	68.3	87%	0.867	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-8.6	179.7	-57.7	-177.3	83.1	0	0	113.7	M210 H214	M210-M216 VanDerWaalsContact CE-O 3.29Å; M210-M216 WeakPolarHBondContact CE-O 3.16Å; H214-M216 PolarHBondContact O-N 3.26Å
217	E	84.5	Confident	83.1	Confident	70 Å²	70	72.2 Å²	72.2	33%	0.327	35%	0.349	S	S	.	.	S	Bend	trans	-100.5	134.1	-176.1	-72.2	-61.4	143.4	0	0	112.9	C211 H214 C231 L233	C211-E217 PolarHBondContact N-O 2.8Å; H214-E217 HydrophobicContact CB-CB 3.95Å; H214-E217 HydrophobicContact CB-CG 4.07Å; H214-E217 PolarHBondContact O-N 2.79Å; E217-C231 HydrophobicContact CB-CB 3.81Å; E217-L233 HydrophobicContact CG-CD1 3.47Å; E217-L233 VanDerWaalsContact CG-CD1 3.47Å; E217-L233 HydrophobicContact CG-CG 3.82Å
218	K	85.3	Confident	84.1	Confident	114 Å²	114	70 Å²	70	50%	0.496	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-78.4	138.8	174.6	-60.1	-177.3	-176	178	0	110.1	V208 M210 N220 C231	V208-K218 HydrophobicContact CG1-CB 4.47Å; V208-K218 HydrophobicContact CG1-CD 3.75Å; V208-K218 HydrophobicContact CG1-CG 3.75Å; M210-K218 HydrophobicContact CE-CG 4.27Å; M210-K218 HydrophobicContact SD-CG 3.93Å; K218-N220 PolarHBondContact O-N 2.92Å; K218-C231 WeakPolarHBondContact O-CB 3.21Å
219	V	87.1	Confident	84.8	Confident	12 Å²	12	69 Å²	69	7%	0.073	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-79.4	117.6	173.3	-56.9	0	0	0	0	110.3	F131 L209 C211 P229 C231	F131-V219 HydrophobicContact CE1-CG1 4.15Å; L209-V219 HydrophobicContact CB-CG2 3.71Å; L209-V219 HydrophobicContact CD2-CG2 3.47Å; L209-V219 VanDerWaalsContact CD2-CG2 3.47Å; L209-V219 HydrophobicContact CG-CG2 3.54Å; L209-V219 WeakPolarHBondContact O-CG2 3.33Å; L209-V219 PolarHBondContact O-N 2.76Å; L209-V219 VanDerWaalsContact O-N 3.15Å; C211-V219 HydrophobicContact CB-CG1 3.89Å; V219-P229 HydrophobicContact CB-CB 4.26Å; V219-P229 HydrophobicContact CG2-CB 4.01Å; V219-C231 HydrophobicContact CG1-CB 4.47Å
220	N	87.2	Confident	85.1	Confident	84 Å²	84	66.6 Å²	66.6	45%	0.449	32%	0.319	S	S	.	.			trans	-132	4.3	-174.4	-74	-26.7	0	0	0	112.8	K218 V230 M248	K218-N220 PolarHBondContact O-N 2.92Å; N220-V230 PolarHBondContact N-O 3.48Å; N220-M248 VanDerWaalsContact O-CB 3.26Å; N220-M248 WeakPolarHBondContact O-CB 3.17Å; N220-M248 PolarHBondContact O-N 3.35Å
221	M	89.2	Confident	85.5	Confident	41 Å²	41	63.3 Å²	63.3	20%	0.202	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	155.7	-176.7	-66.7	-68.3	-81.2	0	0	110.1	P229 V230 V245 T246 M248	M221-P229 CarbonylContact O-C 3.51Å; M221-P229 WeakPolarHBondContact O-CA 3.19Å; M221-V230 HydrophobicContact CB-CG2 3.92Å; M221-V230 PolarHBondContact N-O 3.45Å; M221-V230 PolarHBondContact O-N 3.39Å; M221-V230 VanDerWaalsContact O-O 3.12Å; M221-V245 HydrophobicContact CB-CG1 3.52Å; M221-V245 HydrophobicContact CE-CB 4.41Å; M221-V245 HydrophobicContact CE-CG1 3.59Å; M221-V245 HydrophobicContact CG-CG1 4.26Å; M221-T246 WeakPolarHBondContact CA-O 3.39Å; M221-M248 VanDerWaalsContact O-CE 3.27Å; M221-M248 WeakPolarHBondContact O-CE 3.28Å
222	Y	90.7	Very high	85.6	Confident	39 Å²	39	67.3 Å²	67.3	15%	0.153	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	123.2	179.4	-177.8	-99.9	0	0	0	110.5	E224 R227 V245 T246 A251 L255	Y222-E224 HydrophobicContact CD1-CG 4.38Å; Y222-R227 VanDerWaalsContact OH-CA 3.3Å; Y222-R227 WeakPolarHBondContact OH-CA 3.39Å; Y222-R227 PolarHBondContact OH-O 2.89Å; Y222-V245 CarbonylContact O-C 3.55Å; Y222-V245 VanDerWaalsContact O-CA 3.27Å; Y222-V245 WeakPolarHBondContact O-CA 3.45Å; Y222-V245 WeakPolarHBondContact O-CG1 3.32Å; Y222-T246 PolarHBondContact N-O 2.73Å; Y222-T246 PolarHBondContact O-N 2.91Å; Y222-A251 HydrophobicContact CD1-CB 3.82Å; Y222-A251 HydrophobicContact CD2-CB 4.41Å; Y222-A251 HydrophobicContact CG-CB 3.67Å; Y222-L255 HydrophobicContact CE2-CD1 4.36Å
223	C	90.2	Very high	85.9	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	117.6	175.1	-178.9	0	0	0	0	109.9	V225 C226 R227 R228 V230 H240 H243 V245	C223-V225 VanDerWaalsContact C-N 3.33Å; C223-C226 HydrophobicContact CB-CB 4.21Å; C223-C226 PolarHBondContact SG-N 2.94Å; C223-R227 VanDerWaalsContact O-CA 3.25Å; C223-R227 WeakPolarHBondContact O-CA 3.45Å; C223-R227 PolarHBondContact O-N 3.33Å; C223-R228 PolarHBondContact N-O 2.94Å; C223-R228 PolarHBondContact O-N 2.82Å; C223-V230 HydrophobicContact CB-CG1 4.09Å; C223-V230 HydrophobicContact CB-CG2 4.34Å; C223-H240 PolarHBondContact SG-ND1 3.18Å; C223-H240 VanDerWaalsContact SG-ND1 3.42Å; C223-H243 WeakPolarHBondContact SG-CB 3.34Å; C223-V245 HydrophobicContact CB-CG2 4.22Å
224	E	88.1	Confident	86.1	Confident	75 Å²	75	67.5 Å²	67.5	35%	0.35	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-30.6	179.8	-68.5	-178.1	-164.8	0	0	112.4	Y222 K244 T246	Y222-E224 HydrophobicContact CD1-CG 4.38Å; E224-K244 PolarHBondContact N-O 3.26Å; E224-K244 IonicContact OE1-NZ 3.79Å; E224-K244 PolarHBondContact OE1-NZ 3.17Å; E224-K244 VanDerWaalsContact OE2-CD 3.27Å; E224-K244 WeakPolarHBondContact OE2-CD 3.45Å; E224-K244 WeakPolarHBondContact OE2-CE 3.28Å; E224-K244 IonicContact OE2-NZ 2.81Å; E224-K244 PolarHBondContact OE2-NZ 3.38Å; E224-T246 WeakPolarHBondContact OE1-CG2 3.4Å
225	V	88.4	Confident	86.2	Confident	87 Å²	87	68.5 Å²	68.5	53%	0.527	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-52.1	-179.1	-177.6	0	0	0	0	110.5	C223 R227 H243	C223-V225 VanDerWaalsContact C-N 3.33Å; V225-R227 VanDerWaalsContact C-N 3.31Å; V225-R227 PolarHBondContact O-N 3.48Å; V225-H243 HydrophobicContact CB-CB 4.19Å; V225-H243 HydrophobicContact CG2-CB 4.1Å
226	C	83.5	Confident	86.5	Confident	50 Å²	50	68.1 Å²	68.1	34%	0.338	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-4.5	-179.5	-67.4	0	0	0	0	113.9	C223 R228 H240 H243	C223-C226 HydrophobicContact CB-CB 4.21Å; C223-C226 PolarHBondContact SG-N 2.94Å; C226-R228 HydrophobicContact CB-CG 3.83Å; C226-R228 PolarHBondContact O-N 2.85Å; C226-R228 VanDerWaalsContact O-N 3.1Å; C226-H240 PolarHBondContact SG-CE1 3.05Å; C226-H243 PolarHBondContact SG-CE1 3.08Å; C226-H243 PolarHBondContact SG-ND1 3.33Å
227	R	86.2	Confident	86.3	Confident	184 Å²	184	63.2 Å²	63.2	69%	0.694	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	33.3	-178.4	-57.7	-173.5	179.7	-167	3.1	114.6	Y222 C223 V225	Y222-R227 VanDerWaalsContact OH-CA 3.3Å; Y222-R227 WeakPolarHBondContact OH-CA 3.39Å; Y222-R227 PolarHBondContact OH-O 2.89Å; C223-R227 VanDerWaalsContact O-CA 3.25Å; C223-R227 WeakPolarHBondContact O-CA 3.45Å; C223-R227 PolarHBondContact O-N 3.33Å; V225-R227 VanDerWaalsContact C-N 3.31Å; V225-R227 PolarHBondContact O-N 3.48Å
228	R	85.1	Confident	86	Confident	85 Å²	85	61 Å²	61	32%	0.321	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	150.8	-175.9	69	-174.8	-179.6	136.5	5.1	112.6	E213 C223 C226 V230 H240	E213-R228 IonicContact OE1-CZ 3.54Å; E213-R228 IonicContact OE1-NH1 2.83Å; E213-R228 IonicContact OE1-NH2 2.79Å; E213-R228 PolarHBondContact OE1-NH2 2.95Å; C223-R228 PolarHBondContact N-O 2.94Å; C223-R228 PolarHBondContact O-N 2.82Å; C226-R228 HydrophobicContact CB-CG 3.83Å; C226-R228 PolarHBondContact O-N 2.85Å; C226-R228 VanDerWaalsContact O-N 3.1Å; R228-V230 HydrophobicContact CG-CG1 4.33Å; R228-H240 PolarHBondContact NE-CE1 2.98Å; R228-H240 PolarHBondContact NE-NE2 2.97Å; R228-H240 PolarHBondContact NH2-NE2 3.45Å
229	P	88.1	Confident	85.7	Confident	34 Å²	34	59 Å²	59	22%	0.221	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	140	173	30.1	-35.1	0	0	0	110.6	F131 L209 V219 M221 M248	F131-P229 HydrophobicContact CE1-CG 4.33Å; F131-P229 HydrophobicContact CE2-CG 4.38Å; F131-P229 HydrophobicContact CZ-CG 4.07Å; F131-P229 WeakPolarHBondContact CZ-O 3.19Å; L209-P229 HydrophobicContact CD2-CG 4.15Å; V219-P229 HydrophobicContact CB-CB 4.26Å; V219-P229 HydrophobicContact CG2-CB 4.01Å; M221-P229 CarbonylContact O-C 3.51Å; M221-P229 WeakPolarHBondContact O-CA 3.19Å; P229-M248 HydrophobicContact CB-CE 3.82Å
230	V	88.5	Confident	85.6	Confident	3 Å²	3	58.4 Å²	58.4	2%	0.018	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	157	-178.1	-61.7	0	0	0	0	110.7	N220 M221 C223 R228 C234 V245	N220-V230 PolarHBondContact N-O 3.48Å; M221-V230 HydrophobicContact CB-CG2 3.92Å; M221-V230 PolarHBondContact N-O 3.45Å; M221-V230 PolarHBondContact O-N 3.39Å; M221-V230 VanDerWaalsContact O-O 3.12Å; C223-V230 HydrophobicContact CB-CG1 4.09Å; C223-V230 HydrophobicContact CB-CG2 4.34Å; R228-V230 HydrophobicContact CG-CG1 4.33Å; V230-C234 HydrophobicContact CB-CB 4Å; V230-V245 HydrophobicContact CG2-CG1 4Å; V230-V245 HydrophobicContact CG2-CG2 4.44Å
231	C	89.8	Confident	85.5	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.309	C	S	.	.			trans	-92.3	176.4	171.8	72.7	0	0	0	0	111.5	C211 H214 E217 K218 V219 C234	C211-C231 HydrophobicContact CB-CB 3.93Å; C211-C231 VanDerWaalsContact SG-SG 3.65Å; H214-C231 PolarHBondContact ND1-SG 3.15Å; E217-C231 HydrophobicContact CB-CB 3.81Å; K218-C231 WeakPolarHBondContact O-CB 3.21Å; V219-C231 HydrophobicContact CG1-CB 4.47Å; C231-C234 WeakPolarHBondContact O-CB 3.45Å; C231-C234 PolarHBondContact O-N 2.93Å; C231-C234 VanDerWaalsContact SG-SG 3.61Å
232	H	86	Confident	85.3	Confident	87 Å²	87	62 Å²	62	40%	0.403	34%	0.341	S	S	.	.	H	α-helix	trans	-66.9	-35.7	179.7	-65.7	88.5	0	0	0	112.5	C234 K235 L236	H232-C234 VanDerWaalsContact C-N 3.35Å; H232-C234 PolarHBondContact O-N 3.43Å; H232-K235 PolarHBondContact O-N 2.85Å; H232-K235 VanDerWaalsContact O-N 3.07Å; H232-L236 WeakPolarHBondContact O-CG 3.2Å; H232-L236 PolarHBondContact O-N 3.47Å
233	L	87.2	Confident	85.3	Confident	72 Å²	72	62.6 Å²	62.6	38%	0.377	35%	0.345	S	S	.	.	H	α-helix	trans	-65.5	-36.2	177.7	-62.3	-174.1	0	0	0	112.5	H214 E217 K235 L236 G237 G238	H214-L233 HydrophobicContact CB-CD1 4.35Å; E217-L233 HydrophobicContact CG-CD1 3.47Å; E217-L233 VanDerWaalsContact CG-CD1 3.47Å; E217-L233 HydrophobicContact CG-CG 3.82Å; L233-K235 PolarHBondContact O-N 2.88Å; L233-L236 PolarHBondContact O-N 3.06Å; L233-G237 PolarHBondContact O-N 3.12Å; L233-G237 VanDerWaalsContact O-N 3.16Å; L233-G238 PolarHBondContact O-N 3.35Å
234	C	85.1	Confident	85.2	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.007	37%	0.371	C	S	.	.	H	α-helix	trans	-57.9	-30.3	172.4	-71.3	0	0	0	0	112.7	C211 H214 V230 C231 H232 G238 H240	C211-C234 PolarHBondContact SG-SG 2.74Å; H214-C234 PolarHBondContact ND1-SG 2.81Å; H214-C234 VanDerWaalsContact ND1-SG 3.39Å; V230-C234 HydrophobicContact CB-CB 4Å; C231-C234 WeakPolarHBondContact O-CB 3.45Å; C231-C234 PolarHBondContact O-N 2.93Å; C231-C234 VanDerWaalsContact SG-SG 3.61Å; H232-C234 VanDerWaalsContact C-N 3.35Å; H232-C234 PolarHBondContact O-N 3.43Å; C234-G238 CarbonylContact O-C 3.5Å; C234-G238 WeakPolarHBondContact O-CA 3.28Å; C234-G238 PolarHBondContact O-N 3.01Å; C234-H240 CarbonylContact O-C 3.55Å; C234-H240 WeakPolarHBondContact O-CA 3.32Å; C234-H240 WeakPolarHBondContact O-CB 3.22Å; C234-H240 PolarHBondContact O-N 3.22Å; C234-H240 VanDerWaalsContact O-N 3.16Å
235	K	84.3	Confident	85.3	Confident	74 Å²	74	66.3 Å²	66.3	32%	0.322	36%	0.362	S	S	.	.	H	α-helix	trans	-88.8	-36	178.4	179.6	56.7	179.1	174	0	113.2	H232 L233 H240 A241 H243 V245	H232-K235 PolarHBondContact O-N 2.85Å; H232-K235 VanDerWaalsContact O-N 3.07Å; L233-K235 PolarHBondContact O-N 2.88Å; K235-H240 WeakPolarHBondContact CD-O 3.44Å; K235-A241 PolarHBondContact NZ-O 3.37Å; K235-A241 WeakPolarHBondContact O-CA 3.27Å; K235-H243 PolarHBondContact NZ-O 2.91Å; K235-V245 HydrophobicContact CD-CB 4.38Å; K235-V245 HydrophobicContact CD-CG2 3.95Å
236	L	82.5	Confident	85.4	Confident	143 Å²	143	64 Å²	64	75%	0.749	35%	0.348	S	S	*	.	H	α-helix	trans	-77.9	-29.6	-174.9	-71	171.1	0	0	0	113.5	H232 L233	H232-L236 WeakPolarHBondContact O-CG 3.2Å; H232-L236 PolarHBondContact O-N 3.47Å; L233-L236 PolarHBondContact O-N 3.06Å
237	G	74.9	Confident	85.8	Confident	72 Å²	72	63.9 Å²	63.9	74%	0.742	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-159.7	10.6	179.8	0	0	0	0	0	115.4	L233	L233-G237 PolarHBondContact O-N 3.12Å; L233-G237 VanDerWaalsContact O-N 3.16Å
238	G	78.9	Confident	85.9	Confident	24 Å²	24	58.1 Å²	58.1	25%	0.247	33%	0.33	C	S	.	.	S	Bend	trans	-100.5	-165.3	-179.6	0	0	0	0	0	113.9	L233 C234 H240 A241	L233-G238 PolarHBondContact O-N 3.35Å; C234-G238 CarbonylContact O-C 3.5Å; C234-G238 WeakPolarHBondContact O-CA 3.28Å; C234-G238 PolarHBondContact O-N 3.01Å; G238-H240 PolarHBondContact O-N 3.39Å; G238-A241 PolarHBondContact O-N 2.81Å
239	S	79.3	Confident	86.1	Confident	71 Å²	71	58.6 Å²	58.6	50%	0.497	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-0.3	-175.8	74.6	0	0	0	0	115.1
240	H	83.9	Confident	86.2	Confident	0 Å²	0	60 Å²	60	0%	0	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	15.6	-179.5	-61.3	-94.7	0	0	0	113.2	C223 C226 R228 C234 K235 G238 N242 H243	C223-H240 PolarHBondContact SG-ND1 3.18Å; C223-H240 VanDerWaalsContact SG-ND1 3.42Å; C226-H240 PolarHBondContact SG-CE1 3.05Å; R228-H240 PolarHBondContact NE-CE1 2.98Å; R228-H240 PolarHBondContact NE-NE2 2.97Å; R228-H240 PolarHBondContact NH2-NE2 3.45Å; C234-H240 CarbonylContact O-C 3.55Å; C234-H240 WeakPolarHBondContact O-CA 3.32Å; C234-H240 WeakPolarHBondContact O-CB 3.22Å; C234-H240 PolarHBondContact O-N 3.22Å; C234-H240 VanDerWaalsContact O-N 3.16Å; K235-H240 WeakPolarHBondContact CD-O 3.44Å; G238-H240 PolarHBondContact O-N 3.39Å; H240-N242 PolarHBondContact O-N 3.06Å; H240-H243 HydrophobicContact CB-CB 4.35Å; H240-H243 AromaticContact CE1-ND1 3.97Å; H240-H243 AromaticContact CG-ND1 3.78Å; H240-H243 AromaticContact ND1-CE1 3.97Å; H240-H243 AromaticContact ND1-ND1 3.09Å; H240-H243 PolarHBondContact ND1-ND1 3.31Å; H240-H243 PolarHBondContact O-N 3.34Å; H240-H243 VanDerWaalsContact O-N 3.13Å
241	A	84.8	Confident	86.2	Confident	40 Å²	40	60.1 Å²	60.1	33%	0.331	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-41.9	178.8	0	0	0	0	0	112.5	K235 G238	K235-A241 PolarHBondContact NZ-O 3.37Å; K235-A241 WeakPolarHBondContact O-CA 3.27Å; G238-A241 PolarHBondContact O-N 2.81Å
242	N	86.1	Confident	86.2	Confident	160 Å²	160	66.8 Å²	66.8	86%	0.856	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	0.6	-177.5	-62.9	-23.7	0	0	0	114.3	H240	H240-N242 PolarHBondContact O-N 3.06Å
243	H	90.9	Very high	86.5	Confident	52 Å²	52	69.8 Å²	69.8	24%	0.241	40%	0.396	C	S	.	.	S	Bend	trans	-87	149.2	179.8	-65.3	157.6	0	0	0	112.2	C223 V225 C226 K235 H240 V245	C223-H243 WeakPolarHBondContact SG-CB 3.34Å; V225-H243 HydrophobicContact CB-CB 4.19Å; V225-H243 HydrophobicContact CG2-CB 4.1Å; C226-H243 PolarHBondContact SG-CE1 3.08Å; C226-H243 PolarHBondContact SG-ND1 3.33Å; K235-H243 PolarHBondContact NZ-O 2.91Å; H240-H243 HydrophobicContact CB-CB 4.35Å; H240-H243 AromaticContact CE1-ND1 3.97Å; H240-H243 AromaticContact CG-ND1 3.78Å; H240-H243 AromaticContact ND1-CE1 3.97Å; H240-H243 AromaticContact ND1-ND1 3.09Å; H240-H243 PolarHBondContact ND1-ND1 3.31Å; H240-H243 PolarHBondContact O-N 3.34Å; H240-H243 VanDerWaalsContact O-N 3.13Å; H243-V245 PolarHBondContact O-N 3.09Å
244	K	88.4	Confident	86.7	Confident	128 Å²	128	71.8 Å²	71.8	56%	0.557	41%	0.406	S	S	*	.			trans	-69.1	121.6	168.4	-173	177.5	172.6	-149.4	0	109.2	E224	E224-K244 PolarHBondContact N-O 3.26Å; E224-K244 IonicContact OE1-NZ 3.79Å; E224-K244 PolarHBondContact OE1-NZ 3.17Å; E224-K244 VanDerWaalsContact OE2-CD 3.27Å; E224-K244 WeakPolarHBondContact OE2-CD 3.45Å; E224-K244 WeakPolarHBondContact OE2-CE 3.28Å; E224-K244 IonicContact OE2-NZ 2.81Å; E224-K244 PolarHBondContact OE2-NZ 3.38Å
245	V	90.2	Very high	86.9	Confident	26 Å²	26	75.8 Å²	75.8	16%	0.158	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	133.1	-177.1	-178.8	0	0	0	0	108.9	M221 Y222 C223 V230 K235 H243	M221-V245 HydrophobicContact CB-CG1 3.52Å; M221-V245 HydrophobicContact CE-CB 4.41Å; M221-V245 HydrophobicContact CE-CG1 3.59Å; M221-V245 HydrophobicContact CG-CG1 4.26Å; Y222-V245 CarbonylContact O-C 3.55Å; Y222-V245 VanDerWaalsContact O-CA 3.27Å; Y222-V245 WeakPolarHBondContact O-CA 3.45Å; Y222-V245 WeakPolarHBondContact O-CG1 3.32Å; C223-V245 HydrophobicContact CB-CG2 4.22Å; V230-V245 HydrophobicContact CG2-CG1 4Å; V230-V245 HydrophobicContact CG2-CG2 4.44Å; K235-V245 HydrophobicContact CD-CB 4.38Å; K235-V245 HydrophobicContact CD-CG2 3.95Å; H243-V245 PolarHBondContact O-N 3.09Å
246	T	90.6	Very high	87.2	Confident	38 Å²	38	78 Å²	78	23%	0.233	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	167.1	177.6	46.8	0	0	0	0	111.5	M221 Y222 E224	M221-T246 WeakPolarHBondContact CA-O 3.39Å; Y222-T246 PolarHBondContact N-O 2.73Å; Y222-T246 PolarHBondContact O-N 2.91Å; E224-T246 WeakPolarHBondContact OE1-CG2 3.4Å
247	S	90.7	Very high	87.7	Confident	48 Å²	48	75.7 Å²	75.7	34%	0.336	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	145.6	175.6	83.6	0	0	0	0	111	S249 S250 A251	S247-S249 PolarHBondContact O-N 2.85Å; S247-S250 PolarHBondContact O-N 2.9Å; S247-S250 WeakPolarHBondContact OG-CB 3.5Å; S247-S250 PolarHBondContact OG-N 2.86Å; S247-S250 VanDerWaalsContact OG-N 3.16Å; S247-S250 PolarHBondContact OG-OG 3.42Å; S247-A251 PolarHBondContact O-N 2.93Å; S247-A251 VanDerWaalsContact O-N 3.15Å
248	M	89.1	Confident	88.6	Confident	63 Å²	63	79 Å²	79	31%	0.31	42%	0.416	S	S	.	.	H	α-helix	trans	-56.6	-37.3	175.6	-168.7	61	63.9	0	0	112.2	N220 M221 P229 A251 Y252	N220-M248 VanDerWaalsContact O-CB 3.26Å; N220-M248 WeakPolarHBondContact O-CB 3.17Å; N220-M248 PolarHBondContact O-N 3.35Å; M221-M248 VanDerWaalsContact O-CE 3.27Å; M221-M248 WeakPolarHBondContact O-CE 3.28Å; P229-M248 HydrophobicContact CB-CE 3.82Å; M248-A251 PolarHBondContact O-N 2.94Å; M248-Y252 VanDerWaalsContact O-CB 3.27Å; M248-Y252 WeakPolarHBondContact O-CB 3.49Å; M248-Y252 PolarHBondContact O-N 3.34Å
249	S	88.6	Confident	89.2	Confident	95 Å²	95	83.1 Å²	83.1	66%	0.664	43%	0.431	S	S	*	.	H	α-helix	trans	-63.8	-42.2	-179.4	-53.3	0	0	0	0	112.6	S247 K253	S247-S249 PolarHBondContact O-N 2.85Å; S249-K253 PolarHBondContact O-N 3.38Å
250	S	89.8	Confident	89.8	Confident	62 Å²	62	81.7 Å²	81.7	43%	0.434	42%	0.424	S	S	.	.	H	α-helix	trans	-67.1	-46.8	176.7	-56.6	0	0	0	0	111.3	S247 Y252 K253 I254	S247-S250 PolarHBondContact O-N 2.9Å; S247-S250 WeakPolarHBondContact OG-CB 3.5Å; S247-S250 PolarHBondContact OG-N 2.86Å; S247-S250 VanDerWaalsContact OG-N 3.16Å; S247-S250 PolarHBondContact OG-OG 3.42Å; S250-Y252 VanDerWaalsContact C-N 3.33Å; S250-Y252 PolarHBondContact O-N 3.49Å; S250-K253 PolarHBondContact O-N 3.35Å; S250-I254 WeakPolarHBondContact O-CG1 3.38Å; S250-I254 PolarHBondContact O-N 3.46Å
251	A	89.3	Confident	90.2	Very high	7 Å²	7	87.9 Å²	87.9	6%	0.058	45%	0.451	C	S	.	.	H	α-helix	trans	-61.7	-41	177.9	0	0	0	0	0	112	Y222 S247 M248 K253 I254 L255	Y222-A251 HydrophobicContact CD1-CB 3.82Å; Y222-A251 HydrophobicContact CD2-CB 4.41Å; Y222-A251 HydrophobicContact CG-CB 3.67Å; S247-A251 PolarHBondContact O-N 2.93Å; S247-A251 VanDerWaalsContact O-N 3.15Å; M248-A251 PolarHBondContact O-N 2.94Å; A251-K253 PolarHBondContact O-N 3.41Å; A251-I254 PolarHBondContact O-N 3.09Å; A251-L255 WeakPolarHBondContact O-CB 3.48Å; A251-L255 WeakPolarHBondContact O-CG 3.44Å; A251-L255 PolarHBondContact O-N 2.78Å
252	Y	90	Very high	90.6	Very high	140 Å²	140	89 Å²	89	55%	0.549	46%	0.456	S	S	.	.	H	α-helix	trans	-55.8	-50	174.4	169.6	-95.8	0	0	0	112	M248 S250 I254 K256	M248-Y252 VanDerWaalsContact O-CB 3.27Å; M248-Y252 WeakPolarHBondContact O-CB 3.49Å; M248-Y252 PolarHBondContact O-N 3.34Å; S250-Y252 VanDerWaalsContact C-N 3.33Å; S250-Y252 PolarHBondContact O-N 3.49Å; Y252-I254 PolarHBondContact O-N 2.98Å; Y252-K256 HydrophobicContact CE1-CD 3.93Å; Y252-K256 HydrophobicContact CE2-CD 4.27Å; Y252-K256 WeakPolarHBondContact O-CB 3.46Å; Y252-K256 PolarHBondContact O-N 2.99Å; Y252-K256 WeakPolarHBondContact OH-CD 3.42Å; Y252-K256 PolarHBondContact OH-NZ 3.09Å
253	K	92.3	Very high	90.8	Very high	149 Å²	149	85.2 Å²	85.2	65%	0.648	44%	0.435	S	S	*	.	H	α-helix	trans	-61.1	-47.6	-178.3	-172.3	-179.8	178.2	-176.2	0	111.2	S249 S250 A251 E257	S249-K253 PolarHBondContact O-N 3.38Å; S250-K253 PolarHBondContact O-N 3.35Å; A251-K253 PolarHBondContact O-N 3.41Å; K253-E257 WeakPolarHBondContact O-CB 3.32Å; K253-E257 PolarHBondContact O-N 3.01Å
254	I	90.6	Very high	90.7	Very high	114 Å²	114	89.1 Å²	89.1	59%	0.585	45%	0.453	S	S	*	.	H	α-helix	trans	-64.9	-49.5	-178.2	-64.6	168.7	0	0	0	111.1	S250 A251 Y252 K256 E257 K258	S250-I254 WeakPolarHBondContact O-CG1 3.38Å; S250-I254 PolarHBondContact O-N 3.46Å; A251-I254 PolarHBondContact O-N 3.09Å; Y252-I254 PolarHBondContact O-N 2.98Å; I254-K256 PolarHBondContact O-N 3.45Å; I254-E257 PolarHBondContact O-N 3.17Å; I254-K258 WeakPolarHBondContact O-CB 3.19Å; I254-K258 PolarHBondContact O-N 3.29Å
255	L	89.4	Confident	90.9	Very high	85 Å²	85	90 Å²	90	45%	0.445	45%	0.454	S	S	.	.	H	α-helix	trans	-66	-38.9	-178.8	-71	173.1	0	0	0	111.8	Y222 A251 K258 L259	Y222-L255 HydrophobicContact CE2-CD1 4.36Å; A251-L255 WeakPolarHBondContact O-CB 3.48Å; A251-L255 WeakPolarHBondContact O-CG 3.44Å; A251-L255 PolarHBondContact O-N 2.78Å; L255-K258 PolarHBondContact O-N 3.18Å; L255-L259 VanDerWaalsContact O-CB 3.3Å; L255-L259 WeakPolarHBondContact O-CB 3.37Å; L255-L259 PolarHBondContact O-N 3.37Å
256	K	91.4	Very high	91	Very high	120 Å²	120	94.4 Å²	94.4	52%	0.522	48%	0.476	S	S	.	.	H	α-helix	trans	-63.8	-44.1	176.4	-173.5	177.7	-175.3	-177.2	0	111.8	Y252 I254 A260	Y252-K256 HydrophobicContact CE1-CD 3.93Å; Y252-K256 HydrophobicContact CE2-CD 4.27Å; Y252-K256 WeakPolarHBondContact O-CB 3.46Å; Y252-K256 PolarHBondContact O-N 2.99Å; Y252-K256 WeakPolarHBondContact OH-CD 3.42Å; Y252-K256 PolarHBondContact OH-NZ 3.09Å; I254-K256 PolarHBondContact O-N 3.45Å; K256-A260 WeakPolarHBondContact O-CB 3.43Å; K256-A260 PolarHBondContact O-N 3.12Å
257	E	93.3	Very high	90.9	Very high	95 Å²	95	95.6 Å²	95.6	44%	0.444	48%	0.48	S	S	.	.	H	α-helix	trans	-66.1	-44	177.7	-171.3	-177.1	159.2	0	0	111.7	K253 I254 L259 A260 K261	K253-E257 WeakPolarHBondContact O-CB 3.32Å; K253-E257 PolarHBondContact O-N 3.01Å; I254-E257 PolarHBondContact O-N 3.17Å; E257-L259 PolarHBondContact O-N 3.48Å; E257-A260 PolarHBondContact O-N 3.43Å; E257-K261 WeakPolarHBondContact O-CG 3.4Å; E257-K261 PolarHBondContact O-N 2.95Å; E257-K261 WeakPolarHBondContact OE1-CE 3.39Å; E257-K261 IonicContact OE1-NZ 3.71Å; E257-K261 PolarHBondContact OE1-NZ 3.29Å
258	K	92.4	Very high	90.9	Very high	142 Å²	142	96.9 Å²	96.9	62%	0.617	49%	0.49	S	S	*	.	H	α-helix	trans	-59.9	-46.5	176.6	-173.4	176.4	-179.5	178.4	0	111.5	I254 L255 K261 S262	I254-K258 WeakPolarHBondContact O-CB 3.19Å; I254-K258 PolarHBondContact O-N 3.29Å; L255-K258 PolarHBondContact O-N 3.18Å; K258-K261 PolarHBondContact O-N 2.66Å; K258-S262 PolarHBondContact O-N 2.98Å; K258-S262 PolarHBondContact O-OG 3.11Å
259	L	91.9	Very high	91.1	Very high	110 Å²	110	97.3 Å²	97.3	58%	0.576	49%	0.49	S	S	*	.	H	α-helix	trans	-62.4	-43.8	177.8	-177.5	62	0	0	0	111.5	L255 E257 K261 S262 I263	L255-L259 VanDerWaalsContact O-CB 3.3Å; L255-L259 WeakPolarHBondContact O-CB 3.37Å; L255-L259 PolarHBondContact O-N 3.37Å; E257-L259 PolarHBondContact O-N 3.48Å; L259-K261 PolarHBondContact O-N 2.99Å; L259-S262 PolarHBondContact O-N 2.95Å; L259-I263 HydrophobicContact CD1-CD1 4.03Å; L259-I263 HydrophobicContact CD1-CG1 4.31Å; L259-I263 HydrophobicContact CG-CD1 3.82Å; L259-I263 HydrophobicContact CG-CG1 4.49Å; L259-I263 VanDerWaalsContact O-CG1 3.28Å; L259-I263 WeakPolarHBondContact O-CG1 3.37Å; L259-I263 PolarHBondContact O-N 3.28Å
260	A	91.6	Very high	91.1	Very high	42 Å²	42	97.8 Å²	97.8	35%	0.347	48%	0.482	S	S	.	.	H	α-helix	trans	-60.1	-45.2	176.9	0	0	0	0	0	111.9	K256 E257 I263 H264	K256-A260 WeakPolarHBondContact O-CB 3.43Å; K256-A260 PolarHBondContact O-N 3.12Å; E257-A260 PolarHBondContact O-N 3.43Å; A260-I263 PolarHBondContact O-N 2.83Å; A260-H264 PolarHBondContact O-CD2 3.06Å; A260-H264 PolarHBondContact O-N 2.8Å
261	K	92.6	Very high	91.1	Very high	129 Å²	129	99.8 Å²	99.8	56%	0.561	49%	0.488	S	S	*	.	H	α-helix	trans	-60.8	-45.9	176.3	-73.1	178.1	-175.7	170.2	0	112.1	E257 K258 L259 H264 Y265	E257-K261 WeakPolarHBondContact O-CG 3.4Å; E257-K261 PolarHBondContact O-N 2.95Å; E257-K261 WeakPolarHBondContact OE1-CE 3.39Å; E257-K261 IonicContact OE1-NZ 3.71Å; E257-K261 PolarHBondContact OE1-NZ 3.29Å; K258-K261 PolarHBondContact O-N 2.66Å; L259-K261 PolarHBondContact O-N 2.99Å; K261-H264 PolarHBondContact O-N 3.37Å; K261-Y265 PolarHBondContact O-N 2.75Å
262	S	92.6	Very high	91.3	Very high	63 Å²	63	103.9 Å²	103.9	44%	0.441	51%	0.505	S	S	.	.	H	α-helix	trans	-62.9	-41.2	177.4	-66.1	0	0	0	0	112.5	K258 L259 Y265 L266	K258-S262 PolarHBondContact O-N 2.98Å; K258-S262 PolarHBondContact O-OG 3.11Å; L259-S262 PolarHBondContact O-N 2.95Å; S262-Y265 PolarHBondContact O-N 3.22Å; S262-L266 WeakPolarHBondContact O-CG 3.23Å; S262-L266 PolarHBondContact O-N 3.45Å
263	I	91.4	Very high	91.5	Very high	81 Å²	81	100.8 Å²	100.8	42%	0.415	50%	0.501	S	S	.	.	H	α-helix	trans	-64	-47.1	176.1	-69.9	167.8	0	0	0	110.7	L259 A260 Y265 L266 I267	L259-I263 HydrophobicContact CD1-CD1 4.03Å; L259-I263 HydrophobicContact CD1-CG1 4.31Å; L259-I263 HydrophobicContact CG-CD1 3.82Å; L259-I263 HydrophobicContact CG-CG1 4.49Å; L259-I263 VanDerWaalsContact O-CG1 3.28Å; L259-I263 WeakPolarHBondContact O-CG1 3.37Å; L259-I263 PolarHBondContact O-N 3.28Å; A260-I263 PolarHBondContact O-N 2.83Å; I263-Y265 VanDerWaalsContact C-N 3.27Å; I263-Y265 PolarHBondContact O-N 3.05Å; I263-L266 PolarHBondContact O-N 2.8Å; I263-I267 HydrophobicContact CG2-CD1 3.73Å; I263-I267 HydrophobicContact CG2-CG1 4.39Å; I263-I267 WeakPolarHBondContact O-CG1 3.45Å; I263-I267 PolarHBondContact O-N 2.99Å
264	H	89.6	Confident	91.6	Very high	134 Å²	134	100 Å²	100	62%	0.62	49%	0.494	S	S	*	.	H	α-helix	trans	-59.6	-39	177	-83.6	-64.9	0	0	0	112.4	A260 K261 I267 S268	A260-H264 PolarHBondContact O-CD2 3.06Å; A260-H264 PolarHBondContact O-N 2.8Å; K261-H264 PolarHBondContact O-N 3.37Å; H264-I267 PolarHBondContact O-N 2.83Å; H264-S268 WeakPolarHBondContact O-CB 3.25Å; H264-S268 PolarHBondContact O-N 3.13Å
265	Y	92.1	Very high	91.8	Very high	146 Å²	146	98.9 Å²	98.9	57%	0.573	49%	0.493	S	S	*	.	H	α-helix	trans	-61.2	-48.6	174.1	178.7	-95	0	0	0	111.7	K261 S262 I263 I267 S268 K269	K261-Y265 PolarHBondContact O-N 2.75Å; S262-Y265 PolarHBondContact O-N 3.22Å; I263-Y265 VanDerWaalsContact C-N 3.27Å; I263-Y265 PolarHBondContact O-N 3.05Å; Y265-I267 VanDerWaalsContact C-N 3.34Å; Y265-I267 PolarHBondContact O-N 2.85Å; Y265-S268 PolarHBondContact O-N 2.73Å; Y265-S268 VanDerWaalsContact O-N 3.15Å; Y265-S268 PolarHBondContact O-OG 3.12Å; Y265-K269 HydrophobicContact CD1-CG 4.37Å; Y265-K269 HydrophobicContact CE1-CG 3.98Å; Y265-K269 HydrophobicContact CE2-CG 4.31Å; Y265-K269 WeakPolarHBondContact O-CG 3.35Å; Y265-K269 PolarHBondContact O-N 3.13Å; Y265-K269 VanDerWaalsContact O-N 3.15Å
266	L	90.9	Very high	92.1	Very high	120 Å²	120	100 Å²	100	63%	0.628	50%	0.495	S	S	*	.	H	α-helix	trans	-60.4	-43.1	178.6	-69.3	174.4	0	0	0	112.2	S262 I263 S268 K269 E270	S262-L266 WeakPolarHBondContact O-CG 3.23Å; S262-L266 PolarHBondContact O-N 3.45Å; I263-L266 PolarHBondContact O-N 2.8Å; L266-S268 VanDerWaalsContact C-N 3.34Å; L266-S268 PolarHBondContact O-N 3.37Å; L266-K269 PolarHBondContact O-N 2.64Å; L266-K269 VanDerWaalsContact O-N 3.17Å; L266-E270 PolarHBondContact O-N 2.91Å
267	I	89.4	Confident	92.3	Very high	62 Å²	62	98.4 Å²	98.4	32%	0.318	49%	0.492	S	S	.	.	H	α-helix	trans	-61.8	-43.3	175.5	-65	168.3	0	0	0	110.5	I263 H264 Y265 K269 E270	I263-I267 HydrophobicContact CG2-CD1 3.73Å; I263-I267 HydrophobicContact CG2-CG1 4.39Å; I263-I267 WeakPolarHBondContact O-CG1 3.45Å; I263-I267 PolarHBondContact O-N 2.99Å; H264-I267 PolarHBondContact O-N 2.83Å; Y265-I267 VanDerWaalsContact C-N 3.34Å; Y265-I267 PolarHBondContact O-N 2.85Å; I267-K269 PolarHBondContact O-N 2.86Å; I267-K269 VanDerWaalsContact O-N 3.14Å; I267-E270 WeakPolarHBondContact O-CB 3.32Å; I267-E270 PolarHBondContact O-N 3.03Å
268	S	90.2	Very high	92.5	Very high	76 Å²	76	97.8 Å²	97.8	53%	0.531	50%	0.495	S	S	.	.	H	α-helix	trans	-64.3	-18.9	178.6	75.5	0	0	0	0	114.2	H264 Y265 L266	H264-S268 WeakPolarHBondContact O-CB 3.25Å; H264-S268 PolarHBondContact O-N 3.13Å; Y265-S268 PolarHBondContact O-N 2.73Å; Y265-S268 VanDerWaalsContact O-N 3.15Å; Y265-S268 PolarHBondContact O-OG 3.12Å; L266-S268 VanDerWaalsContact C-N 3.34Å; L266-S268 PolarHBondContact O-N 3.37Å
269	K	92.9	Very high	92.7	Very high	72 Å²	72	95 Å²	95	31%	0.313	48%	0.484	S	S	.	.	H	α-helix	trans	-96.5	-6.4	-179.9	-67.4	-58.5	-171.6	179.7	0	113.7	Y265 L266 I267 D271 Q272 V273	Y265-K269 HydrophobicContact CD1-CG 4.37Å; Y265-K269 HydrophobicContact CE1-CG 3.98Å; Y265-K269 HydrophobicContact CE2-CG 4.31Å; Y265-K269 WeakPolarHBondContact O-CG 3.35Å; Y265-K269 PolarHBondContact O-N 3.13Å; Y265-K269 VanDerWaalsContact O-N 3.15Å; L266-K269 PolarHBondContact O-N 2.64Å; L266-K269 VanDerWaalsContact O-N 3.17Å; I267-K269 PolarHBondContact O-N 2.86Å; I267-K269 VanDerWaalsContact O-N 3.14Å; K269-D271 PolarHBondContact O-N 3.04Å; K269-Q272 VanDerWaalsContact CD-OE1 3.22Å; K269-Q272 WeakPolarHBondContact O-CB 3.37Å; K269-Q272 PolarHBondContact O-N 2.75Å; K269-V273 PolarHBondContact O-N 2.8Å; K269-V273 VanDerWaalsContact O-N 3.12Å
270	E	89.6	Confident	92.9	Very high	105 Å²	105	94.8 Å²	94.8	49%	0.491	48%	0.483	S	S	.	.	H	α-helix	trans	-57.9	-47.4	179.7	-172.1	-176.5	159.3	0	0	112	L266 I267 Q272 V273 R274	L266-E270 PolarHBondContact O-N 2.91Å; I267-E270 WeakPolarHBondContact O-CB 3.32Å; I267-E270 PolarHBondContact O-N 3.03Å; E270-Q272 VanDerWaalsContact C-N 3.31Å; E270-Q272 PolarHBondContact O-N 2.78Å; E270-V273 PolarHBondContact O-N 3.21Å; E270-R274 PolarHBondContact O-N 2.96Å; E270-R274 IonicContact OE1-NH2 3.97Å; E270-R274 PolarHBondContact OE1-NH2 2.84Å
271	D	90	Very high	93.2	Very high	104 Å²	104	96.9 Å²	96.9	56%	0.556	49%	0.488	S	S	*	.	H	α-helix	trans	-64.1	-37.5	179.4	-71.8	-30.2	0	0	0	111.8	K269 V273 R274 T275	K269-D271 PolarHBondContact O-N 3.04Å; D271-V273 PolarHBondContact O-N 2.82Å; D271-R274 WeakPolarHBondContact O-CB 2.96Å; D271-R274 PolarHBondContact O-N 2.98Å; D271-R274 IonicContact OD1-NH1 3.56Å; D271-T275 PolarHBondContact O-N 3.02Å; D271-T275 PolarHBondContact O-OG1 3.47Å; D271-T275 VanDerWaalsContact O-OG1 3.09Å
272	Q	93.7	Very high	93.4	Very high	92 Å²	92	96.1 Å²	96.1	43%	0.43	48%	0.481	S	S	.	.	H	α-helix	trans	-61.5	-45.2	176.4	-177.9	175.7	7.9	0	0	111.4	K269 E270 R274 T275 Q276	K269-Q272 VanDerWaalsContact CD-OE1 3.22Å; K269-Q272 WeakPolarHBondContact O-CB 3.37Å; K269-Q272 PolarHBondContact O-N 2.75Å; E270-Q272 VanDerWaalsContact C-N 3.31Å; E270-Q272 PolarHBondContact O-N 2.78Å; Q272-R274 VanDerWaalsContact C-N 3.32Å; Q272-T275 PolarHBondContact O-N 2.83Å; Q272-Q276 WeakPolarHBondContact O-CG 3.41Å; Q272-Q276 PolarHBondContact O-N 3.32Å
273	V	93.9	Very high	93.6	Very high	76 Å²	76	96.5 Å²	96.5	46%	0.461	48%	0.478	S	S	.	.	H	α-helix	trans	-64.7	-39.8	177.1	175.5	0	0	0	0	110.5	K269 E270 D271 T275 Q276 I277	K269-V273 PolarHBondContact O-N 2.8Å; K269-V273 VanDerWaalsContact O-N 3.12Å; E270-V273 PolarHBondContact O-N 3.21Å; D271-V273 PolarHBondContact O-N 2.82Å; V273-T275 PolarHBondContact O-N 2.73Å; V273-Q276 WeakPolarHBondContact O-CB 3.21Å; V273-Q276 PolarHBondContact O-N 2.81Å; V273-I277 HydrophobicContact CG1-CD1 4.19Å; V273-I277 WeakPolarHBondContact O-CG1 3.49Å; V273-I277 PolarHBondContact O-N 3.45Å
274	R	93.3	Very high	93.8	Very high	132 Å²	132	97 Å²	97	50%	0.498	48%	0.481	S	S	.	.	H	α-helix	trans	-61.5	-43.3	176.1	-167	178.1	-63.2	157.4	4.5	111.9	E270 D271 Q272 Q276 I277 T278	E270-R274 PolarHBondContact O-N 2.96Å; E270-R274 IonicContact OE1-NH2 3.97Å; E270-R274 PolarHBondContact OE1-NH2 2.84Å; D271-R274 WeakPolarHBondContact O-CB 2.96Å; D271-R274 PolarHBondContact O-N 2.98Å; D271-R274 IonicContact OD1-NH1 3.56Å; Q272-R274 VanDerWaalsContact C-N 3.32Å; R274-Q276 VanDerWaalsContact C-N 3.33Å; R274-Q276 PolarHBondContact O-N 2.85Å; R274-I277 PolarHBondContact O-N 2.97Å; R274-T278 PolarHBondContact O-N 3.43Å; R274-T278 PolarHBondContact O-OG1 3.04Å
275	T	94.8	Very high	94.1	Very high	91 Å²	91	93.4 Å²	93.4	56%	0.558	47%	0.471	S	S	*	.	H	α-helix	trans	-62.8	-39.3	174.5	-57.3	0	0	0	0	112.1	D271 Q272 V273 T278 E279	D271-T275 PolarHBondContact O-N 3.02Å; D271-T275 PolarHBondContact O-OG1 3.47Å; D271-T275 VanDerWaalsContact O-OG1 3.09Å; Q272-T275 PolarHBondContact O-N 2.83Å; V273-T275 PolarHBondContact O-N 2.73Å; T275-T278 WeakPolarHBondContact CA-OG1 3.47Å; T275-T278 PolarHBondContact O-N 3.47Å; T275-T278 PolarHBondContact O-OG1 3.38Å; T275-E279 PolarHBondContact O-N 3.12Å
276	Q	96.4	Very high	94.3	Very high	107 Å²	107	90.4 Å²	90.4	50%	0.5	46%	0.462	S	S	.	.	H	α-helix	trans	-63.9	-40.4	175.8	-73.5	175.9	-26.8	0	0	112	Q272 V273 R274 E279 L280	Q272-Q276 WeakPolarHBondContact O-CG 3.41Å; Q272-Q276 PolarHBondContact O-N 3.32Å; V273-Q276 WeakPolarHBondContact O-CB 3.21Å; V273-Q276 PolarHBondContact O-N 2.81Å; R274-Q276 VanDerWaalsContact C-N 3.33Å; R274-Q276 PolarHBondContact O-N 2.85Å; Q276-E279 PolarHBondContact O-N 3.4Å; Q276-L280 WeakPolarHBondContact O-CG 3.48Å; Q276-L280 PolarHBondContact O-N 3.35Å
277	I	96.6	Very high	94.2	Very high	88 Å²	88	89.4 Å²	89.4	45%	0.451	46%	0.461	S	S	.	.	H	α-helix	trans	-60.7	-48.5	174.4	-67.8	166.8	0	0	0	110.3	V273 R274 E279 L280 D281	V273-I277 HydrophobicContact CG1-CD1 4.19Å; V273-I277 WeakPolarHBondContact O-CG1 3.49Å; V273-I277 PolarHBondContact O-N 3.45Å; R274-I277 PolarHBondContact O-N 2.97Å; I277-E279 VanDerWaalsContact C-N 3.26Å; I277-E279 PolarHBondContact O-N 3.1Å; I277-L280 WeakPolarHBondContact O-CB 3.28Å; I277-L280 PolarHBondContact O-N 3.5Å; I277-L280 VanDerWaalsContact O-N 3.13Å; I277-D281 PolarHBondContact O-N 3.38Å
278	T	96.8	Very high	94.5	Very high	82 Å²	82	92 Å²	92	50%	0.503	47%	0.472	S	S	.	.	H	α-helix	trans	-62.6	-33.4	179.6	52.6	0	0	0	0	113.2	R274 T275 R282	R274-T278 PolarHBondContact O-N 3.43Å; R274-T278 PolarHBondContact O-OG1 3.04Å; T275-T278 WeakPolarHBondContact CA-OG1 3.47Å; T275-T278 PolarHBondContact O-N 3.47Å; T275-T278 PolarHBondContact O-OG1 3.38Å; T278-R282 WeakPolarHBondContact O-CB 3.26Å; T278-R282 PolarHBondContact O-N 3.02Å
279	E	96.1	Very high	94.8	Very high	83 Å²	83	94.4 Å²	94.4	39%	0.388	48%	0.475	S	S	.	.	H	α-helix	trans	-71.1	-38.7	175.6	179.7	58.6	-168.2	0	0	111.7	T275 Q276 I277 R282 L283	T275-E279 PolarHBondContact O-N 3.12Å; Q276-E279 PolarHBondContact O-N 3.4Å; I277-E279 VanDerWaalsContact C-N 3.26Å; I277-E279 PolarHBondContact O-N 3.1Å; E279-R282 WeakPolarHBondContact O-CB 3.47Å; E279-R282 PolarHBondContact O-N 3.37Å; E279-R282 IonicContact OE1-CZ 2.74Å; E279-R282 IonicContact OE1-NE 3.45Å; E279-R282 PolarHBondContact OE1-NE 2.94Å; E279-R282 IonicContact OE1-NH2 3.02Å; E279-R282 PolarHBondContact OE1-NH2 3.4Å; E279-R282 IonicContact OE2-CZ 3.65Å; E279-R282 IonicContact OE2-NE 3.77Å; E279-R282 PolarHBondContact OE2-NE 3.46Å; E279-R282 IonicContact OE2-NH2 3.89Å; E279-L283 HydrophobicContact CG-CD1 4.49Å; E279-L283 WeakPolarHBondContact O-CG 3.48Å; E279-L283 PolarHBondContact O-N 3.05Å
280	L	97.1	Very high	94.7	Very high	106 Å²	106	95.3 Å²	95.3	56%	0.555	48%	0.483	S	S	*	.	H	α-helix	trans	-63.4	-44.2	173.1	-71.8	171.2	0	0	0	111.4	Q276 I277 R282 L283 I284	Q276-L280 WeakPolarHBondContact O-CG 3.48Å; Q276-L280 PolarHBondContact O-N 3.35Å; I277-L280 WeakPolarHBondContact O-CB 3.28Å; I277-L280 PolarHBondContact O-N 3.5Å; I277-L280 VanDerWaalsContact O-N 3.13Å; L280-R282 VanDerWaalsContact C-N 3.29Å; L280-R282 PolarHBondContact O-N 3.49Å; L280-L283 PolarHBondContact O-N 2.88Å; L280-I284 VanDerWaalsContact O-CG1 3.29Å; L280-I284 WeakPolarHBondContact O-CG1 3.28Å; L280-I284 PolarHBondContact O-N 3.24Å
281	D	97.2	Very high	94.7	Very high	85 Å²	85	92.3 Å²	92.3	46%	0.455	48%	0.48	S	S	.	.	H	α-helix	trans	-59.3	-42.1	175.9	-70.1	-31.9	0	0	0	111.2	I277 L283 I284 S285	I277-D281 PolarHBondContact O-N 3.38Å; D281-L283 PolarHBondContact O-N 2.86Å; D281-I284 PolarHBondContact O-N 2.95Å; D281-S285 PolarHBondContact O-N 3.4Å; D281-S285 PolarHBondContact O-OG 3.43Å
282	R	96.7	Very high	94.9	Very high	113 Å²	113	92.9 Å²	92.9	43%	0.426	48%	0.479	S	S	.	.	H	α-helix	trans	-60.9	-44.2	175	-169.3	-165.3	68.4	69.2	0.9	112.1	T278 E279 L280 I284 S285 Q286	T278-R282 WeakPolarHBondContact O-CB 3.26Å; T278-R282 PolarHBondContact O-N 3.02Å; E279-R282 WeakPolarHBondContact O-CB 3.47Å; E279-R282 PolarHBondContact O-N 3.37Å; E279-R282 IonicContact OE1-CZ 2.74Å; E279-R282 IonicContact OE1-NE 3.45Å; E279-R282 PolarHBondContact OE1-NE 2.94Å; E279-R282 IonicContact OE1-NH2 3.02Å; E279-R282 PolarHBondContact OE1-NH2 3.4Å; E279-R282 IonicContact OE2-CZ 3.65Å; E279-R282 IonicContact OE2-NE 3.77Å; E279-R282 PolarHBondContact OE2-NE 3.46Å; E279-R282 IonicContact OE2-NH2 3.89Å; L280-R282 VanDerWaalsContact C-N 3.29Å; L280-R282 PolarHBondContact O-N 3.49Å; R282-I284 VanDerWaalsContact C-N 3.33Å; R282-S285 PolarHBondContact O-N 3.34Å; R282-Q286 WeakPolarHBondContact O-CB 3.31Å; R282-Q286 PolarHBondContact O-N 3.39Å
283	L	96	Very high	94.8	Very high	72 Å²	72	91.9 Å²	91.9	38%	0.377	48%	0.476	S	S	.	.	H	α-helix	trans	-65.7	-36.8	177.9	-72.5	172.1	0	0	0	112	E279 L280 D281 T287	E279-L283 HydrophobicContact CG-CD1 4.49Å; E279-L283 WeakPolarHBondContact O-CG 3.48Å; E279-L283 PolarHBondContact O-N 3.05Å; L280-L283 PolarHBondContact O-N 2.88Å; D281-L283 PolarHBondContact O-N 2.86Å; L283-T287 WeakPolarHBondContact O-CB 3.48Å; L283-T287 PolarHBondContact O-N 3.36Å; L283-T287 PolarHBondContact O-OG1 3.4Å
284	I	96.3	Very high	94.2	Very high	91 Å²	91	90.9 Å²	90.9	47%	0.467	48%	0.476	S	S	.	.	H	α-helix	trans	-61.7	-54.2	174	-69.2	164.6	0	0	0	109.6	L280 D281 R282 Q286 T287 E288	L280-I284 VanDerWaalsContact O-CG1 3.29Å; L280-I284 WeakPolarHBondContact O-CG1 3.28Å; L280-I284 PolarHBondContact O-N 3.24Å; D281-I284 PolarHBondContact O-N 2.95Å; R282-I284 VanDerWaalsContact C-N 3.33Å; I284-Q286 VanDerWaalsContact C-N 3.31Å; I284-Q286 PolarHBondContact O-N 3.46Å; I284-T287 PolarHBondContact O-N 2.97Å; I284-T287 VanDerWaalsContact O-N 3.09Å; I284-E288 WeakPolarHBondContact O-CG 3.31Å; I284-E288 PolarHBondContact O-N 2.9Å
285	S	96.5	Very high	94	Very high	59 Å²	59	91.4 Å²	91.4	41%	0.413	48%	0.484	S	S	.	.	H	α-helix	trans	-56.1	-44.9	177.8	-62.1	0	0	0	0	112.3	D281 R282 T287 E288 E289	D281-S285 PolarHBondContact O-N 3.4Å; D281-S285 PolarHBondContact O-OG 3.43Å; R282-S285 PolarHBondContact O-N 3.34Å; S285-T287 VanDerWaalsContact C-N 3.3Å; S285-T287 PolarHBondContact O-N 2.85Å; S285-E288 PolarHBondContact O-N 3.48Å; S285-E289 WeakPolarHBondContact O-CG 3.5Å; S285-E289 PolarHBondContact O-N 3.02Å
286	Q	95.2	Very high	93.9	Very high	82 Å²	82	94.5 Å²	94.5	38%	0.383	49%	0.486	S	S	.	.	H	α-helix	trans	-63.5	-37.2	179.3	-173.9	175.3	9.7	0	0	112.2	R282 I284 N290	R282-Q286 WeakPolarHBondContact O-CB 3.31Å; R282-Q286 PolarHBondContact O-N 3.39Å; I284-Q286 VanDerWaalsContact C-N 3.31Å; I284-Q286 PolarHBondContact O-N 3.46Å; Q286-N290 VanDerWaalsContact O-CB 3.3Å; Q286-N290 WeakPolarHBondContact O-CB 3.37Å; Q286-N290 PolarHBondContact O-N 2.88Å; Q286-N290 PolarHBondContact O-ND2 3.35Å
287	T	90.1	Very high	93.4	Very high	99 Å²	99	94.2 Å²	94.2	61%	0.607	49%	0.485	S	S	*	.	H	α-helix	trans	-67.8	-40.5	177.3	-57	0	0	0	0	111	L283 I284 S285 G291	L283-T287 WeakPolarHBondContact O-CB 3.48Å; L283-T287 PolarHBondContact O-N 3.36Å; L283-T287 PolarHBondContact O-OG1 3.4Å; I284-T287 PolarHBondContact O-N 2.97Å; I284-T287 VanDerWaalsContact O-N 3.09Å; S285-T287 VanDerWaalsContact C-N 3.3Å; S285-T287 PolarHBondContact O-N 2.85Å; T287-G291 PolarHBondContact O-N 2.88Å
288	E	95.8	Very high	92.8	Very high	117 Å²	117	92.3 Å²	92.3	55%	0.547	48%	0.482	S	S	.	.	H	α-helix	trans	-63.2	-47.6	175.6	-69.5	178	168.5	0	0	111.8	I284 S285 G291 Q292	I284-E288 WeakPolarHBondContact O-CG 3.31Å; I284-E288 PolarHBondContact O-N 2.9Å; S285-E288 PolarHBondContact O-N 3.48Å; E288-G291 PolarHBondContact O-N 2.95Å; E288-Q292 WeakPolarHBondContact O-CG 3.49Å; E288-Q292 PolarHBondContact O-N 2.93Å
289	E	95.5	Very high	92.5	Very high	127 Å²	127	92.8 Å²	92.8	59%	0.593	48%	0.481	S	S	*	.	H	α-helix	trans	-61.6	-45.1	177.8	-72.9	176.4	-173.5	0	0	112.2	S285 G291 Q292 L293	S285-E289 WeakPolarHBondContact O-CG 3.5Å; S285-E289 PolarHBondContact O-N 3.02Å; E289-G291 VanDerWaalsContact C-N 3.34Å; E289-G291 PolarHBondContact O-N 3.38Å; E289-Q292 PolarHBondContact O-N 3.08Å; E289-L293 PolarHBondContact O-N 2.72Å
290	N	91.8	Very high	92.4	Very high	91 Å²	91	94.1 Å²	94.1	49%	0.487	49%	0.488	S	S	.	.	H	α-helix	trans	-64.2	-39.5	176.9	-72.8	-14.3	0	0	0	111.8	Q286 L293 A294	Q286-N290 VanDerWaalsContact O-CB 3.3Å; Q286-N290 WeakPolarHBondContact O-CB 3.37Å; Q286-N290 PolarHBondContact O-N 2.88Å; Q286-N290 PolarHBondContact O-ND2 3.35Å; N290-L293 PolarHBondContact O-N 3.19Å; N290-A294 PolarHBondContact O-N 2.93Å
291	G	88.1	Confident	91.9	Very high	41 Å²	41	94.2 Å²	94.2	42%	0.423	49%	0.485	S	S	.	.	H	α-helix	trans	-61.1	-46.3	174.9	0	0	0	0	0	111.9	T287 E288 E289 L293 A294 E295	T287-G291 PolarHBondContact O-N 2.88Å; E288-G291 PolarHBondContact O-N 2.95Å; E289-G291 VanDerWaalsContact C-N 3.34Å; E289-G291 PolarHBondContact O-N 3.38Å; G291-L293 VanDerWaalsContact C-N 3.33Å; G291-L293 PolarHBondContact O-N 3.22Å; G291-A294 PolarHBondContact O-N 2.82Å; G291-E295 PolarHBondContact O-N 3.32Å
292	Q	94.4	Very high	91.5	Very high	117 Å²	117	93.9 Å²	93.9	55%	0.547	48%	0.48	S	S	.	.	H	α-helix	trans	-64.3	-35.3	176.1	-70.7	174.2	16.3	0	0	112.7	E288 E289 R296	E288-Q292 WeakPolarHBondContact O-CG 3.49Å; E288-Q292 PolarHBondContact O-N 2.93Å; E289-Q292 PolarHBondContact O-N 3.08Å; Q292-R296 WeakPolarHBondContact O-CG 3.45Å; Q292-R296 PolarHBondContact O-N 3.18Å; Q292-R296 VanDerWaalsContact O-N 3.09Å
293	L	91.7	Very high	91.4	Very high	70 Å²	70	92.8 Å²	92.8	37%	0.366	48%	0.479	S	S	.	.	H	α-helix	trans	-64.1	-49.5	173.9	178.7	62.5	0	0	0	111	E289 N290 G291 E295 R296 E297	E289-L293 PolarHBondContact O-N 2.72Å; N290-L293 PolarHBondContact O-N 3.19Å; G291-L293 VanDerWaalsContact C-N 3.33Å; G291-L293 PolarHBondContact O-N 3.22Å; L293-E295 VanDerWaalsContact C-N 3.27Å; L293-E295 PolarHBondContact O-N 3.22Å; L293-R296 PolarHBondContact O-N 2.73Å; L293-R296 VanDerWaalsContact O-N 3.14Å; L293-E297 HydrophobicContact CD1-CG 4.24Å; L293-E297 HydrophobicContact CG-CG 4.46Å; L293-E297 WeakPolarHBondContact O-CG 3.25Å; L293-E297 PolarHBondContact O-N 2.94Å
294	A	82.4	Confident	91.3	Very high	55 Å²	55	94.5 Å²	94.5	46%	0.455	48%	0.481	S	S	.	.	H	α-helix	trans	-59.8	-38.5	178.9	0	0	0	0	0	112.2	N290 G291 A298	N290-A294 PolarHBondContact O-N 2.93Å; G291-A294 PolarHBondContact O-N 2.82Å; A294-A298 WeakPolarHBondContact O-CB 3.41Å; A294-A298 PolarHBondContact O-N 3.41Å
295	E	88.1	Confident	91.1	Very high	144 Å²	144	93.4 Å²	93.4	67%	0.673	48%	0.476	S	S	*	.	H	α-helix	trans	-63.2	-45.9	174.5	-172.9	178.6	176.2	0	0	112	G291 L293 A298 N299	G291-E295 PolarHBondContact O-N 3.32Å; L293-E295 VanDerWaalsContact C-N 3.27Å; L293-E295 PolarHBondContact O-N 3.22Å; E295-A298 PolarHBondContact O-N 3.43Å; E295-N299 PolarHBondContact O-N 2.78Å
296	R	92.8	Very high	90.9	Very high	156 Å²	156	96.7 Å²	96.7	59%	0.589	48%	0.483	S	S	*	.	H	α-helix	trans	-63	-45.8	177.2	-76.2	-171.7	-66	155.4	-1.4	112.2	Q292 L293 A298 N299 E300	Q292-R296 WeakPolarHBondContact O-CG 3.45Å; Q292-R296 PolarHBondContact O-N 3.18Å; Q292-R296 VanDerWaalsContact O-N 3.09Å; L293-R296 PolarHBondContact O-N 2.73Å; L293-R296 VanDerWaalsContact O-N 3.14Å; R296-A298 PolarHBondContact O-N 2.88Å; R296-N299 PolarHBondContact O-N 2.98Å; R296-E300 WeakPolarHBondContact O-CG 3.31Å; R296-E300 PolarHBondContact O-N 2.78Å
297	E	87.1	Confident	91	Very high	101 Å²	101	98.9 Å²	98.9	47%	0.472	49%	0.493	S	S	.	.	H	α-helix	trans	-58.9	-48.3	177.6	-73	-179.4	163.7	0	0	110.6	L293 N299 E300 H301	L293-E297 HydrophobicContact CD1-CG 4.24Å; L293-E297 HydrophobicContact CG-CG 4.46Å; L293-E297 WeakPolarHBondContact O-CG 3.25Å; L293-E297 PolarHBondContact O-N 2.94Å; E297-N299 VanDerWaalsContact C-N 3.31Å; E297-N299 PolarHBondContact O-N 2.87Å; E297-E300 PolarHBondContact O-N 3.09Å; E297-H301 PolarHBondContact O-CD2 3.36Å; E297-H301 PolarHBondContact O-N 2.81Å
298	A	83.8	Confident	91.2	Very high	48 Å²	48	97.8 Å²	97.8	40%	0.397	49%	0.486	S	S	.	.	H	α-helix	trans	-56.6	-45	176.1	0	0	0	0	0	111.7	A294 E295 R296 H301 F302	A294-A298 WeakPolarHBondContact O-CB 3.41Å; A294-A298 PolarHBondContact O-N 3.41Å; E295-A298 PolarHBondContact O-N 3.43Å; R296-A298 PolarHBondContact O-N 2.88Å; A298-H301 WeakPolarHBondContact O-CB 3.49Å; A298-H301 PolarHBondContact O-N 2.8Å; A298-F302 VanDerWaalsContact O-CD2 3.25Å; A298-F302 WeakPolarHBondContact O-CD2 3.47Å; A298-F302 PolarHBondContact O-N 2.95Å
299	N	90.9	Very high	91.1	Very high	92 Å²	92	96.4 Å²	96.4	49%	0.492	48%	0.482	S	S	.	.	H	α-helix	trans	-62.2	-44.5	177.5	-168.3	79.5	0	0	0	112.3	E295 R296 E297 H301 F302 E303	E295-N299 PolarHBondContact O-N 2.78Å; R296-N299 PolarHBondContact O-N 2.98Å; E297-N299 VanDerWaalsContact C-N 3.31Å; E297-N299 PolarHBondContact O-N 2.87Å; N299-H301 PolarHBondContact O-N 2.81Å; N299-F302 PolarHBondContact O-N 2.84Å; N299-F302 VanDerWaalsContact O-N 3.11Å; N299-E303 WeakPolarHBondContact O-CG 3.35Å; N299-E303 PolarHBondContact O-N 2.88Å
300	E	93.1	Very high	91.1	Very high	111 Å²	111	95.3 Å²	95.3	52%	0.519	48%	0.477	S	S	.	.	H	α-helix	trans	-59.2	-35	176	-74.2	-179.5	-176.4	0	0	112.6	R296 E297 R304	R296-E300 WeakPolarHBondContact O-CG 3.31Å; R296-E300 PolarHBondContact O-N 2.78Å; E297-E300 PolarHBondContact O-N 3.09Å; E300-R304 WeakPolarHBondContact O-CG 3.27Å; E300-R304 PolarHBondContact O-N 3.41Å; E300-R304 VanDerWaalsContact O-N 3.14Å; E300-R304 PolarHBondContact O-NE 3.32Å
301	H	87.2	Confident	91.3	Very high	108 Å²	108	97.7 Å²	97.7	50%	0.5	49%	0.485	S	S	.	.	H	α-helix	trans	-64.6	-41.4	174.6	-79.3	-80.8	0	0	0	112.4	E297 A298 N299 R304 L305	E297-H301 PolarHBondContact O-CD2 3.36Å; E297-H301 PolarHBondContact O-N 2.81Å; A298-H301 WeakPolarHBondContact O-CB 3.49Å; A298-H301 PolarHBondContact O-N 2.8Å; N299-H301 PolarHBondContact O-N 2.81Å; H301-R304 PolarHBondContact CD2-NH2 2.8Å; H301-R304 PolarHBondContact CE1-NH1 3.27Å; H301-R304 PolarHBondContact CE1-NH2 2.88Å; H301-R304 PolarHBondContact ND1-NH1 3.1Å; H301-R304 PolarHBondContact ND1-NH2 2.74Å; H301-R304 PolarHBondContact NE2-NH2 2.77Å; H301-L305 PolarHBondContact O-N 2.82Å
302	F	89.1	Confident	91.5	Very high	78 Å²	78	103.9 Å²	103.9	34%	0.342	50%	0.496	S	S	.	.	H	α-helix	trans	-70.5	-40.4	176.7	-77.5	-72.4	0	0	0	112.7	A298 N299 R304 L305 F306 F411	A298-F302 VanDerWaalsContact O-CD2 3.25Å; A298-F302 WeakPolarHBondContact O-CD2 3.47Å; A298-F302 PolarHBondContact O-N 2.95Å; N299-F302 PolarHBondContact O-N 2.84Å; N299-F302 VanDerWaalsContact O-N 3.11Å; F302-R304 VanDerWaalsContact C-N 3.31Å; F302-R304 PolarHBondContact O-N 3Å; F302-L305 HydrophobicContact CD1-CD1 4.35Å; F302-L305 WeakPolarHBondContact O-CB 3.34Å; F302-L305 PolarHBondContact O-N 2.84Å; F302-L305 VanDerWaalsContact O-N 3.09Å; F302-F306 HydrophobicContact CB-CE2 4.31Å; F302-F306 WeakPolarHBondContact O-CD2 3.43Å; F302-F306 PolarHBondContact O-N 2.77Å; F302-F411 HydrophobicContact CE1-CD2 4.31Å; F302-F411 HydrophobicContact CE1-CE1 4.21Å; F302-F411 AromaticContact CE1-CE2 3.69Å; F302-F411 HydrophobicContact CE1-CE2 3.69Å; F302-F411 AromaticContact CE1-CZ 3.63Å; F302-F411 HydrophobicContact CE1-CZ 3.63Å; F302-F411 HydrophobicContact CZ-CD1 4.14Å; F302-F411 AromaticContact CZ-CD2 3.85Å; F302-F411 HydrophobicContact CZ-CD2 3.85Å; F302-F411 AromaticContact CZ-CE1 3.99Å; F302-F411 HydrophobicContact CZ-CE1 3.99Å; F302-F411 AromaticContact CZ-CE2 3.7Å; F302-F411 HydrophobicContact CZ-CE2 3.7Å; F302-F411 HydrophobicContact CZ-CG 4.06Å; F302-F411 AromaticContact CZ-CZ 3.76Å; F302-F411 HydrophobicContact CZ-CZ 3.76Å
303	E	94.6	Very high	91.5	Very high	90 Å²	90	104.1 Å²	104.1	42%	0.421	50%	0.495	S	S	.	.	H	α-helix	trans	-58.4	-42.8	175.4	-71.2	-62.2	164.1	0	0	111.6	N299 L305 F306 E307	N299-E303 WeakPolarHBondContact O-CG 3.35Å; N299-E303 PolarHBondContact O-N 2.88Å; E303-L305 VanDerWaalsContact C-N 3.3Å; E303-L305 PolarHBondContact O-N 2.91Å; E303-F306 PolarHBondContact O-N 2.98Å; E303-F306 VanDerWaalsContact O-N 3.11Å; E303-E307 WeakPolarHBondContact O-CG 3.49Å; E303-E307 PolarHBondContact O-N 3.34Å
304	R	92.9	Very high	91.7	Very high	107 Å²	107	103.6 Å²	103.6	40%	0.404	50%	0.497	S	S	.	.	H	α-helix	trans	-60.8	-35.9	174.9	-77.2	-178	-94.6	111	-5.5	113.3	E300 H301 F302 T308	E300-R304 WeakPolarHBondContact O-CG 3.27Å; E300-R304 PolarHBondContact O-N 3.41Å; E300-R304 VanDerWaalsContact O-N 3.14Å; E300-R304 PolarHBondContact O-NE 3.32Å; H301-R304 PolarHBondContact CD2-NH2 2.8Å; H301-R304 PolarHBondContact CE1-NH1 3.27Å; H301-R304 PolarHBondContact CE1-NH2 2.88Å; H301-R304 PolarHBondContact ND1-NH1 3.1Å; H301-R304 PolarHBondContact ND1-NH2 2.74Å; H301-R304 PolarHBondContact NE2-NH2 2.77Å; F302-R304 VanDerWaalsContact C-N 3.31Å; F302-R304 PolarHBondContact O-N 3Å; R304-T308 PolarHBondContact O-N 3.31Å; R304-T308 VanDerWaalsContact O-N 3.14Å; R304-T308 PolarHBondContact O-OG1 2.82Å
305	L	91.3	Very high	92.3	Very high	69 Å²	69	105.4 Å²	105.4	36%	0.361	50%	0.496	S	S	.	.	H	α-helix	trans	-67	-43.5	173.7	-71.3	172.2	0	0	0	111.2	H301 F302 E303 T308 L309 M409	H301-L305 PolarHBondContact O-N 2.82Å; F302-L305 HydrophobicContact CD1-CD1 4.35Å; F302-L305 WeakPolarHBondContact O-CB 3.34Å; F302-L305 PolarHBondContact O-N 2.84Å; F302-L305 VanDerWaalsContact O-N 3.09Å; E303-L305 VanDerWaalsContact C-N 3.3Å; E303-L305 PolarHBondContact O-N 2.91Å; L305-T308 PolarHBondContact O-N 2.87Å; L305-L309 WeakPolarHBondContact O-CG 3.29Å; L305-L309 PolarHBondContact O-N 2.89Å; L305-L309 VanDerWaalsContact O-N 3.08Å; L305-M409 HydrophobicContact CD1-CE 4.5Å; L305-M409 HydrophobicContact CD1-SD 4.49Å
306	F	93.7	Very high	92.5	Very high	127 Å²	127	102.4 Å²	102.4	56%	0.557	48%	0.483	S	S	*	.	H	α-helix	trans	-62.1	-44.7	176.1	-71	-57.1	0	0	0	112.3	F302 E303 T308 L309 Q310	F302-F306 HydrophobicContact CB-CE2 4.31Å; F302-F306 WeakPolarHBondContact O-CD2 3.43Å; F302-F306 PolarHBondContact O-N 2.77Å; E303-F306 PolarHBondContact O-N 2.98Å; E303-F306 VanDerWaalsContact O-N 3.11Å; F306-T308 VanDerWaalsContact C-N 3.33Å; F306-T308 PolarHBondContact O-N 3.21Å; F306-L309 PolarHBondContact O-N 2.9Å; F306-Q310 VanDerWaalsContact O-CB 3.28Å; F306-Q310 WeakPolarHBondContact O-CB 3.16Å; F306-Q310 PolarHBondContact O-N 3.31Å
307	E	96.3	Very high	92.6	Very high	128 Å²	128	99.8 Å²	99.8	60%	0.598	48%	0.48	S	S	*	.	H	α-helix	trans	-57.8	-46.1	176.6	-74.8	178.2	170.3	0	0	111.5	E303 L309 Q310 E311	E303-E307 WeakPolarHBondContact O-CG 3.49Å; E303-E307 PolarHBondContact O-N 3.34Å; E307-L309 PolarHBondContact O-N 2.88Å; E307-Q310 PolarHBondContact O-N 2.86Å; E307-E311 WeakPolarHBondContact O-CB 3.28Å; E307-E311 PolarHBondContact O-N 3.23Å
308	T	94.4	Very high	93.1	Very high	77 Å²	77	100.5 Å²	100.5	47%	0.472	48%	0.479	S	S	.	.	H	α-helix	trans	-61.3	-45.2	178.4	-56.3	0	0	0	0	111.6	R304 L305 F306 Q310 E311 R312	R304-T308 PolarHBondContact O-N 3.31Å; R304-T308 VanDerWaalsContact O-N 3.14Å; R304-T308 PolarHBondContact O-OG1 2.82Å; L305-T308 PolarHBondContact O-N 2.87Å; F306-T308 VanDerWaalsContact C-N 3.33Å; F306-T308 PolarHBondContact O-N 3.21Å; T308-Q310 VanDerWaalsContact C-N 3.33Å; T308-Q310 PolarHBondContact O-N 3.3Å; T308-E311 PolarHBondContact O-N 2.87Å; T308-R312 WeakPolarHBondContact O-CG 3.22Å; T308-R312 PolarHBondContact O-N 2.76Å; T308-R312 VanDerWaalsContact O-N 3.1Å
309	L	92.9	Very high	93.6	Very high	88 Å²	88	100.6 Å²	100.6	46%	0.461	48%	0.477	S	S	.	.	H	α-helix	trans	-64.4	-39.9	177.2	-72	173.5	0	0	0	111.7	L305 F306 E307 R312 K313 L406	L305-L309 WeakPolarHBondContact O-CG 3.29Å; L305-L309 PolarHBondContact O-N 2.89Å; L305-L309 VanDerWaalsContact O-N 3.08Å; F306-L309 PolarHBondContact O-N 2.9Å; E307-L309 PolarHBondContact O-N 2.88Å; L309-R312 PolarHBondContact O-N 3.46Å; L309-K313 WeakPolarHBondContact O-CB 3.47Å; L309-K313 PolarHBondContact O-N 2.92Å; L309-L406 HydrophobicContact CD1-CD1 4.27Å
310	Q	95.7	Very high	93.8	Very high	103 Å²	103	98.8 Å²	98.8	48%	0.481	47%	0.466	S	S	.	.	H	α-helix	trans	-67.9	-37.1	178.8	-177	61.9	14.1	0	0	112.1	F306 E307 T308 S314	F306-Q310 VanDerWaalsContact O-CB 3.28Å; F306-Q310 WeakPolarHBondContact O-CB 3.16Å; F306-Q310 PolarHBondContact O-N 3.31Å; E307-Q310 PolarHBondContact O-N 2.86Å; T308-Q310 VanDerWaalsContact C-N 3.33Å; T308-Q310 PolarHBondContact O-N 3.3Å; Q310-S314 WeakPolarHBondContact O-CB 3.29Å; Q310-S314 PolarHBondContact O-N 3.5Å; Q310-S314 PolarHBondContact O-OG 3.37Å
311	E	96.6	Very high	94	Very high	142 Å²	142	98 Å²	98	66%	0.664	46%	0.463	S	S	*	.	H	α-helix	trans	-63.6	-48.5	173.9	-173.1	175.6	-162.4	0	0	111.1	E307 T308 K313 S314 E315	E307-E311 WeakPolarHBondContact O-CB 3.28Å; E307-E311 PolarHBondContact O-N 3.23Å; T308-E311 PolarHBondContact O-N 2.87Å; E311-K313 VanDerWaalsContact C-N 3.35Å; E311-K313 PolarHBondContact O-N 3.48Å; E311-S314 WeakPolarHBondContact O-CB 3.43Å; E311-S314 PolarHBondContact O-N 3.41Å; E311-S314 VanDerWaalsContact O-N 3.08Å; E311-E315 PolarHBondContact O-N 2.99Å
312	R	93.1	Very high	94.4	Very high	170 Å²	170	98 Å²	98	64%	0.642	46%	0.463	S	S	*	.	H	α-helix	trans	-58.8	-43.6	176.9	-70.1	-63.7	-169.5	172.9	4.4	112.8	T308 L309 S314 E315 M316	T308-R312 WeakPolarHBondContact O-CG 3.22Å; T308-R312 PolarHBondContact O-N 2.76Å; T308-R312 VanDerWaalsContact O-N 3.1Å; L309-R312 PolarHBondContact O-N 3.46Å; R312-S314 VanDerWaalsContact C-N 3.33Å; R312-S314 PolarHBondContact O-N 3.36Å; R312-E315 IonicContact NH1-OE2 3.94Å; R312-E315 PolarHBondContact O-N 3.01Å; R312-M316 PolarHBondContact O-N 3.08Å; R312-M316 VanDerWaalsContact O-N 3.11Å
313	K	93.4	Very high	94.7	Very high	123 Å²	123	95.3 Å²	95.3	54%	0.535	45%	0.454	S	S	.	.	H	α-helix	trans	-58.2	-46.5	173.4	174.2	-176.9	171.7	-178	0	111.3	L309 E311 M316 L317	L309-K313 WeakPolarHBondContact O-CB 3.47Å; L309-K313 PolarHBondContact O-N 2.92Å; E311-K313 VanDerWaalsContact C-N 3.35Å; E311-K313 PolarHBondContact O-N 3.48Å; K313-M316 PolarHBondContact O-N 3.08Å; K313-L317 HydrophobicContact CG-CD1 4.16Å; K313-L317 WeakPolarHBondContact O-CG 3.2Å; K313-L317 PolarHBondContact O-N 3.31Å; K313-L317 VanDerWaalsContact O-N 3.08Å
314	S	96.1	Very high	94.8	Very high	59 Å²	59	96 Å²	96	41%	0.413	45%	0.453	S	S	.	.	H	α-helix	trans	-65.8	-40	-177.9	-57.8	0	0	0	0	111.7	Q310 E311 R312 L317 R318	Q310-S314 WeakPolarHBondContact O-CB 3.29Å; Q310-S314 PolarHBondContact O-N 3.5Å; Q310-S314 PolarHBondContact O-OG 3.37Å; E311-S314 WeakPolarHBondContact O-CB 3.43Å; E311-S314 PolarHBondContact O-N 3.41Å; E311-S314 VanDerWaalsContact O-N 3.08Å; R312-S314 VanDerWaalsContact C-N 3.33Å; R312-S314 PolarHBondContact O-N 3.36Å; S314-L317 PolarHBondContact O-N 3.01Å; S314-R318 WeakPolarHBondContact O-CB 3.21Å; S314-R318 PolarHBondContact O-N 3.45Å
315	E	95.1	Very high	95	Very high	92 Å²	92	94 Å²	94	43%	0.43	45%	0.45	S	S	.	.	H	α-helix	trans	-61.4	-46	175.9	-172.6	177.6	-158.3	0	0	112.1	E311 R312 R318 S319	E311-E315 PolarHBondContact O-N 2.99Å; R312-E315 IonicContact NH1-OE2 3.94Å; R312-E315 PolarHBondContact O-N 3.01Å; E315-R318 PolarHBondContact O-N 3.39Å; E315-S319 PolarHBondContact O-N 3.47Å
316	M	92.2	Very high	95.2	Very high	82 Å²	82	98.2 Å²	98.2	40%	0.404	46%	0.461	S	S	.	.	H	α-helix	trans	-62.2	-48.2	178.1	-175	63.1	73.2	0	0	111.8	R312 K313 R318 S319 I320 F395 L397	R312-M316 PolarHBondContact O-N 3.08Å; R312-M316 VanDerWaalsContact O-N 3.11Å; K313-M316 PolarHBondContact O-N 3.08Å; M316-R318 VanDerWaalsContact C-N 3.3Å; M316-R318 PolarHBondContact O-N 3.36Å; M316-S319 WeakPolarHBondContact O-CB 3.24Å; M316-S319 PolarHBondContact O-N 3.44Å; M316-S319 VanDerWaalsContact O-N 3.12Å; M316-I320 HydrophobicContact CG-CD1 4.3Å; M316-I320 WeakPolarHBondContact O-CG1 3.23Å; M316-I320 PolarHBondContact O-N 2.92Å; M316-F395 HydrophobicContact SD-CD1 4.32Å; M316-L397 HydrophobicContact CE-CD1 4.46Å
317	L	95.2	Very high	95.3	Very high	100 Å²	100	93.6 Å²	93.6	52%	0.524	44%	0.44	S	S	.	.	H	α-helix	trans	-60.7	-40.4	178.3	-70.9	176	0	0	0	111.9	K313 S314 S319 I320 E321	K313-L317 HydrophobicContact CG-CD1 4.16Å; K313-L317 WeakPolarHBondContact O-CG 3.2Å; K313-L317 PolarHBondContact O-N 3.31Å; K313-L317 VanDerWaalsContact O-N 3.08Å; S314-L317 PolarHBondContact O-N 3.01Å; L317-S319 VanDerWaalsContact C-N 3.33Å; L317-S319 PolarHBondContact O-N 3Å; L317-I320 PolarHBondContact O-N 3.43Å; L317-E321 WeakPolarHBondContact O-CB 3.19Å; L317-E321 PolarHBondContact O-N 2.89Å
318	R	96.6	Very high	95.3	Very high	117 Å²	117	90.7 Å²	90.7	44%	0.442	43%	0.428	S	S	.	.	H	α-helix	trans	-61.4	-41	175	-176.7	-176.3	59.3	70.4	-1	111.7	S314 E315 M316 E321 Q322	S314-R318 WeakPolarHBondContact O-CB 3.21Å; S314-R318 PolarHBondContact O-N 3.45Å; E315-R318 PolarHBondContact O-N 3.39Å; M316-R318 VanDerWaalsContact C-N 3.3Å; M316-R318 PolarHBondContact O-N 3.36Å; R318-E321 PolarHBondContact O-N 3.03Å; R318-Q322 VanDerWaalsContact NH1-OE1 3.14Å; R318-Q322 WeakPolarHBondContact O-CB 3.34Å; R318-Q322 VanDerWaalsContact O-CG 3.26Å; R318-Q322 WeakPolarHBondContact O-CG 3.32Å; R318-Q322 PolarHBondContact O-N 3.42Å
319	S	95.7	Very high	95.4	Very high	50 Å²	50	91.9 Å²	91.9	35%	0.35	43%	0.431	S	S	.	.	H	α-helix	trans	-63	-45.1	177	-172.2	0	0	0	0	112	E315 M316 L317 E321 Q322 S323	E315-S319 PolarHBondContact O-N 3.47Å; M316-S319 WeakPolarHBondContact O-CB 3.24Å; M316-S319 PolarHBondContact O-N 3.44Å; M316-S319 VanDerWaalsContact O-N 3.12Å; L317-S319 VanDerWaalsContact C-N 3.33Å; L317-S319 PolarHBondContact O-N 3Å; S319-E321 VanDerWaalsContact C-N 3.34Å; S319-E321 PolarHBondContact O-N 3.28Å; S319-Q322 PolarHBondContact O-N 2.85Å; S319-S323 PolarHBondContact O-N 3.11Å
320	I	95.1	Very high	95.6	Very high	53 Å²	53	90.9 Å²	90.9	27%	0.272	42%	0.424	S	S	.	.	H	α-helix	trans	-60.3	-46.1	175.8	-65.6	167.1	0	0	0	110.4	M316 L317 Q322 S323 R324 F392 F395	M316-I320 HydrophobicContact CG-CD1 4.3Å; M316-I320 WeakPolarHBondContact O-CG1 3.23Å; M316-I320 PolarHBondContact O-N 2.92Å; L317-I320 PolarHBondContact O-N 3.43Å; I320-Q322 PolarHBondContact O-N 3.1Å; I320-S323 PolarHBondContact O-N 3.03Å; I320-R324 VanDerWaalsContact O-CB 3.27Å; I320-R324 WeakPolarHBondContact O-CB 3.47Å; I320-R324 PolarHBondContact O-N 3.2Å; I320-F392 HydrophobicContact CG2-CD1 4.38Å; I320-F392 HydrophobicContact CG2-CE1 4.34Å; I320-F395 HydrophobicContact CD1-CB 4.35Å; I320-F395 HydrophobicContact CD1-CD1 4.18Å; I320-F395 HydrophobicContact CD1-CG 4.38Å; I320-F395 HydrophobicContact CG1-CB 4.24Å; I320-F395 HydrophobicContact CG1-CD1 3.41Å; I320-F395 VanDerWaalsContact CG1-CD1 3.41Å; I320-F395 HydrophobicContact CG1-CD2 4.34Å; I320-F395 HydrophobicContact CG1-CE1 3.7Å; I320-F395 HydrophobicContact CG1-CG 3.75Å; I320-F395 HydrophobicContact CG1-CZ 4.28Å
321	E	96.4	Very high	95.5	Very high	95 Å²	95	88.6 Å²	88.6	44%	0.444	42%	0.415	S	S	.	.	H	α-helix	trans	-62.4	-42.3	178.4	175.5	153.1	-124.1	0	0	112.4	L317 R318 S319 R324 N325	L317-E321 WeakPolarHBondContact O-CB 3.19Å; L317-E321 PolarHBondContact O-N 2.89Å; R318-E321 PolarHBondContact O-N 3.03Å; S319-E321 VanDerWaalsContact C-N 3.34Å; S319-E321 PolarHBondContact O-N 3.28Å; E321-R324 PolarHBondContact O-N 2.94Å; E321-R324 IonicContact OE1-CZ 3.28Å; E321-R324 IonicContact OE1-NH2 2.83Å; E321-R324 PolarHBondContact OE1-NH2 2.94Å; E321-N325 WeakPolarHBondContact O-CB 3.47Å; E321-N325 PolarHBondContact O-N 2.76Å; E321-N325 PolarHBondContact O-ND2 3.47Å; E321-N325 PolarHBondContact O-OD1 2.81Å
322	Q	96.3	Very high	95.5	Very high	107 Å²	107	87.7 Å²	87.7	50%	0.5	41%	0.409	S	S	.	.	H	α-helix	trans	-63.4	-45.7	175.6	-74.7	175.8	-5.8	0	0	111.9	R318 S319 I320 N325 R326	R318-Q322 VanDerWaalsContact NH1-OE1 3.14Å; R318-Q322 WeakPolarHBondContact O-CB 3.34Å; R318-Q322 VanDerWaalsContact O-CG 3.26Å; R318-Q322 WeakPolarHBondContact O-CG 3.32Å; R318-Q322 PolarHBondContact O-N 3.42Å; S319-Q322 PolarHBondContact O-N 2.85Å; I320-Q322 PolarHBondContact O-N 3.1Å; Q322-N325 PolarHBondContact O-N 3.15Å; Q322-R326 WeakPolarHBondContact O-CB 3.42Å; Q322-R326 PolarHBondContact O-N 3.29Å
323	S	95.3	Very high	95.5	Very high	23 Å²	23	81.2 Å²	81.2	16%	0.161	40%	0.395	C	S	.	.	H	α-helix	trans	-61.7	-44.9	176.7	-173.2	0	0	0	0	111.2	S319 I320 N325 R326 R327	S319-S323 PolarHBondContact O-N 3.11Å; I320-S323 PolarHBondContact O-N 3.03Å; S323-N325 PolarHBondContact O-N 3.48Å; S323-R326 PolarHBondContact O-N 2.75Å; S323-R327 VanDerWaalsContact O-CG 3.32Å; S323-R327 WeakPolarHBondContact O-CG 3.46Å; S323-R327 PolarHBondContact O-N 2.81Å
324	R	95.9	Very high	95.4	Very high	104 Å²	104	76.7 Å²	76.7	39%	0.392	38%	0.376	S	S	.	.	H	α-helix	trans	-57.2	-51.5	175	-176.8	-169	69.4	-164.6	-3.5	111.6	I320 E321 R326 R327 I328 F392	I320-R324 VanDerWaalsContact O-CB 3.27Å; I320-R324 WeakPolarHBondContact O-CB 3.47Å; I320-R324 PolarHBondContact O-N 3.2Å; E321-R324 PolarHBondContact O-N 2.94Å; E321-R324 IonicContact OE1-CZ 3.28Å; E321-R324 IonicContact OE1-NH2 2.83Å; E321-R324 PolarHBondContact OE1-NH2 2.94Å; R324-R326 VanDerWaalsContact C-N 3.35Å; R324-R326 PolarHBondContact O-N 2.9Å; R324-R327 PolarHBondContact O-N 2.91Å; R324-I328 HydrophobicContact CG-CD1 3.83Å; R324-I328 WeakPolarHBondContact O-CB 3.25Å; R324-I328 VanDerWaalsContact O-CG1 3.31Å; R324-I328 WeakPolarHBondContact O-CG1 3.3Å; R324-I328 PolarHBondContact O-N 3.4Å; R324-F392 HydrophobicContact CB-CE1 4.07Å; R324-F392 HydrophobicContact CB-CZ 3.79Å; R324-F392 HydrophobicContact CG-CZ 4.1Å
325	N	97	Very high	95.1	Very high	66 Å²	66	77.7 Å²	77.7	35%	0.353	38%	0.379	S	S	.	.	H	α-helix	trans	-62.4	-43.9	-178.2	-67.5	-9.3	0	0	0	110.8	E321 Q322 S323 R327 I328 D329	E321-N325 WeakPolarHBondContact O-CB 3.47Å; E321-N325 PolarHBondContact O-N 2.76Å; E321-N325 PolarHBondContact O-ND2 3.47Å; E321-N325 PolarHBondContact O-OD1 2.81Å; Q322-N325 PolarHBondContact O-N 3.15Å; S323-N325 PolarHBondContact O-N 3.48Å; N325-R327 PolarHBondContact O-N 3.09Å; N325-I328 PolarHBondContact O-N 3.02Å; N325-D329 WeakPolarHBondContact O-CB 3.36Å; N325-D329 PolarHBondContact O-N 3.16Å
326	R	96	Very high	94.9	Very high	157 Å²	157	79.5 Å²	79.5	59%	0.592	39%	0.388	S	S	*	.	H	α-helix	trans	-58.9	-45.2	177.2	-165.7	-176.2	90.5	104.7	-0.7	112.7	Q322 S323 R324 D329 Q330	Q322-R326 WeakPolarHBondContact O-CB 3.42Å; Q322-R326 PolarHBondContact O-N 3.29Å; S323-R326 PolarHBondContact O-N 2.75Å; R324-R326 VanDerWaalsContact C-N 3.35Å; R324-R326 PolarHBondContact O-N 2.9Å; R326-D329 PolarHBondContact O-N 2.87Å; R326-Q330 VanDerWaalsContact O-CG 3.31Å; R326-Q330 WeakPolarHBondContact O-CG 3.45Å; R326-Q330 PolarHBondContact O-N 2.96Å
327	R	96	Very high	94.6	Very high	30 Å²	30	81.4 Å²	81.4	11%	0.113	40%	0.396	C	S	.	.	H	α-helix	trans	-65.3	-43.1	177.7	-69.6	172.1	175	161.6	1.9	111.6	S323 R324 N325 D329 Q330 L331 A388 D389 C391 F392 E394	S323-R327 VanDerWaalsContact O-CG 3.32Å; S323-R327 WeakPolarHBondContact O-CG 3.46Å; S323-R327 PolarHBondContact O-N 2.81Å; R324-R327 PolarHBondContact O-N 2.91Å; N325-R327 PolarHBondContact O-N 3.09Å; R327-D329 VanDerWaalsContact C-N 3.33Å; R327-D329 PolarHBondContact O-N 3.46Å; R327-Q330 PolarHBondContact O-N 2.98Å; R327-L331 WeakPolarHBondContact O-CG 3.38Å; R327-L331 PolarHBondContact O-N 2.84Å; R327-A388 HydrophobicContact CB-CB 4.03Å; R327-A388 HydrophobicContact CG-CB 4.07Å; R327-D389 WeakPolarHBondContact CD-O 3.26Å; R327-C391 VanDerWaalsContact CZ-O 3.29Å; R327-C391 PolarHBondContact NH1-O 2.92Å; R327-F392 VanDerWaalsContact NH1-CD1 3.26Å; R327-F392 VanDerWaalsContact NH1-CE1 3.26Å; R327-E394 IonicContact CZ-OE1 2.82Å; R327-E394 IonicContact NH1-OE1 2.76Å; R327-E394 IonicContact NH2-OE1 3.79Å; R327-E394 PolarHBondContact NH2-OE1 2.94Å; R327-E394 IonicContact NH2-OE2 3.63Å
328	I	96.6	Very high	94	Very high	67 Å²	67	80.1 Å²	80.1	34%	0.344	38%	0.384	S	S	.	.	H	α-helix	trans	-60.1	-44.7	175.4	-72.1	172.8	0	0	0	110.5	R324 N325 L331 K332	R324-I328 HydrophobicContact CG-CD1 3.83Å; R324-I328 WeakPolarHBondContact O-CB 3.25Å; R324-I328 VanDerWaalsContact O-CG1 3.31Å; R324-I328 WeakPolarHBondContact O-CG1 3.3Å; R324-I328 PolarHBondContact O-N 3.4Å; N325-I328 PolarHBondContact O-N 3.02Å; I328-L331 PolarHBondContact O-N 3.38Å; I328-K332 HydrophobicContact CG2-CD 3.85Å; I328-K332 HydrophobicContact CG2-CG 4.23Å; I328-K332 WeakPolarHBondContact O-CB 3.38Å; I328-K332 VanDerWaalsContact O-CG 3.31Å; I328-K332 WeakPolarHBondContact O-CG 3.27Å; I328-K332 PolarHBondContact O-N 3.49Å
329	D	97.1	Very high	93.5	Very high	101 Å²	101	79.7 Å²	79.7	54%	0.54	39%	0.387	S	S	.	.	H	α-helix	trans	-65.4	-40	-179.8	-67.2	-21.2	0	0	0	111.7	N325 R326 R327 K332 G333	N325-D329 WeakPolarHBondContact O-CB 3.36Å; N325-D329 PolarHBondContact O-N 3.16Å; R326-D329 PolarHBondContact O-N 2.87Å; R327-D329 VanDerWaalsContact C-N 3.33Å; R327-D329 PolarHBondContact O-N 3.46Å; D329-K332 PolarHBondContact O-N 3.32Å; D329-G333 PolarHBondContact O-N 3.04Å
330	Q	95.8	Very high	92.8	Very high	67 Å²	67	78.5 Å²	78.5	31%	0.313	38%	0.383	S	S	.	.	H	α-helix	trans	-62.6	-42.8	174	-74	175.9	-36.8	0	0	112.5	R326 R327 Q334 S387 A388	R326-Q330 VanDerWaalsContact O-CG 3.31Å; R326-Q330 WeakPolarHBondContact O-CG 3.45Å; R326-Q330 PolarHBondContact O-N 2.96Å; R327-Q330 PolarHBondContact O-N 2.98Å; Q330-Q334 PolarHBondContact O-N 3.24Å; Q330-S387 PolarHBondContact O-OG 3.21Å; Q330-A388 HydrophobicContact CB-CB 4.26Å
331	L	95	Very high	91.9	Very high	56 Å²	56	78.3 Å²	78.3	29%	0.293	38%	0.382	S	S	.	.	H	α-helix	trans	-70.3	-41	178.6	-70.6	169	0	0	0	111.3	R327 I328 Q334 V335 P386 S387 A388	R327-L331 WeakPolarHBondContact O-CG 3.38Å; R327-L331 PolarHBondContact O-N 2.84Å; I328-L331 PolarHBondContact O-N 3.38Å; L331-Q334 WeakPolarHBondContact O-CB 3.42Å; L331-Q334 PolarHBondContact O-N 3.1Å; L331-V335 WeakPolarHBondContact O-CG2 3.34Å; L331-V335 PolarHBondContact O-N 3.39Å; L331-P386 HydrophobicContact CD2-CB 4.24Å; L331-S387 PolarHBondContact N-OG 3.2Å; L331-A388 HydrophobicContact CD2-CB 4.45Å; L331-A388 HydrophobicContact CG-CB 4.17Å
332	K	95.5	Very high	90.8	Very high	123 Å²	123	80.4 Å²	80.4	54%	0.535	40%	0.395	S	S	.	.	H	α-helix	trans	-61.4	-44.7	173.8	-77.6	178.4	177.7	175.5	0	111.8	I328 D329 Q334 V335 E336	I328-K332 HydrophobicContact CG2-CD 3.85Å; I328-K332 HydrophobicContact CG2-CG 4.23Å; I328-K332 WeakPolarHBondContact O-CB 3.38Å; I328-K332 VanDerWaalsContact O-CG 3.31Å; I328-K332 WeakPolarHBondContact O-CG 3.27Å; I328-K332 PolarHBondContact O-N 3.49Å; D329-K332 PolarHBondContact O-N 3.32Å; K332-Q334 VanDerWaalsContact C-N 3.29Å; K332-Q334 PolarHBondContact O-N 3.06Å; K332-V335 WeakPolarHBondContact O-CA 3.3Å; K332-V335 WeakPolarHBondContact O-CB 3.33Å; K332-V335 PolarHBondContact O-N 3.32Å; K332-V335 VanDerWaalsContact O-N 3.09Å; K332-E336 WeakPolarHBondContact O-CG 3.41Å; K332-E336 PolarHBondContact O-N 3.33Å
333	G	93.4	Very high	89.6	Confident	34 Å²	34	82.8 Å²	82.8	35%	0.351	41%	0.406	S	S	.	.	H	α-helix	trans	-60.4	-39.3	175	0	0	0	0	0	112.4	D329 E336 E337	D329-G333 PolarHBondContact O-N 3.04Å; G333-E336 PolarHBondContact O-N 2.84Å; G333-E337 PolarHBondContact O-N 2.76Å
334	Q	91.3	Very high	88.2	Confident	27 Å²	27	86.6 Å²	86.6	13%	0.126	43%	0.425	C	S	.	.	H	α-helix	trans	-64.6	-40.4	173.1	-169.5	177.3	26.1	0	0	111.6	Q330 L331 K332 E337 Y338 H385 S387	Q330-Q334 PolarHBondContact O-N 3.24Å; L331-Q334 WeakPolarHBondContact O-CB 3.42Å; L331-Q334 PolarHBondContact O-N 3.1Å; K332-Q334 VanDerWaalsContact C-N 3.29Å; K332-Q334 PolarHBondContact O-N 3.06Å; Q334-E337 PolarHBondContact O-N 3.11Å; Q334-Y338 HydrophobicContact CG-CD2 3.95Å; Q334-Y338 HydrophobicContact CG-CE2 3.86Å; Q334-Y338 VanDerWaalsContact O-CD2 3.27Å; Q334-Y338 WeakPolarHBondContact O-CD2 3.33Å; Q334-Y338 PolarHBondContact O-N 2.99Å; Q334-Y338 VanDerWaalsContact O-N 3.08Å; Q334-H385 PolarHBondContact NE2-O 3.39Å; Q334-S387 PolarHBondContact OE1-OG 3.08Å
335	V	90.6	Very high	86.7	Confident	80 Å²	80	85.4 Å²	85.4	49%	0.485	43%	0.433	S	S	.	.	H	α-helix	trans	-60.4	-45.7	174.3	169.8	0	0	0	0	111.1	L331 K332 E337 Y338 Q339	L331-V335 WeakPolarHBondContact O-CG2 3.34Å; L331-V335 PolarHBondContact O-N 3.39Å; K332-V335 WeakPolarHBondContact O-CA 3.3Å; K332-V335 WeakPolarHBondContact O-CB 3.33Å; K332-V335 PolarHBondContact O-N 3.32Å; K332-V335 VanDerWaalsContact O-N 3.09Å; V335-E337 VanDerWaalsContact C-N 3.34Å; V335-E337 PolarHBondContact O-N 3.09Å; V335-Y338 PolarHBondContact O-N 2.87Å; V335-Q339 HydrophobicContact CG1-CG 4.26Å; V335-Q339 WeakPolarHBondContact O-CB 3.35Å; V335-Q339 VanDerWaalsContact O-CG 3.27Å; V335-Q339 WeakPolarHBondContact O-CG 3.32Å; V335-Q339 PolarHBondContact O-N 3.46Å
336	E	90.8	Very high	85.5	Confident	131 Å²	131	84.6 Å²	84.6	61%	0.612	44%	0.44	S	S	*	.	H	α-helix	trans	-61.3	-40.2	177.1	-71.8	173	-168.6	0	0	112.1	K332 G333 Q339 G340	K332-E336 WeakPolarHBondContact O-CG 3.41Å; K332-E336 PolarHBondContact O-N 3.33Å; G333-E336 PolarHBondContact O-N 2.84Å; E336-Q339 PolarHBondContact O-N 3.29Å; E336-G340 PolarHBondContact O-N 3.14Å
337	E	84.5	Confident	84.7	Confident	122 Å²	122	79 Å²	79	57%	0.57	42%	0.421	S	S	*	.	H	α-helix	trans	-61.6	-47.5	175.9	-175.2	-179.3	-174.3	0	0	111.9	G333 Q334 V335 G340 M341	G333-E337 PolarHBondContact O-N 2.76Å; Q334-E337 PolarHBondContact O-N 3.11Å; V335-E337 VanDerWaalsContact C-N 3.34Å; V335-E337 PolarHBondContact O-N 3.09Å; E337-G340 PolarHBondContact O-N 3.5Å; E337-M341 PolarHBondContact O-N 3.23Å
338	Y	84.1	Confident	84	Confident	72 Å²	72	81.8 Å²	81.8	28%	0.282	44%	0.442	S	S	.	.	H	α-helix	trans	-69	-33.7	177.9	-84.2	-100.8	0	0	0	112.2	Q334 V335 M341 L342	Q334-Y338 HydrophobicContact CG-CD2 3.95Å; Q334-Y338 HydrophobicContact CG-CE2 3.86Å; Q334-Y338 VanDerWaalsContact O-CD2 3.27Å; Q334-Y338 WeakPolarHBondContact O-CD2 3.33Å; Q334-Y338 PolarHBondContact O-N 2.99Å; Q334-Y338 VanDerWaalsContact O-N 3.08Å; V335-Y338 PolarHBondContact O-N 2.87Å; Y338-M341 WeakPolarHBondContact O-CB 3.14Å; Y338-M341 PolarHBondContact O-N 2.86Å; Y338-L342 PolarHBondContact O-N 2.83Å; Y338-L342 VanDerWaalsContact O-N 3.09Å
339	Q	85.4	Confident	83.4	Confident	108 Å²	108	80 Å²	80	51%	0.505	44%	0.44	S	S	.	.	H	α-helix	trans	-64.2	-45.6	171.4	-76.6	175.7	-10.2	0	0	111.2	V335 E336 M341 L342 E343	V335-Q339 HydrophobicContact CG1-CG 4.26Å; V335-Q339 WeakPolarHBondContact O-CB 3.35Å; V335-Q339 VanDerWaalsContact O-CG 3.27Å; V335-Q339 WeakPolarHBondContact O-CG 3.32Å; V335-Q339 PolarHBondContact O-N 3.46Å; E336-Q339 PolarHBondContact O-N 3.29Å; Q339-M341 VanDerWaalsContact C-N 3.3Å; Q339-M341 PolarHBondContact O-N 2.86Å; Q339-L342 WeakPolarHBondContact O-CA 3.38Å; Q339-L342 WeakPolarHBondContact O-CB 3.43Å; Q339-L342 PolarHBondContact O-N 2.89Å; Q339-E343 WeakPolarHBondContact O-CG 3.4Å; Q339-E343 PolarHBondContact O-N 3.42Å
340	G	81.6	Confident	82.9	Confident	25 Å²	25	80.5 Å²	80.5	26%	0.258	44%	0.435	S	S	.	.	H	α-helix	trans	-62.6	-34.5	174.6	0	0	0	0	0	113.1	E336 E337 L342 E343 N344	E336-G340 PolarHBondContact O-N 3.14Å; E337-G340 PolarHBondContact O-N 3.5Å; G340-L342 VanDerWaalsContact C-N 3.31Å; G340-L342 PolarHBondContact O-N 2.85Å; G340-E343 PolarHBondContact O-N 2.78Å; G340-N344 PolarHBondContact O-N 3.42Å; G340-N344 VanDerWaalsContact O-N 3.09Å; G340-N344 PolarHBondContact O-ND2 3.44Å
341	M	76.4	Confident	82.5	Confident	50 Å²	50	78 Å²	78	25%	0.246	43%	0.425	C	S	.	.	H	α-helix	trans	-63	-35.7	169.6	-78	-179.6	42.8	0	0	112.9	E337 Y338 Q339 N344 L381	E337-M341 PolarHBondContact O-N 3.23Å; Y338-M341 WeakPolarHBondContact O-CB 3.14Å; Y338-M341 PolarHBondContact O-N 2.86Å; Q339-M341 VanDerWaalsContact C-N 3.3Å; Q339-M341 PolarHBondContact O-N 2.86Å; M341-N344 WeakPolarHBondContact O-CB 3.45Å; M341-N344 PolarHBondContact O-N 2.87Å; M341-L381 HydrophobicContact CE-CD2 3.79Å; M341-L381 HydrophobicContact CE-CG 3.91Å
342	L	72.9	Confident	82.1	Confident	138 Å²	138	80.8 Å²	80.8	72%	0.723	44%	0.437	S	S	*	.	H	α-helix	trans	-73.1	-37.2	176.7	-168.9	69.2	0	0	0	111.8	Y338 Q339 G340 N344 S345	Y338-L342 PolarHBondContact O-N 2.83Å; Y338-L342 VanDerWaalsContact O-N 3.09Å; Q339-L342 WeakPolarHBondContact O-CA 3.38Å; Q339-L342 WeakPolarHBondContact O-CB 3.43Å; Q339-L342 PolarHBondContact O-N 2.89Å; G340-L342 VanDerWaalsContact C-N 3.31Å; G340-L342 PolarHBondContact O-N 2.85Å; L342-N344 PolarHBondContact O-N 3.13Å; L342-S345 VanDerWaalsContact O-CB 3.28Å; L342-S345 WeakPolarHBondContact O-CB 3.49Å; L342-S345 PolarHBondContact O-N 3.2Å
343	E	70.9	Confident	81.9	Confident	157 Å²	157	80 Å²	80	73%	0.734	44%	0.435	S	S	*	.	H	α-helix	trans	-63.7	-28.9	172.9	-69.6	179.1	174.1	0	0	112.1	Q339 G340 S345	Q339-E343 WeakPolarHBondContact O-CG 3.4Å; Q339-E343 PolarHBondContact O-N 3.42Å; G340-E343 PolarHBondContact O-N 2.78Å; E343-S345 PolarHBondContact O-N 2.88Å
344	N	64.8	Low	81.8	Confident	103 Å²	103	79.1 Å²	79.1	55%	0.551	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	13.5	167	-72.3	-49.2	0	0	0	114.1	G340 M341 L342 G346 L347	G340-N344 PolarHBondContact O-N 3.42Å; G340-N344 VanDerWaalsContact O-N 3.09Å; G340-N344 PolarHBondContact O-ND2 3.44Å; M341-N344 WeakPolarHBondContact O-CB 3.45Å; M341-N344 PolarHBondContact O-N 2.87Å; L342-N344 PolarHBondContact O-N 3.13Å; N344-G346 PolarHBondContact O-N 2.97Å; N344-L347 WeakPolarHBondContact O-CA 3.45Å; N344-L347 WeakPolarHBondContact O-CB 3.33Å; N344-L347 PolarHBondContact O-N 3Å
345	S	64.8	Low	81.8	Confident	80 Å²	80	83.8 Å²	83.8	56%	0.559	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-27.4	166.7	63.2	0	0	0	0	113.4	L342 E343 L347 V348 G349	L342-S345 VanDerWaalsContact O-CB 3.28Å; L342-S345 WeakPolarHBondContact O-CB 3.49Å; L342-S345 PolarHBondContact O-N 3.2Å; E343-S345 PolarHBondContact O-N 2.88Å; S345-L347 PolarHBondContact O-N 3.33Å; S345-V348 WeakPolarHBondContact O-CB 3.44Å; S345-V348 PolarHBondContact O-N 3.47Å; S345-V348 VanDerWaalsContact O-N 3.1Å; S345-G349 PolarHBondContact O-N 2.88Å
346	G	71.7	Confident	82	Confident	49 Å²	49	86.3 Å²	86.3	51%	0.505	45%	0.452	S	S	.	.	H	α-helix	trans	-60.9	-21.2	170.3	0	0	0	0	0	114.3	N344 V348 G349 Y350	N344-G346 PolarHBondContact O-N 2.97Å; G346-V348 VanDerWaalsContact C-N 3.35Å; G346-G349 PolarHBondContact O-N 2.8Å; G346-Y350 WeakPolarHBondContact O-CB 3.36Å; G346-Y350 PolarHBondContact O-N 2.81Å
347	L	79.7	Confident	82.1	Confident	38 Å²	38	84.6 Å²	84.6	20%	0.199	44%	0.444	C	S	.	.	H	α-helix	trans	-66.5	-37.1	172.8	-173	69.5	0	0	0	111.5	N344 S345 A351 L370 R373 I374	N344-L347 WeakPolarHBondContact O-CA 3.45Å; N344-L347 WeakPolarHBondContact O-CB 3.33Å; N344-L347 PolarHBondContact O-N 3Å; S345-L347 PolarHBondContact O-N 3.33Å; L347-A351 WeakPolarHBondContact O-CB 3.44Å; L347-A351 PolarHBondContact O-N 2.95Å; L347-L370 HydrophobicContact CD1-CD1 3.66Å; L347-L370 HydrophobicContact CG-CD1 4.31Å; L347-R373 HydrophobicContact CD1-CB 4.36Å; L347-R373 HydrophobicContact CD2-CB 4.41Å; L347-I374 HydrophobicContact CD2-CG1 4.13Å; L347-I374 HydrophobicContact CG-CG1 4.41Å
348	V	81.3	Confident	82.4	Confident	90 Å²	90	85 Å²	85	55%	0.545	46%	0.456	S	S	.	.	H	α-helix	trans	-68.2	-44.1	174.8	179.3	0	0	0	0	109.6	S345 G346 A351 Q352	S345-V348 WeakPolarHBondContact O-CB 3.44Å; S345-V348 PolarHBondContact O-N 3.47Å; S345-V348 VanDerWaalsContact O-N 3.1Å; G346-V348 VanDerWaalsContact C-N 3.35Å; V348-A351 PolarHBondContact O-N 2.88Å; V348-Q352 VanDerWaalsContact O-CG 3.27Å; V348-Q352 WeakPolarHBondContact O-CG 3.42Å; V348-Q352 PolarHBondContact O-N 2.88Å
349	G	84.3	Confident	82.9	Confident	29 Å²	29	84.9 Å²	84.9	30%	0.299	46%	0.46	S	S	.	.	H	α-helix	trans	-61.7	-45.7	173.6	0	0	0	0	0	112.8	S345 G346 A351 Q352 E353	S345-G349 PolarHBondContact O-N 2.88Å; G346-G349 PolarHBondContact O-N 2.8Å; G349-A351 VanDerWaalsContact C-N 3.33Å; G349-A351 PolarHBondContact O-N 2.78Å; G349-Q352 WeakPolarHBondContact O-CB 3.08Å; G349-Q352 PolarHBondContact O-N 2.92Å; G349-Q352 VanDerWaalsContact O-N 3.17Å; G349-E353 PolarHBondContact O-N 2.85Å
350	Y	85.9	Confident	83.2	Confident	112 Å²	112	87.6 Å²	87.6	44%	0.439	47%	0.472	S	S	.	.	H	α-helix	trans	-61.5	-41.1	175.1	179	-116.1	0	0	0	111.7	G346 Q352 E353 V354 T366 L370	G346-Y350 WeakPolarHBondContact O-CB 3.36Å; G346-Y350 PolarHBondContact O-N 2.81Å; Y350-Q352 VanDerWaalsContact C-N 3.34Å; Y350-Q352 PolarHBondContact O-N 3.2Å; Y350-E353 PolarHBondContact O-N 2.86Å; Y350-V354 HydrophobicContact CD1-CG2 4.44Å; Y350-V354 HydrophobicContact CD2-CG2 4.34Å; Y350-V354 HydrophobicContact CE1-CG2 4.09Å; Y350-V354 HydrophobicContact CE2-CG2 3.97Å; Y350-V354 VanDerWaalsContact O-CG2 3.31Å; Y350-V354 WeakPolarHBondContact O-CG2 3.34Å; Y350-V354 PolarHBondContact O-N 2.9Å; Y350-T366 VanDerWaalsContact OH-CG2 3.29Å; Y350-T366 WeakPolarHBondContact OH-CG2 3.26Å; Y350-L370 HydrophobicContact CD1-CD1 3.89Å; Y350-L370 HydrophobicContact CE1-CD1 4.22Å
351	A	87.4	Confident	83.6	Confident	13 Å²	13	90.5 Å²	90.5	11%	0.107	49%	0.488	C	S	.	.	H	α-helix	trans	-62.4	-41.4	174.1	0	0	0	0	0	112.4	L347 V348 G349 E353 V354 L355 L370 I374	L347-A351 WeakPolarHBondContact O-CB 3.44Å; L347-A351 PolarHBondContact O-N 2.95Å; V348-A351 PolarHBondContact O-N 2.88Å; G349-A351 VanDerWaalsContact C-N 3.33Å; G349-A351 PolarHBondContact O-N 2.78Å; A351-E353 VanDerWaalsContact C-N 3.35Å; A351-V354 PolarHBondContact O-N 3.41Å; A351-L355 VanDerWaalsContact O-CG 3.25Å; A351-L355 WeakPolarHBondContact O-CG 3.48Å; A351-L355 PolarHBondContact O-N 3.06Å; A351-L370 VanDerWaalsContact CA-CD2 3.5Å; A351-L370 HydrophobicContact CB-CD1 4.16Å; A351-L370 HydrophobicContact CB-CD2 3.66Å; A351-L370 HydrophobicContact CB-CG 4.29Å; A351-I374 HydrophobicContact CB-CD1 3.97Å
352	Q	87.6	Confident	84.3	Confident	115 Å²	115	90.9 Å²	90.9	54%	0.537	50%	0.495	S	S	.	.	H	α-helix	trans	-63.6	-37.8	174.9	-73.3	172.2	-13.1	0	0	112.4	V348 G349 Y350	V348-Q352 VanDerWaalsContact O-CG 3.27Å; V348-Q352 WeakPolarHBondContact O-CG 3.42Å; V348-Q352 PolarHBondContact O-N 2.88Å; G349-Q352 WeakPolarHBondContact O-CB 3.08Å; G349-Q352 PolarHBondContact O-N 2.92Å; G349-Q352 VanDerWaalsContact O-N 3.17Å; Y350-Q352 VanDerWaalsContact C-N 3.34Å; Y350-Q352 PolarHBondContact O-N 3.2Å
353	E	90.7	Very high	85.3	Confident	107 Å²	107	87.5 Å²	87.5	50%	0.5	48%	0.475	S	S	.	.	H	α-helix	trans	-70.3	-42.5	174.5	-66.8	-51.5	136.4	0	0	112.4	G349 Y350 A351 L355 K356	G349-E353 PolarHBondContact O-N 2.85Å; Y350-E353 PolarHBondContact O-N 2.86Å; A351-E353 VanDerWaalsContact C-N 3.35Å; E353-L355 PolarHBondContact O-N 3.17Å; E353-K356 WeakPolarHBondContact O-CB 3.44Å; E353-K356 PolarHBondContact O-N 2.92Å; E353-K356 IonicContact OE1-NZ 3.6Å; E353-K356 PolarHBondContact OE1-NZ 3.38Å; E353-K356 WeakPolarHBondContact OE2-CD 3.41Å; E353-K356 IonicContact OE2-NZ 3.29Å; E353-K356 PolarHBondContact OE2-NZ 2.99Å
354	V	92	Very high	86.3	Confident	15 Å²	15	84.6 Å²	84.6	9%	0.091	47%	0.468	C	S	.	.	H	α-helix	trans	-59.5	-33.7	175.7	170.7	0	0	0	0	111.3	Y350 A351 K356 E357 F363 T366 L370	Y350-V354 HydrophobicContact CD1-CG2 4.44Å; Y350-V354 HydrophobicContact CD2-CG2 4.34Å; Y350-V354 HydrophobicContact CE1-CG2 4.09Å; Y350-V354 HydrophobicContact CE2-CG2 3.97Å; Y350-V354 VanDerWaalsContact O-CG2 3.31Å; Y350-V354 WeakPolarHBondContact O-CG2 3.34Å; Y350-V354 PolarHBondContact O-N 2.9Å; A351-V354 PolarHBondContact O-N 3.41Å; V354-K356 PolarHBondContact O-N 3.25Å; V354-E357 WeakPolarHBondContact O-CB 3.14Å; V354-E357 PolarHBondContact O-N 2.66Å; V354-F363 HydrophobicContact CG1-CD2 4.22Å; V354-F363 HydrophobicContact CG1-CE2 4.21Å; V354-F363 WeakPolarHBondContact O-CD2 2.87Å; V354-T366 HydrophobicContact CG1-CG2 4.19Å; V354-T366 HydrophobicContact CG2-CG2 3.79Å; V354-L370 HydrophobicContact CB-CD2 4.04Å; V354-L370 HydrophobicContact CG1-CD2 4.11Å; V354-L370 HydrophobicContact CG2-CD2 4.25Å
355	L	91.1	Very high	87.3	Confident	125 Å²	125	86.5 Å²	86.5	65%	0.654	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-15.6	175.4	-73.5	169.7	0	0	0	114.3	A351 E353 F363	A351-L355 VanDerWaalsContact O-CG 3.25Å; A351-L355 WeakPolarHBondContact O-CG 3.48Å; A351-L355 PolarHBondContact O-N 3.06Å; E353-L355 PolarHBondContact O-N 3.17Å; L355-F363 HydrophobicContact CD2-CE2 4.32Å; L355-F363 HydrophobicContact CD2-CZ 4.46Å
356	K	93.4	Very high	88.6	Confident	133 Å²	133	84.8 Å²	84.8	58%	0.578	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-7.8	175.7	-59.6	176	-166.6	164.6	0	113.3	E353 V354	E353-K356 WeakPolarHBondContact O-CB 3.44Å; E353-K356 PolarHBondContact O-N 2.92Å; E353-K356 IonicContact OE1-NZ 3.6Å; E353-K356 PolarHBondContact OE1-NZ 3.38Å; E353-K356 WeakPolarHBondContact OE2-CD 3.41Å; E353-K356 IonicContact OE2-NZ 3.29Å; E353-K356 PolarHBondContact OE2-NZ 2.99Å; V354-K356 PolarHBondContact O-N 3.25Å
357	E	93.8	Very high	89.4	Confident	95 Å²	95	83.6 Å²	83.6	44%	0.444	45%	0.445	S	S	.	.			trans	-64.1	135.4	-179.7	-174.4	53	-103.3	0	0	110.9	V354 D359 C362 F363	V354-E357 WeakPolarHBondContact O-CB 3.14Å; V354-E357 PolarHBondContact O-N 2.66Å; E357-D359 PolarHBondContact OE1-N 3.4Å; E357-C362 HydrophobicContact CG-CB 4.24Å; E357-F363 HydrophobicContact CB-CB 4.32Å; E357-F363 HydrophobicContact CB-CD2 4.31Å; E357-F363 HydrophobicContact CG-CB 4.16Å
358	T	91.1	Very high	89.8	Confident	132 Å²	132	89.5 Å²	89.5	81%	0.81	47%	0.469	S	S	*	.			trans	-104.3	-24.1	-173.1	58.7	0	0	0	0	112.3
359	D	94.8	Very high	90	Very high	69 Å²	69	91 Å²	91	37%	0.369	47%	0.47	S	S	.	.			trans	-78.1	121.3	174.5	-177.9	-96.2	0	0	0	111.5	E357 S361 C362 F363	E357-D359 PolarHBondContact OE1-N 3.4Å; D359-S361 VanDerWaalsContact C-N 3.33Å; D359-S361 PolarHBondContact O-N 3.04Å; D359-S361 WeakPolarHBondContact OD1-CB 3.27Å; D359-S361 PolarHBondContact OD1-N 3.23Å; D359-S361 VanDerWaalsContact OD1-N 3.08Å; D359-S361 PolarHBondContact OD1-OG 3.05Å; D359-C362 HydrophobicContact CB-CB 4.11Å; D359-C362 PolarHBondContact O-N 3.11Å; D359-C362 WeakPolarHBondContact OD1-CB 3.41Å; D359-C362 PolarHBondContact OD1-N 2.94Å; D359-C362 PolarHBondContact OD1-SG 3.3Å; D359-F363 VanDerWaalsContact O-CB 3.31Å; D359-F363 WeakPolarHBondContact O-CB 3.31Å; D359-F363 PolarHBondContact O-N 3.25Å
360	Q	90.9	Very high	90.2	Very high	165 Å²	165	90.3 Å²	90.3	77%	0.771	46%	0.459	S	S	*	.	H	α-helix	trans	-63.8	-36.7	-174	-63.5	177.8	4.6	0	0	112.7	V364	Q360-V364 WeakPolarHBondContact O-CB 3.21Å; Q360-V364 WeakPolarHBondContact O-CG2 3.39Å; Q360-V364 PolarHBondContact O-N 3.42Å; Q360-V364 VanDerWaalsContact O-N 3.16Å
361	S	90.9	Very high	90.3	Very high	85 Å²	85	90.6 Å²	90.6	59%	0.594	47%	0.465	S	S	*	.	H	α-helix	trans	-72.3	-46	-179.7	29.9	0	0	0	0	112.6	D359 V364 Q365	D359-S361 VanDerWaalsContact C-N 3.33Å; D359-S361 PolarHBondContact O-N 3.04Å; D359-S361 WeakPolarHBondContact OD1-CB 3.27Å; D359-S361 PolarHBondContact OD1-N 3.23Å; D359-S361 VanDerWaalsContact OD1-N 3.08Å; D359-S361 PolarHBondContact OD1-OG 3.05Å; S361-V364 PolarHBondContact O-N 3.37Å; S361-Q365 PolarHBondContact O-N 3.47Å; S361-Q365 VanDerWaalsContact O-N 3.13Å
362	C	90.8	Very high	90.3	Very high	58 Å²	58	94.2 Å²	94.2	39%	0.392	49%	0.485	S	S	.	.	H	α-helix	trans	-64.5	-40.1	177.1	-67.7	0	0	0	0	111.9	E357 D359 T366	E357-C362 HydrophobicContact CG-CB 4.24Å; D359-C362 HydrophobicContact CB-CB 4.11Å; D359-C362 PolarHBondContact O-N 3.11Å; D359-C362 WeakPolarHBondContact OD1-CB 3.41Å; D359-C362 PolarHBondContact OD1-N 2.94Å; D359-C362 PolarHBondContact OD1-SG 3.3Å; C362-T366 PolarHBondContact O-N 3.39Å; C362-T366 PolarHBondContact O-OG1 3.14Å; C362-T366 VanDerWaalsContact O-OG1 3.13Å
363	F	93.6	Very high	90.2	Very high	68 Å²	68	95.5 Å²	95.5	30%	0.298	49%	0.485	S	S	.	.	H	α-helix	trans	-60.3	-53.6	174.9	176.3	-101.1	0	0	0	111.3	V354 L355 E357 D359 Q365 T366 A367	V354-F363 HydrophobicContact CG1-CD2 4.22Å; V354-F363 HydrophobicContact CG1-CE2 4.21Å; V354-F363 WeakPolarHBondContact O-CD2 2.87Å; L355-F363 HydrophobicContact CD2-CE2 4.32Å; L355-F363 HydrophobicContact CD2-CZ 4.46Å; E357-F363 HydrophobicContact CB-CB 4.32Å; E357-F363 HydrophobicContact CB-CD2 4.31Å; E357-F363 HydrophobicContact CG-CB 4.16Å; D359-F363 VanDerWaalsContact O-CB 3.31Å; D359-F363 WeakPolarHBondContact O-CB 3.31Å; D359-F363 PolarHBondContact O-N 3.25Å; F363-Q365 VanDerWaalsContact C-N 3.31Å; F363-Q365 PolarHBondContact O-N 3.41Å; F363-T366 PolarHBondContact O-N 3.26Å; F363-T366 VanDerWaalsContact O-N 3.17Å; F363-A367 HydrophobicContact CD1-CB 4.3Å; F363-A367 HydrophobicContact CE1-CB 3.97Å; F363-A367 HydrophobicContact CE2-CB 4.21Å; F363-A367 HydrophobicContact CZ-CB 3.92Å; F363-A367 WeakPolarHBondContact O-CB 3.48Å; F363-A367 PolarHBondContact O-N 2.93Å
364	V	91.3	Very high	89.9	Confident	96 Å²	96	93.4 Å²	93.4	58%	0.582	48%	0.477	S	S	*	.	H	α-helix	trans	-62.2	-37.8	-176.1	171.1	0	0	0	0	112	Q360 S361 T366 K368	Q360-V364 WeakPolarHBondContact O-CB 3.21Å; Q360-V364 WeakPolarHBondContact O-CG2 3.39Å; Q360-V364 PolarHBondContact O-N 3.42Å; Q360-V364 VanDerWaalsContact O-N 3.16Å; S361-V364 PolarHBondContact O-N 3.37Å; V364-T366 VanDerWaalsContact C-N 3.33Å; V364-T366 PolarHBondContact O-N 3.34Å; V364-K368 PolarHBondContact O-N 3.12Å
365	Q	86.9	Confident	89.6	Confident	142 Å²	142	96.8 Å²	96.8	66%	0.664	49%	0.492	S	S	*	.	H	α-helix	trans	-59.5	-42.7	176.8	-177.5	177.9	-2.4	0	0	112.2	S361 F363	S361-Q365 PolarHBondContact O-N 3.47Å; S361-Q365 VanDerWaalsContact O-N 3.13Å; F363-Q365 VanDerWaalsContact C-N 3.31Å; F363-Q365 PolarHBondContact O-N 3.41Å
366	T	90.4	Very high	89.1	Confident	45 Å²	45	98.1 Å²	98.1	28%	0.276	49%	0.492	S	S	.	.	H	α-helix	trans	-86.4	-39.7	-175.2	-50	0	0	0	0	112	Y350 V354 C362 F363 V364 K368 Q369 L370	Y350-T366 VanDerWaalsContact OH-CG2 3.29Å; Y350-T366 WeakPolarHBondContact OH-CG2 3.26Å; V354-T366 HydrophobicContact CG1-CG2 4.19Å; V354-T366 HydrophobicContact CG2-CG2 3.79Å; C362-T366 PolarHBondContact O-N 3.39Å; C362-T366 PolarHBondContact O-OG1 3.14Å; C362-T366 VanDerWaalsContact O-OG1 3.13Å; F363-T366 PolarHBondContact O-N 3.26Å; F363-T366 VanDerWaalsContact O-N 3.17Å; V364-T366 VanDerWaalsContact C-N 3.33Å; V364-T366 PolarHBondContact O-N 3.34Å; T366-K368 VanDerWaalsContact C-N 3.3Å; T366-K368 PolarHBondContact O-N 2.84Å; T366-Q369 PolarHBondContact O-N 3.17Å; T366-L370 WeakPolarHBondContact O-CB 3.38Å; T366-L370 PolarHBondContact O-N 2.56Å
367	A	90.6	Very high	88.4	Confident	24 Å²	24	93.4 Å²	93.4	20%	0.198	48%	0.478	C	S	.	.	H	α-helix	trans	-60	-36.4	-178.7	0	0	0	0	0	112.5	F363 L370 H371	F363-A367 HydrophobicContact CD1-CB 4.3Å; F363-A367 HydrophobicContact CE1-CB 3.97Å; F363-A367 HydrophobicContact CE2-CB 4.21Å; F363-A367 HydrophobicContact CZ-CB 3.92Å; F363-A367 WeakPolarHBondContact O-CB 3.48Å; F363-A367 PolarHBondContact O-N 2.93Å; A367-L370 PolarHBondContact O-N 2.69Å; A367-H371 VanDerWaalsContact O-CB 3.28Å; A367-H371 WeakPolarHBondContact O-CB 3.42Å; A367-H371 PolarHBondContact O-N 2.81Å
368	K	87.1	Confident	87.8	Confident	162 Å²	162	92.1 Å²	92.1	70%	0.704	48%	0.477	S	S	*	.	H	α-helix	trans	-64.7	-44.1	178.3	-171.6	175.9	179.7	178.8	0	112.5	V364 T366 V372	V364-K368 PolarHBondContact O-N 3.12Å; T366-K368 VanDerWaalsContact C-N 3.3Å; T366-K368 PolarHBondContact O-N 2.84Å; K368-V372 WeakPolarHBondContact O-CG2 3.33Å; K368-V372 PolarHBondContact O-N 2.78Å
369	Q	86	Confident	87.3	Confident	122 Å²	122	90.5 Å²	90.5	57%	0.57	46%	0.46	S	S	*	.	H	α-helix	trans	-68.5	-39.4	177.1	-74.5	-177	35.9	0	0	111.7	T366 V372 R373	T366-Q369 PolarHBondContact O-N 3.17Å; Q369-V372 PolarHBondContact O-N 2.94Å; Q369-R373 WeakPolarHBondContact O-CG 3.49Å; Q369-R373 PolarHBondContact O-N 3.08Å
370	L	88.8	Confident	86.3	Confident	13 Å²	13	89.6 Å²	89.6	7%	0.068	46%	0.459	C	S	.	.	H	α-helix	trans	-64.8	-43.3	177.7	178.7	62	0	0	0	112.1	L347 Y350 A351 V354 T366 A367 V372 R373 I374	L347-L370 HydrophobicContact CD1-CD1 3.66Å; L347-L370 HydrophobicContact CG-CD1 4.31Å; Y350-L370 HydrophobicContact CD1-CD1 3.89Å; Y350-L370 HydrophobicContact CE1-CD1 4.22Å; A351-L370 VanDerWaalsContact CA-CD2 3.5Å; A351-L370 HydrophobicContact CB-CD1 4.16Å; A351-L370 HydrophobicContact CB-CD2 3.66Å; A351-L370 HydrophobicContact CB-CG 4.29Å; V354-L370 HydrophobicContact CB-CD2 4.04Å; V354-L370 HydrophobicContact CG1-CD2 4.11Å; V354-L370 HydrophobicContact CG2-CD2 4.25Å; T366-L370 WeakPolarHBondContact O-CB 3.38Å; T366-L370 PolarHBondContact O-N 2.56Å; A367-L370 PolarHBondContact O-N 2.69Å; L370-V372 VanDerWaalsContact C-N 3.32Å; L370-V372 PolarHBondContact O-N 2.88Å; L370-R373 PolarHBondContact O-N 3.48Å; L370-R373 VanDerWaalsContact O-N 3.12Å; L370-I374 HydrophobicContact CD1-CD1 3.95Å; L370-I374 HydrophobicContact CD1-CG1 4.19Å; L370-I374 HydrophobicContact CD2-CD1 4.43Å; L370-I374 HydrophobicContact CG-CD1 3.82Å; L370-I374 HydrophobicContact CG-CG1 4.43Å; L370-I374 WeakPolarHBondContact O-CG1 3.42Å; L370-I374 PolarHBondContact O-N 2.89Å
371	H	87.5	Confident	85.7	Confident	119 Å²	119	87.3 Å²	87.3	55%	0.551	45%	0.451	S	S	*	.	H	α-helix	trans	-58.8	-43.3	178.3	-174.8	71.3	0	0	0	111.8	A367 R373 I374 Q375	A367-H371 VanDerWaalsContact O-CB 3.28Å; A367-H371 WeakPolarHBondContact O-CB 3.42Å; A367-H371 PolarHBondContact O-N 2.81Å; H371-R373 VanDerWaalsContact C-N 3.34Å; H371-R373 PolarHBondContact O-N 3.44Å; H371-I374 PolarHBondContact O-N 2.55Å; H371-Q375 VanDerWaalsContact O-CB 3.24Å; H371-Q375 WeakPolarHBondContact O-CB 3.28Å; H371-Q375 PolarHBondContact O-N 3.34Å
372	V	86.8	Confident	85.1	Confident	89 Å²	89	90.4 Å²	90.4	54%	0.539	45%	0.454	S	S	.	.	H	α-helix	trans	-61.8	-40.9	175.9	173.9	0	0	0	0	111.6	K368 Q369 L370 K376	K368-V372 WeakPolarHBondContact O-CG2 3.33Å; K368-V372 PolarHBondContact O-N 2.78Å; Q369-V372 PolarHBondContact O-N 2.94Å; L370-V372 VanDerWaalsContact C-N 3.32Å; L370-V372 PolarHBondContact O-N 2.88Å; V372-K376 WeakPolarHBondContact O-CB 3.29Å; V372-K376 PolarHBondContact O-N 3.47Å
373	R	85.8	Confident	84.2	Confident	142 Å²	142	92.9 Å²	92.9	54%	0.536	47%	0.468	S	S	.	.	H	α-helix	trans	-66.1	-43.8	177.3	-69.3	-178	-172.5	178.8	4.1	112.1	L347 Q369 L370 H371 A377	L347-R373 HydrophobicContact CD1-CB 4.36Å; L347-R373 HydrophobicContact CD2-CB 4.41Å; Q369-R373 WeakPolarHBondContact O-CG 3.49Å; Q369-R373 PolarHBondContact O-N 3.08Å; L370-R373 PolarHBondContact O-N 3.48Å; L370-R373 VanDerWaalsContact O-N 3.12Å; H371-R373 VanDerWaalsContact C-N 3.34Å; H371-R373 PolarHBondContact O-N 3.44Å; R373-A377 PolarHBondContact O-N 3.43Å; R373-A377 VanDerWaalsContact O-N 3.12Å
374	I	85.3	Confident	83.7	Confident	62 Å²	62	96.1 Å²	96.1	32%	0.318	48%	0.482	S	S	.	.	H	α-helix	trans	-66.4	-42.7	177.5	-67.6	172.1	0	0	0	110.8	L347 A351 L370 H371 K376 A377 T378	L347-I374 HydrophobicContact CD2-CG1 4.13Å; L347-I374 HydrophobicContact CG-CG1 4.41Å; A351-I374 HydrophobicContact CB-CD1 3.97Å; L370-I374 HydrophobicContact CD1-CD1 3.95Å; L370-I374 HydrophobicContact CD1-CG1 4.19Å; L370-I374 HydrophobicContact CD2-CD1 4.43Å; L370-I374 HydrophobicContact CG-CD1 3.82Å; L370-I374 HydrophobicContact CG-CG1 4.43Å; L370-I374 WeakPolarHBondContact O-CG1 3.42Å; L370-I374 PolarHBondContact O-N 2.89Å; H371-I374 PolarHBondContact O-N 2.55Å; I374-K376 PolarHBondContact O-N 3.43Å; I374-A377 PolarHBondContact O-N 3.01Å; I374-T378 WeakPolarHBondContact O-CB 3.38Å; I374-T378 PolarHBondContact O-N 2.91Å; I374-T378 PolarHBondContact O-OG1 2.99Å
375	Q	84.9	Confident	83.4	Confident	87 Å²	87	98.8 Å²	98.8	41%	0.407	49%	0.488	S	S	.	.	H	α-helix	trans	-60.2	-46.6	177.9	-177.3	178	-10.4	0	0	110.9	H371 A377 T378 E379	H371-Q375 VanDerWaalsContact O-CB 3.24Å; H371-Q375 WeakPolarHBondContact O-CB 3.28Å; H371-Q375 PolarHBondContact O-N 3.34Å; Q375-A377 PolarHBondContact O-N 3.48Å; Q375-T378 PolarHBondContact O-N 3.14Å; Q375-E379 WeakPolarHBondContact CG-OE1 3.25Å; Q375-E379 PolarHBondContact NE2-OE1 2.91Å; Q375-E379 WeakPolarHBondContact O-CG 3.47Å; Q375-E379 PolarHBondContact O-N 3.34Å
376	K	80.5	Confident	83.4	Confident	152 Å²	152	95.5 Å²	95.5	66%	0.661	48%	0.479	S	S	*	.	H	α-helix	trans	-59.6	-44.1	176.7	-168.8	179.2	-179	-175.3	0	112.1	V372 I374 E379 S380	V372-K376 WeakPolarHBondContact O-CB 3.29Å; V372-K376 PolarHBondContact O-N 3.47Å; I374-K376 PolarHBondContact O-N 3.43Å; K376-E379 PolarHBondContact O-N 3.01Å; K376-S380 PolarHBondContact O-N 3.36Å; K376-S380 PolarHBondContact O-OG 3.07Å
377	A	79.8	Confident	83.4	Confident	35 Å²	35	95.9 Å²	95.9	29%	0.289	48%	0.483	S	S	.	.	H	α-helix	trans	-65.6	-38	175.8	0	0	0	0	0	112.6	R373 I374 Q375 S380 L381	R373-A377 PolarHBondContact O-N 3.43Å; R373-A377 VanDerWaalsContact O-N 3.12Å; I374-A377 PolarHBondContact O-N 3.01Å; Q375-A377 PolarHBondContact O-N 3.48Å; A377-S380 PolarHBondContact O-N 3.2Å; A377-L381 WeakPolarHBondContact O-CG 3.28Å; A377-L381 PolarHBondContact O-N 3.18Å
378	T	81.1	Confident	83.4	Confident	67 Å²	67	95.3 Å²	95.3	41%	0.411	48%	0.479	S	S	.	.	H	α-helix	trans	-69.8	-37.1	179.2	-52.1	0	0	0	0	111.5	I374 Q375 L381 K382	I374-T378 WeakPolarHBondContact O-CB 3.38Å; I374-T378 PolarHBondContact O-N 2.91Å; I374-T378 PolarHBondContact O-OG1 2.99Å; Q375-T378 PolarHBondContact O-N 3.14Å; T378-L381 PolarHBondContact O-N 3.09Å; T378-K382 WeakPolarHBondContact O-CG 3.41Å; T378-K382 PolarHBondContact O-N 3.33Å
379	E	79.9	Confident	83.6	Confident	98 Å²	98	92.6 Å²	92.6	46%	0.458	47%	0.472	S	S	.	.	H	α-helix	trans	-64.5	-42	175.2	-76.3	170.9	-173.7	0	0	111.8	Q375 K376 L381 K382	Q375-E379 WeakPolarHBondContact CG-OE1 3.25Å; Q375-E379 PolarHBondContact NE2-OE1 2.91Å; Q375-E379 WeakPolarHBondContact O-CG 3.47Å; Q375-E379 PolarHBondContact O-N 3.34Å; K376-E379 PolarHBondContact O-N 3.01Å; E379-L381 PolarHBondContact O-N 3.21Å; E379-K382 PolarHBondContact O-N 3.31Å
380	S	74.4	Confident	83.8	Confident	51 Å²	51	91.4 Å²	91.4	36%	0.357	48%	0.475	S	S	.	.	H	α-helix	trans	-62	-23.1	174.5	-61.4	0	0	0	0	114.1	K376 A377	K376-S380 PolarHBondContact O-N 3.36Å; K376-S380 PolarHBondContact O-OG 3.07Å; A377-S380 PolarHBondContact O-N 3.2Å
381	L	76.5	Confident	83.8	Confident	116 Å²	116	92.9 Å²	92.9	61%	0.607	49%	0.486	S	S	*	.	H	α-helix	trans	-88.9	-13.5	-179.8	-70.1	168.3	0	0	0	114.1	M341 A377 T378 E379 T383	M341-L381 HydrophobicContact CE-CD2 3.79Å; M341-L381 HydrophobicContact CE-CG 3.91Å; A377-L381 WeakPolarHBondContact O-CG 3.28Å; A377-L381 PolarHBondContact O-N 3.18Å; T378-L381 PolarHBondContact O-N 3.09Å; E379-L381 PolarHBondContact O-N 3.21Å; L381-T383 VanDerWaalsContact C-N 3.32Å; L381-T383 PolarHBondContact O-N 3Å
382	K	78.6	Confident	84	Confident	150 Å²	150	90.7 Å²	90.7	65%	0.652	48%	0.475	S	S	*	.	S	Bend	trans	-69.6	-26.2	-172.7	-78.9	174.9	-175.5	174.2	0	113.8	T378 E379	T378-K382 WeakPolarHBondContact O-CG 3.41Å; T378-K382 PolarHBondContact O-N 3.33Å; E379-K382 PolarHBondContact O-N 3.31Å
383	T	72.9	Confident	84	Confident	111 Å²	111	92.5 Å²	92.5	68%	0.681	48%	0.481	S	S	*	.			trans	-148.8	119.7	-179.2	47.8	0	0	0	0	110.9	L381	L381-T383 VanDerWaalsContact C-N 3.32Å; L381-T383 PolarHBondContact O-N 3Å
384	F	82.4	Confident	84	Confident	135 Å²	135	91.9 Å²	91.9	59%	0.592	49%	0.485	S	S	*	.			trans	-86.6	129.5	171	177.6	-101.5	0	0	0	110.3	P386	F384-P386 HydrophobicContact CE1-CG 3.93Å; F384-P386 HydrophobicContact CZ-CG 4.3Å
385	H	84.3	Confident	84.1	Confident	152 Å²	152	91.2 Å²	91.2	70%	0.704	48%	0.479	S	S	*	.			trans	-137.4	129.3	166.4	-98	54.6	0	0	0	108.6	Q334	Q334-H385 PolarHBondContact NE2-O 3.39Å
386	P	88.6	Confident	84	Confident	73 Å²	73	92.9 Å²	92.9	47%	0.474	50%	0.495	S	S	.	.			trans	-57.5	140.4	173.3	-23.8	33.8	0	0	0	111.8	L331 F384 A388	L331-P386 HydrophobicContact CD2-CB 4.24Å; F384-P386 HydrophobicContact CE1-CG 3.93Å; F384-P386 HydrophobicContact CZ-CG 4.3Å; P386-A388 PolarHBondContact O-N 2.95Å
387	S	89.7	Confident	84.2	Confident	53 Å²	53	91.4 Å²	91.4	37%	0.371	49%	0.494	S	S	.	.	S	Bend	trans	-71	-15.5	177.7	60.4	0	0	0	0	113.4	Q330 L331 Q334	Q330-S387 PolarHBondContact O-OG 3.21Å; L331-S387 PolarHBondContact N-OG 3.2Å; Q334-S387 PolarHBondContact OE1-OG 3.08Å
388	A	91.6	Very high	84.6	Confident	13 Å²	13	95 Å²	95	11%	0.107	51%	0.509	C	S	.	.	S	Bend	trans	-150.1	151	174.6	0	0	0	0	0	111.7	R327 Q330 L331 P386	R327-A388 HydrophobicContact CB-CB 4.03Å; R327-A388 HydrophobicContact CG-CB 4.07Å; Q330-A388 HydrophobicContact CB-CB 4.26Å; L331-A388 HydrophobicContact CD2-CB 4.45Å; L331-A388 HydrophobicContact CG-CB 4.17Å; P386-A388 PolarHBondContact O-N 2.95Å
389	D	90.7	Very high	85	Confident	105 Å²	105	94.8 Å²	94.8	56%	0.561	51%	0.507	S	S	*	.			trans	-82.4	130.6	172.2	-172.8	-15	0	0	0	110.4	R327 C391	R327-D389 WeakPolarHBondContact CD-O 3.26Å; D389-C391 PolarHBondContact O-N 3.33Å; D389-C391 VanDerWaalsContact OD1-CB 3.27Å; D389-C391 WeakPolarHBondContact OD1-CB 3.47Å; D389-C391 PolarHBondContact OD1-N 2.73Å
390	P	89.4	Confident	85.4	Confident	97 Å²	97	92.8 Å²	92.8	63%	0.63	50%	0.504	S	S	*	.			trans	-71.9	-9.2	174.7	30.4	-37.6	0	0	0	114.8	F392	P390-F392 VanDerWaalsContact O-CD2 3.24Å; P390-F392 WeakPolarHBondContact O-CD2 3.42Å; P390-F392 WeakPolarHBondContact O-CE2 3.28Å
391	C	89.3	Confident	86.1	Confident	44 Å²	44	97.6 Å²	97.6	30%	0.297	52%	0.519	S	S	.	.			trans	-74.8	148.2	-174.4	-161	0	0	0	0	114.2	R327 D389 D393	R327-C391 VanDerWaalsContact CZ-O 3.29Å; R327-C391 PolarHBondContact NH1-O 2.92Å; D389-C391 PolarHBondContact O-N 3.33Å; D389-C391 VanDerWaalsContact OD1-CB 3.27Å; D389-C391 WeakPolarHBondContact OD1-CB 3.47Å; D389-C391 PolarHBondContact OD1-N 2.73Å; C391-D393 PolarHBondContact SG-OD1 3.33Å; C391-D393 PolarHBondContact SG-OD2 3.31Å
392	F	91.8	Very high	86.6	Confident	72 Å²	72	97 Å²	97	32%	0.316	51%	0.513	S	S	.	.			trans	-122.6	24.6	178.7	-71.3	-97.2	0	0	0	112.9	I320 R324 R327 P390 E394 F395	I320-F392 HydrophobicContact CG2-CD1 4.38Å; I320-F392 HydrophobicContact CG2-CE1 4.34Å; R324-F392 HydrophobicContact CB-CE1 4.07Å; R324-F392 HydrophobicContact CB-CZ 3.79Å; R324-F392 HydrophobicContact CG-CZ 4.1Å; R327-F392 VanDerWaalsContact NH1-CD1 3.26Å; R327-F392 VanDerWaalsContact NH1-CE1 3.26Å; P390-F392 VanDerWaalsContact O-CD2 3.24Å; P390-F392 WeakPolarHBondContact O-CD2 3.42Å; P390-F392 WeakPolarHBondContact O-CE2 3.28Å; F392-E394 PolarHBondContact O-N 2.94Å; F392-F395 HydrophobicContact CB-CD2 4.12Å; F392-F395 AromaticContact CD1-CD2 3.68Å; F392-F395 HydrophobicContact CD1-CD2 3.68Å; F392-F395 AromaticContact CD1-CE2 3.8Å; F392-F395 HydrophobicContact CD1-CE2 3.8Å; F392-F395 HydrophobicContact CE1-CE2 4.43Å; F392-F395 HydrophobicContact CG-CD2 4.39Å; F392-F395 PolarHBondContact O-N 2.99Å
393	D	86.9	Confident	87	Confident	127 Å²	127	94.2 Å²	94.2	68%	0.679	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-56.8	-22.9	-178	-67.7	-22.1	0	0	0	113.7	C391 F395 V396	C391-D393 PolarHBondContact SG-OD1 3.33Å; C391-D393 PolarHBondContact SG-OD2 3.31Å; D393-F395 PolarHBondContact O-N 3.45Å; D393-V396 WeakPolarHBondContact O-CG2 3.42Å
394	E	85.1	Confident	87.6	Confident	130 Å²	130	92 Å²	92	61%	0.607	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-68.1	-11.1	174	69.4	-164.5	-176.1	0	0	114.3	R327 F392	R327-E394 IonicContact CZ-OE1 2.82Å; R327-E394 IonicContact NH1-OE1 2.76Å; R327-E394 IonicContact NH2-OE1 3.79Å; R327-E394 PolarHBondContact NH2-OE1 2.94Å; R327-E394 IonicContact NH2-OE2 3.63Å; F392-E394 PolarHBondContact O-N 2.94Å
395	F	86.9	Confident	87.7	Confident	47 Å²	47	91 Å²	91	21%	0.206	49%	0.489	C	S	.	.	G	3₁₀ helix	trans	-108.1	18	-179.4	-64.6	-80.2	0	0	0	113.9	M316 I320 F392 D393 L397	M316-F395 HydrophobicContact SD-CD1 4.32Å; I320-F395 HydrophobicContact CD1-CB 4.35Å; I320-F395 HydrophobicContact CD1-CD1 4.18Å; I320-F395 HydrophobicContact CD1-CG 4.38Å; I320-F395 HydrophobicContact CG1-CB 4.24Å; I320-F395 HydrophobicContact CG1-CD1 3.41Å; I320-F395 VanDerWaalsContact CG1-CD1 3.41Å; I320-F395 HydrophobicContact CG1-CD2 4.34Å; I320-F395 HydrophobicContact CG1-CE1 3.7Å; I320-F395 HydrophobicContact CG1-CG 3.75Å; I320-F395 HydrophobicContact CG1-CZ 4.28Å; F392-F395 HydrophobicContact CB-CD2 4.12Å; F392-F395 AromaticContact CD1-CD2 3.68Å; F392-F395 HydrophobicContact CD1-CD2 3.68Å; F392-F395 AromaticContact CD1-CE2 3.8Å; F392-F395 HydrophobicContact CD1-CE2 3.8Å; F392-F395 HydrophobicContact CE1-CE2 4.43Å; F392-F395 HydrophobicContact CG-CD2 4.39Å; F392-F395 PolarHBondContact O-N 2.99Å; D393-F395 PolarHBondContact O-N 3.45Å; F395-L397 PolarHBondContact O-N 3.34Å
396	V	84.4	Confident	87.7	Confident	122 Å²	122	87.3 Å²	87.3	74%	0.739	47%	0.474	S	S	*	.			trans	-66.2	115.8	174	176.8	0	0	0	0	109.6	D393	D393-V396 WeakPolarHBondContact O-CG2 3.42Å
397	L	84.6	Confident	87.2	Confident	122 Å²	122	91.2 Å²	91.2	64%	0.639	48%	0.483	S	S	*	.			trans	-103.6	124.5	-178.9	-172.7	73.2	0	0	0	110.4	M316 F395 T399	M316-L397 HydrophobicContact CE-CD1 4.46Å; F395-L397 PolarHBondContact O-N 3.34Å; L397-T399 HydrophobicContact CD2-CG2 3.65Å; L397-T399 HydrophobicContact CG-CG2 3.82Å
398	D	86.5	Confident	86.6	Confident	111 Å²	111	94.7 Å²	94.7	59%	0.594	49%	0.494	S	S	*	.			trans	-110.9	116.6	167.4	177.2	9.7	0	0	0	108.4	S400	D398-S400 VanDerWaalsContact CG-OG 3.31Å; D398-S400 WeakPolarHBondContact OD1-CB 3.47Å; D398-S400 PolarHBondContact OD1-N 2.96Å; D398-S400 PolarHBondContact OD1-OG 3.33Å; D398-S400 PolarHBondContact OD2-OG 3Å
399	T	90.1	Very high	85.7	Confident	62 Å²	62	97.4 Å²	97.4	38%	0.38	51%	0.505	S	S	.	.			trans	-103.2	7.1	-178.5	55.5	0	0	0	0	113.3	L397 K401 E402 E403	L397-T399 HydrophobicContact CD2-CG2 3.65Å; L397-T399 HydrophobicContact CG-CG2 3.82Å; T399-K401 VanDerWaalsContact C-N 3.29Å; T399-K401 PolarHBondContact O-N 3.49Å; T399-E402 WeakPolarHBondContact CA-OE2 3.35Å; T399-E402 PolarHBondContact O-N 3.29Å; T399-E403 WeakPolarHBondContact O-CG 3.42Å; T399-E403 PolarHBondContact O-N 3.01Å
400	S	89.2	Confident	84.3	Confident	56 Å²	56	95.5 Å²	95.5	39%	0.392	50%	0.499	S	S	.	.	H	α-helix	trans	-60.9	-36	-171.7	57.6	0	0	0	0	113.4	D398 T404	D398-S400 VanDerWaalsContact CG-OG 3.31Å; D398-S400 WeakPolarHBondContact OD1-CB 3.47Å; D398-S400 PolarHBondContact OD1-N 2.96Å; D398-S400 PolarHBondContact OD1-OG 3.33Å; D398-S400 PolarHBondContact OD2-OG 3Å; S400-T404 PolarHBondContact O-N 3.5Å; S400-T404 PolarHBondContact O-OG1 3.14Å
401	K	87.9	Confident	83.1	Confident	152 Å²	152	96.9 Å²	96.9	66%	0.661	50%	0.495	S	S	*	.	H	α-helix	trans	-70	-46.7	177.9	-67.5	-180	-177.6	174.3	0	111.4	T399 E403 T404 L405	T399-K401 VanDerWaalsContact C-N 3.29Å; T399-K401 PolarHBondContact O-N 3.49Å; K401-E403 VanDerWaalsContact C-N 3.33Å; K401-E403 PolarHBondContact O-N 3.27Å; K401-T404 WeakPolarHBondContact O-CB 3.39Å; K401-T404 PolarHBondContact O-N 3.14Å; K401-T404 VanDerWaalsContact O-N 3.12Å; K401-L405 WeakPolarHBondContact O-CG 3.49Å; K401-L405 PolarHBondContact O-N 3.23Å
402	E	88.4	Confident	81.5	Confident	103 Å²	103	97.2 Å²	97.2	48%	0.481	51%	0.506	S	S	.	.	H	α-helix	trans	-63.8	-40.1	179.9	-66.6	70.3	-158	0	0	111	T399 T404 L405 L406	T399-E402 WeakPolarHBondContact CA-OE2 3.35Å; T399-E402 PolarHBondContact O-N 3.29Å; E402-T404 VanDerWaalsContact C-N 3.31Å; E402-T404 PolarHBondContact O-N 3.41Å; E402-L405 PolarHBondContact O-N 3.37Å; E402-L406 WeakPolarHBondContact O-CG 2.93Å; E402-L406 PolarHBondContact O-N 3.44Å
403	E	85.6	Confident	80	Confident	91 Å²	91	95.8 Å²	95.8	43%	0.425	51%	0.512	S	S	.	.	H	α-helix	trans	-61.7	-38.9	172.4	-78.2	-173.9	-156	0	0	112.8	T399 K401 L406 K407	T399-E403 WeakPolarHBondContact O-CG 3.42Å; T399-E403 PolarHBondContact O-N 3.01Å; K401-E403 VanDerWaalsContact C-N 3.33Å; K401-E403 PolarHBondContact O-N 3.27Å; E403-L406 PolarHBondContact O-N 3.17Å; E403-K407 WeakPolarHBondContact O-CB 3.28Å; E403-K407 VanDerWaalsContact O-CG 3.25Å; E403-K407 WeakPolarHBondContact O-CG 3.45Å; E403-K407 PolarHBondContact O-N 3.02Å; E403-K407 IonicContact OE2-NZ 3.93Å; E403-K407 PolarHBondContact OE2-NZ 2.84Å
404	T	85.6	Confident	79	Confident	66 Å²	66	93 Å²	93	41%	0.405	50%	0.5	S	S	.	.	H	α-helix	trans	-66.7	-45.8	178.1	-55.3	0	0	0	0	110.2	S400 K401 E402 L406 K407 E408	S400-T404 PolarHBondContact O-N 3.5Å; S400-T404 PolarHBondContact O-OG1 3.14Å; K401-T404 WeakPolarHBondContact O-CB 3.39Å; K401-T404 PolarHBondContact O-N 3.14Å; K401-T404 VanDerWaalsContact O-N 3.12Å; E402-T404 VanDerWaalsContact C-N 3.31Å; E402-T404 PolarHBondContact O-N 3.41Å; T404-L406 VanDerWaalsContact C-N 3.3Å; T404-L406 PolarHBondContact O-N 3.02Å; T404-K407 PolarHBondContact O-N 3.08Å; T404-K407 VanDerWaalsContact O-N 3.1Å; T404-E408 HydrophobicContact CG2-CG 4.37Å; T404-E408 WeakPolarHBondContact CG2-OE1 3.44Å; T404-E408 WeakPolarHBondContact O-CB 3.45Å; T404-E408 WeakPolarHBondContact O-CG 3.27Å; T404-E408 PolarHBondContact O-N 2.95Å
405	L	84.6	Confident	78.3	Confident	114 Å²	114	87 Å²	87	60%	0.597	47%	0.472	S	S	*	.	H	α-helix	trans	-58.5	-40.8	174.9	-69.4	171.5	0	0	0	112.1	K401 E402 E408 M409	K401-L405 WeakPolarHBondContact O-CG 3.49Å; K401-L405 PolarHBondContact O-N 3.23Å; E402-L405 PolarHBondContact O-N 3.37Å; L405-E408 PolarHBondContact O-N 2.91Å; L405-M409 WeakPolarHBondContact O-CG 3.36Å; L405-M409 PolarHBondContact O-N 3.49Å
406	L	84.1	Confident	77.8	Confident	74 Å²	74	88.9 Å²	88.9	39%	0.387	48%	0.484	S	S	.	.	H	α-helix	trans	-67.3	-36.1	175.9	-72.5	171.5	0	0	0	112.6	L309 E402 E403 T404 M409	L309-L406 HydrophobicContact CD1-CD1 4.27Å; E402-L406 WeakPolarHBondContact O-CG 2.93Å; E402-L406 PolarHBondContact O-N 3.44Å; E403-L406 PolarHBondContact O-N 3.17Å; T404-L406 VanDerWaalsContact C-N 3.3Å; T404-L406 PolarHBondContact O-N 3.02Å; L406-M409 HydrophobicContact CB-CE 4.19Å; L406-M409 HydrophobicContact CD2-CE 3.45Å; L406-M409 VanDerWaalsContact CD2-CE 3.45Å; L406-M409 HydrophobicContact CD2-SD 4.03Å; L406-M409 HydrophobicContact CG-CE 4.43Å; L406-M409 WeakPolarHBondContact O-CB 3.47Å; L406-M409 WeakPolarHBondContact O-CE 3.4Å; L406-M409 WeakPolarHBondContact O-CG 3.45Å
407	K	79.8	Confident	77.8	Confident	155 Å²	155	85.5 Å²	85.5	67%	0.674	46%	0.464	S	S	*	.	H	α-helix	trans	-72.9	-32	176.9	-74.5	166.5	-173.9	158	0	112.8	E403 T404 M409	E403-K407 WeakPolarHBondContact O-CB 3.28Å; E403-K407 VanDerWaalsContact O-CG 3.25Å; E403-K407 WeakPolarHBondContact O-CG 3.45Å; E403-K407 PolarHBondContact O-N 3.02Å; E403-K407 IonicContact OE2-NZ 3.93Å; E403-K407 PolarHBondContact OE2-NZ 2.84Å; T404-K407 PolarHBondContact O-N 3.08Å; T404-K407 VanDerWaalsContact O-N 3.1Å; K407-M409 PolarHBondContact O-N 2.61Å
408	E	76.6	Confident	78	Confident	126 Å²	126	79.7 Å²	79.7	59%	0.589	43%	0.434	S	S	*	.	H	α-helix	trans	-76.4	-10.2	177.6	-73.1	176.8	177.8	0	0	113.1	T404 L405 C410	T404-E408 HydrophobicContact CG2-CG 4.37Å; T404-E408 WeakPolarHBondContact CG2-OE1 3.44Å; T404-E408 WeakPolarHBondContact O-CB 3.45Å; T404-E408 WeakPolarHBondContact O-CG 3.27Å; T404-E408 PolarHBondContact O-N 2.95Å; L405-E408 PolarHBondContact O-N 2.91Å; E408-C410 PolarHBondContact O-N 2.83Å
409	M	72	Confident	78.2	Confident	70 Å²	70	79.4 Å²	79.4	35%	0.345	43%	0.432	S	S	.	.			trans	-60.1	104	174.8	-63.5	-167.6	-60.9	0	0	110.8	L305 L405 L406 K407 F411	L305-M409 HydrophobicContact CD1-CE 4.5Å; L305-M409 HydrophobicContact CD1-SD 4.49Å; L405-M409 WeakPolarHBondContact O-CG 3.36Å; L405-M409 PolarHBondContact O-N 3.49Å; L406-M409 HydrophobicContact CB-CE 4.19Å; L406-M409 HydrophobicContact CD2-CE 3.45Å; L406-M409 VanDerWaalsContact CD2-CE 3.45Å; L406-M409 HydrophobicContact CD2-SD 4.03Å; L406-M409 HydrophobicContact CG-CE 4.43Å; L406-M409 WeakPolarHBondContact O-CB 3.47Å; L406-M409 WeakPolarHBondContact O-CE 3.4Å; L406-M409 WeakPolarHBondContact O-CG 3.45Å; K407-M409 PolarHBondContact O-N 2.61Å; M409-F411 HydrophobicContact CB-CD2 4.3Å; M409-F411 HydrophobicContact CB-CE1 4.49Å; M409-F411 HydrophobicContact CB-CE2 3.48Å; M409-F411 VanDerWaalsContact CB-CE2 3.48Å; M409-F411 HydrophobicContact CB-CZ 3.61Å; M409-F411 HydrophobicContact CE-CE2 3.97Å; M409-F411 HydrophobicContact CE-CZ 3.73Å; M409-F411 HydrophobicContact CG-CZ 4.25Å; M409-F411 HydrophobicContact SD-CE2 4.38Å; M409-F411 HydrophobicContact SD-CZ 3.74Å
410	C	62.7	Low	78.2	Confident	64 Å²	64	77.1 Å²	77.1	43%	0.432	42%	0.417	S	S	.	.			trans	-95	102.7	176	-74.3	0	0	0	0	110	E408 N503	E408-C410 PolarHBondContact O-N 2.83Å; C410-N503 PolarHBondContact O-ND2 3.49Å
411	F	62.8	Low	78.1	Confident	126 Å²	126	75 Å²	75	55%	0.553	40%	0.402	S	S	*	.			trans	-88.3	-7.2	174.2	-55.9	-77.8	0	0	0	113.2	F302 M409	F302-F411 HydrophobicContact CE1-CD2 4.31Å; F302-F411 HydrophobicContact CE1-CE1 4.21Å; F302-F411 AromaticContact CE1-CE2 3.69Å; F302-F411 HydrophobicContact CE1-CE2 3.69Å; F302-F411 AromaticContact CE1-CZ 3.63Å; F302-F411 HydrophobicContact CE1-CZ 3.63Å; F302-F411 HydrophobicContact CZ-CD1 4.14Å; F302-F411 AromaticContact CZ-CD2 3.85Å; F302-F411 HydrophobicContact CZ-CD2 3.85Å; F302-F411 AromaticContact CZ-CE1 3.99Å; F302-F411 HydrophobicContact CZ-CE1 3.99Å; F302-F411 AromaticContact CZ-CE2 3.7Å; F302-F411 HydrophobicContact CZ-CE2 3.7Å; F302-F411 HydrophobicContact CZ-CG 4.06Å; F302-F411 AromaticContact CZ-CZ 3.76Å; F302-F411 HydrophobicContact CZ-CZ 3.76Å; M409-F411 HydrophobicContact CB-CD2 4.3Å; M409-F411 HydrophobicContact CB-CE1 4.49Å; M409-F411 HydrophobicContact CB-CE2 3.48Å; M409-F411 VanDerWaalsContact CB-CE2 3.48Å; M409-F411 HydrophobicContact CB-CZ 3.61Å; M409-F411 HydrophobicContact CE-CE2 3.97Å; M409-F411 HydrophobicContact CE-CZ 3.73Å; M409-F411 HydrophobicContact CG-CZ 4.25Å; M409-F411 HydrophobicContact SD-CE2 4.38Å; M409-F411 HydrophobicContact SD-CZ 3.74Å
412	G	55.4	Low	77.9	Confident	51 Å²	51	74.9 Å²	74.9	53%	0.526	40%	0.397	S	S	.	.			trans	-91.9	140.9	-178.9	0	0	0	0	0	113.2	R502	G412-R502 PolarHBondContact O-NH1 2.86Å
413	G	61.1	Low	77.4	Confident	42 Å²	42	73 Å²	73	43%	0.433	40%	0.395	S	S	.	.			trans	101.9	111.1	162.4	0	0	0	0	0	113.7
414	V	65.3	Low	77.3	Confident	70 Å²	70	74.2 Å²	74.2	42%	0.424	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-59.8	125.3	154.7	174.7	0	0	0	0	106.3	M505 F506	V414-M505 HydrophobicContact CG2-CE 4.12Å; V414-F506 WeakPolarHBondContact CG1-O 3.22Å
415	P	70.4	Confident	77.3	Confident	4 Å²	4	71.2 Å²	71.2	3%	0.026	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-56.2	149	177.3	-22.8	32.3	0	0	0	110.5	R502 S507	P415-R502 HydrophobicContact CG-CB 3.53Å; P415-S507 WeakPolarHBondContact O-CB 3.43Å
416	D	77.8	Confident	77.2	Confident	86 Å²	86	69.4 Å²	69.4	46%	0.46	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-61.6	144	172.4	-72.6	-39.7	0	0	0	110.4
417	P	84.2	Confident	77.2	Confident	51 Å²	51	66.2 Å²	66.2	33%	0.331	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-61.3	129.5	175.9	25.9	-33.1	0	0	0	109.4	P508	P417-P508 HydrophobicContact CB-CB 4.47Å; P417-P508 WeakPolarHBondContact CB-O 3.39Å
418	P	88.1	Confident	77.4	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-64	153.8	175.6	24.4	-28.9	0	0	0	110.3	W435 L437 V498 S510	P418-W435 HydrophobicContact CB-CB 4.27Å; P418-W435 HydrophobicContact CB-CG 4.09Å; P418-L437 HydrophobicContact CB-CD2 3.85Å; P418-V498 HydrophobicContact CB-CG1 4.31Å; P418-V498 HydrophobicContact CG-CB 3.79Å; P418-V498 HydrophobicContact CG-CG1 3.59Å; P418-V498 WeakPolarHBondContact CG-O 3.16Å; P418-S510 WeakPolarHBondContact O-CA 3.34Å; P418-S510 WeakPolarHBondContact O-CB 3.44Å
419	L	90.3	Very high	77.5	Confident	105 Å²	105	57.2 Å²	57.2	55%	0.55	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	114.9	177.1	-65.9	176.1	0	0	0	109.7	D421 W435 R436 P511	L419-D421 PolarHBondContact O-N 3.11Å; L419-W435 CarbonylContact O-C 3.57Å; L419-W435 WeakPolarHBondContact O-CA 3.22Å; L419-W435 VanDerWaalsContact O-CB 3.29Å; L419-W435 WeakPolarHBondContact O-CB 3.47Å; L419-R436 PolarHBondContact N-O 3.41Å; L419-R436 PolarHBondContact O-N 3.11Å; L419-P511 HydrophobicContact CD2-CG 4.41Å
420	I	90.9	Very high	78.1	Confident	13 Å²	13	58.3 Å²	58.3	7%	0.067	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	126.8	175.8	-63.5	172.9	0	0	0	109.1	I433 F496 V498 V513	I420-I433 HydrophobicContact CD1-CG2 4.34Å; I420-I433 HydrophobicContact CG1-CG2 4.34Å; I420-I433 HydrophobicContact CG2-CG2 3.91Å; I420-F496 HydrophobicContact CD1-CB 4.15Å; I420-V498 HydrophobicContact CD1-CG2 4.06Å; I420-V498 HydrophobicContact CG1-CG2 3.96Å; I420-V513 HydrophobicContact CB-CB 4.39Å; I420-V513 HydrophobicContact CB-CG2 3.84Å; I420-V513 HydrophobicContact CD1-CB 4.13Å; I420-V513 HydrophobicContact CD1-CG2 4.19Å; I420-V513 HydrophobicContact CG2-CB 4.14Å; I420-V513 HydrophobicContact CG2-CG1 4.09Å; I420-V513 HydrophobicContact CG2-CG2 4.01Å
421	D	87.8	Confident	79.2	Confident	13 Å²	13	55.3 Å²	55.3	7%	0.07	30%	0.297	C	S	.	.			trans	-90.9	106.4	-177	-165.5	-0.9	0	0	0	110.9	L419 S423 H424 S425 C434 R436	L419-D421 PolarHBondContact O-N 3.11Å; D421-S423 VanDerWaalsContact C-N 3.29Å; D421-S423 PolarHBondContact O-N 2.77Å; D421-S423 PolarHBondContact OD1-N 2.91Å; D421-S423 PolarHBondContact OD1-OG 3.25Å; D421-S423 VanDerWaalsContact OD1-OG 3.05Å; D421-H424 PolarHBondContact O-N 3.43Å; D421-H424 IonicContact OD2-CE1 2.81Å; D421-H424 IonicContact OD2-CG 2.88Å; D421-H424 IonicContact OD2-ND1 3.34Å; D421-H424 PolarHBondContact OD2-ND1 3.39Å; D421-S425 WeakPolarHBondContact O-CB 3.3Å; D421-S425 PolarHBondContact O-N 3.04Å; D421-S425 PolarHBondContact O-OG 3.29Å; D421-C434 PolarHBondContact N-O 3.24Å; D421-R436 IonicContact OD1-CZ 3.79Å; D421-R436 IonicContact OD1-NE 2.64Å; D421-R436 IonicContact OD1-NH2 3.95Å; D421-R436 PolarHBondContact OD1-NH2 3.37Å; D421-R436 VanDerWaalsContact OD1-NH2 3.11Å; D421-R436 IonicContact OD2-CZ 2.95Å; D421-R436 IonicContact OD2-NE 2.83Å; D421-R436 PolarHBondContact OD2-NE 2.98Å; D421-R436 IonicContact OD2-NH2 2.71Å; D421-R436 PolarHBondContact OD2-NH2 2.94Å
422	W	81.8	Confident	80.4	Confident	149 Å²	149	51.2 Å²	51.2	56%	0.564	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-33.8	-178.8	-67.4	85	0	0	0	112.9	H424 V513 F515	W422-H424 VanDerWaalsContact C-N 3.32Å; W422-H424 PolarHBondContact O-N 3Å; W422-V513 HydrophobicContact CD2-CG1 3.83Å; W422-V513 HydrophobicContact CD2-CG2 4.48Å; W422-V513 HydrophobicContact CE3-CG1 3.79Å; W422-V513 HydrophobicContact CH2-CB 4.18Å; W422-V513 HydrophobicContact CH2-CG1 3.52Å; W422-V513 HydrophobicContact CH2-CG2 4.36Å; W422-V513 HydrophobicContact CZ2-CB 3.86Å; W422-V513 HydrophobicContact CZ2-CG1 3.52Å; W422-V513 HydrophobicContact CZ2-CG2 3.55Å; W422-V513 HydrophobicContact CZ3-CG1 3.63Å; W422-F515 AromaticContact CE3-CE1 3.9Å; W422-F515 HydrophobicContact CE3-CE1 3.9Å; W422-F515 HydrophobicContact CE3-CZ 4.02Å; W422-F515 HydrophobicContact CZ3-CE1 4.26Å; W422-F515 HydrophobicContact CZ3-CZ 4.46Å
423	S	78.5	Confident	82.1	Confident	64 Å²	64	48.8 Å²	48.8	45%	0.448	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-22.4	-175.1	61.4	0	0	0	0	113.1	D421 R426	D421-S423 VanDerWaalsContact C-N 3.29Å; D421-S423 PolarHBondContact O-N 2.77Å; D421-S423 PolarHBondContact OD1-N 2.91Å; D421-S423 PolarHBondContact OD1-OG 3.25Å; D421-S423 VanDerWaalsContact OD1-OG 3.05Å; S423-R426 VanDerWaalsContact C-NH1 3.26Å; S423-R426 PolarHBondContact O-NH1 3.32Å; S423-R426 PolarHBondContact O-NH2 2.97Å
424	H	83.2	Confident	83.6	Confident	116 Å²	116	48.1 Å²	48.1	54%	0.537	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-19.1	-179.4	-61.4	111.8	0	0	0	113.2	D421 W422 C434	D421-H424 PolarHBondContact O-N 3.43Å; D421-H424 IonicContact OD2-CE1 2.81Å; D421-H424 IonicContact OD2-CG 2.88Å; D421-H424 IonicContact OD2-ND1 3.34Å; D421-H424 PolarHBondContact OD2-ND1 3.39Å; W422-H424 VanDerWaalsContact C-N 3.32Å; W422-H424 PolarHBondContact O-N 3Å; H424-C434 HydrophobicContact CB-CB 4.03Å
425	S	86.8	Confident	84.9	Confident	2 Å²	2	45 Å²	45	1%	0.014	23%	0.228	C	C	.	.			trans	-75.5	139.6	174.8	-59.1	0	0	0	0	111.6	D421 S432 C434 F515	D421-S425 WeakPolarHBondContact O-CB 3.3Å; D421-S425 PolarHBondContact O-N 3.04Å; D421-S425 PolarHBondContact O-OG 3.29Å; S425-S432 CarbonylContact C-O 3.55Å; S425-S432 VanDerWaalsContact CA-O 3.23Å; S425-S432 WeakPolarHBondContact CA-O 3.44Å; S425-C434 PolarHBondContact OG-N 3.45Å; S425-C434 PolarHBondContact OG-O 3.22Å; S425-F515 VanDerWaalsContact CB-CZ 3.49Å
426	R	82.5	Confident	85.8	Confident	76 Å²	76	52.2 Å²	52.2	29%	0.287	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	138.2	-176.1	-66.2	-63.9	-178.4	-82.9	-5.8	110.4	S423 Y428 A431 S432 R684	S423-R426 VanDerWaalsContact C-NH1 3.26Å; S423-R426 PolarHBondContact O-NH1 3.32Å; S423-R426 PolarHBondContact O-NH2 2.97Å; R426-Y428 HydrophobicContact CB-CD2 4.12Å; R426-Y428 HydrophobicContact CB-CE2 3.81Å; R426-Y428 HydrophobicContact CG-CE2 4.23Å; R426-A431 CarbonylContact O-C 3.57Å; R426-A431 WeakPolarHBondContact O-CA 3.46Å; R426-S432 PolarHBondContact N-O 3Å; R426-S432 PolarHBondContact O-N 3.09Å; R426-R684 VanDerWaalsContact NE-NH1 3.12Å
427	V	84.4	Confident	86.2	Confident	8 Å²	8	50.4 Å²	50.4	5%	0.048	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	108.7	178.9	-179.9	0	0	0	0	109.5	A431 I433 L488 F496 F515 T517	V427-A431 HydrophobicContact CB-CB 4.24Å; V427-A431 HydrophobicContact CG1-CB 4.1Å; V427-A431 HydrophobicContact CG2-CB 3.6Å; V427-I433 HydrophobicContact CG2-CD1 4.03Å; V427-L488 HydrophobicContact CG1-CD1 3.84Å; V427-F496 HydrophobicContact CG2-CE2 4.15Å; V427-F496 HydrophobicContact CG2-CZ 4.28Å; V427-F515 HydrophobicContact CB-CB 3.71Å; V427-F515 HydrophobicContact CB-CG 4.29Å; V427-F515 HydrophobicContact CG1-CB 4.28Å; V427-F515 HydrophobicContact CG2-CB 3.31Å; V427-F515 HydrophobicContact CG2-CD1 4.24Å; V427-F515 HydrophobicContact CG2-CD2 3.69Å; V427-F515 HydrophobicContact CG2-CG 3.5Å; V427-T517 HydrophobicContact CG1-CG2 3.59Å
428	Y	82.1	Confident	85.9	Confident	17 Å²	17	50.9 Å²	50.9	7%	0.067	25%	0.249	C	C	.	.	S	Bend	trans	-128.3	-118.2	178.8	-65.3	-72.1	0	0	0	109.9	R426 E430 P518 V522 Y585 R684 M704 F735	R426-Y428 HydrophobicContact CB-CD2 4.12Å; R426-Y428 HydrophobicContact CB-CE2 3.81Å; R426-Y428 HydrophobicContact CG-CE2 4.23Å; Y428-E430 PolarHBondContact N-O 2.97Å; Y428-P518 HydrophobicContact CD1-CG 3.66Å; Y428-P518 HydrophobicContact CE1-CG 4.49Å; Y428-P518 HydrophobicContact CG-CG 4.46Å; Y428-V522 HydrophobicContact CD1-CG2 4.16Å; Y428-V522 HydrophobicContact CG-CG2 4.29Å; Y428-Y585 HydrophobicContact CD1-CE1 4.49Å; Y428-Y585 HydrophobicContact CE1-CE1 4.39Å; Y428-R684 PolarHBondContact OH-NH1 3.4Å; Y428-M704 HydrophobicContact CE1-CE 4.31Å; Y428-F735 AromaticContact CD1-CD2 3.97Å; Y428-F735 HydrophobicContact CD1-CD2 3.97Å; Y428-F735 HydrophobicContact CD1-CE1 4.31Å; Y428-F735 AromaticContact CD1-CE2 3.37Å; Y428-F735 HydrophobicContact CD1-CE2 3.37Å; Y428-F735 AromaticContact CD1-CZ 3.61Å; Y428-F735 HydrophobicContact CD1-CZ 3.61Å; Y428-F735 HydrophobicContact CD2-CB 4.42Å; Y428-F735 AromaticContact CD2-CD1 3.62Å; Y428-F735 HydrophobicContact CD2-CD1 3.62Å; Y428-F735 AromaticContact CD2-CD2 3.66Å; Y428-F735 HydrophobicContact CD2-CD2 3.66Å; Y428-F735 AromaticContact CD2-CE1 3.72Å; Y428-F735 HydrophobicContact CD2-CE1 3.72Å; Y428-F735 AromaticContact CD2-CE2 3.77Å; Y428-F735 HydrophobicContact CD2-CE2 3.77Å; Y428-F735 AromaticContact CD2-CG 3.61Å; Y428-F735 HydrophobicContact CD2-CG 3.61Å; Y428-F735 AromaticContact CD2-CZ 3.83Å; Y428-F735 HydrophobicContact CD2-CZ 3.83Å; Y428-F735 HydrophobicContact CE1-CD2 4.33Å; Y428-F735 AromaticContact CE1-CE1 3.76Å; Y428-F735 HydrophobicContact CE1-CE1 3.76Å; Y428-F735 AromaticContact CE1-CE2 3.46Å; Y428-F735 HydrophobicContact CE1-CE2 3.46Å; Y428-F735 VanDerWaalsContact CE1-CE2 3.46Å; Y428-F735 AromaticContact CE1-CZ 3.13Å; Y428-F735 HydrophobicContact CE1-CZ 3.13Å; Y428-F735 AromaticContact CE2-CD1 3.28Å; Y428-F735 HydrophobicContact CE2-CD1 3.28Å; Y428-F735 HydrophobicContact CE2-CD2 4.01Å; Y428-F735 AromaticContact CE2-CE1 3.02Å; Y428-F735 HydrophobicContact CE2-CE1 3.02Å; Y428-F735 AromaticContact CE2-CE2 3.82Å; Y428-F735 HydrophobicContact CE2-CE2 3.82Å; Y428-F735 AromaticContact CE2-CG 3.79Å; Y428-F735 HydrophobicContact CE2-CG 3.79Å; Y428-F735 AromaticContact CE2-CZ 3.36Å; Y428-F735 HydrophobicContact CE2-CZ 3.36Å; Y428-F735 HydrophobicContact CG-CD1 4.4Å; Y428-F735 AromaticContact CG-CD2 3.65Å; Y428-F735 HydrophobicContact CG-CD2 3.65Å; Y428-F735 HydrophobicContact CG-CE1 4.32Å; Y428-F735 AromaticContact CG-CE2 3.57Å; Y428-F735 HydrophobicContact CG-CE2 3.57Å; Y428-F735 HydrophobicContact CG-CG 4.11Å; Y428-F735 AromaticContact CG-CZ 3.96Å; Y428-F735 HydrophobicContact CG-CZ 3.96Å; Y428-F735 AromaticContact CZ-CD1 3.85Å; Y428-F735 AromaticContact CZ-CE1 3.06Å; Y428-F735 AromaticContact CZ-CE2 3.69Å; Y428-F735 AromaticContact CZ-CZ 3Å; Y428-F735 VanDerWaalsContact OH-CE1 3.23Å; Y428-F735 WeakPolarHBondContact OH-CE1 3.37Å; Y428-F735 WeakPolarHBondContact OH-CZ 3.35Å
429	N	79.9	Confident	85	Confident	74 Å²	74	60.1 Å²	60.1	40%	0.396	29%	0.293	S	S	.	.	S	Bend	trans	-66.9	-32.1	167.5	-66	-14.4	0	0	0	111.2	V522	N429-V522 PolarHBondContact OD1-N 3.23Å
430	E	83.8	Confident	83.9	Confident	94 Å²	94	62.2 Å²	62.2	44%	0.439	31%	0.305	S	S	.	.	S	Bend	trans	-128.4	149.8	175.9	-59.4	178.1	165.6	0	0	107.6	Y428 V485 H486	Y428-E430 PolarHBondContact N-O 2.97Å; E430-V485 WeakPolarHBondContact CA-O 3.39Å; E430-H486 VanDerWaalsContact CD-CE1 3.44Å; E430-H486 IonicContact OE1-CE1 3.11Å; E430-H486 PolarHBondContact OE1-CE1 3.35Å; E430-H486 VanDerWaalsContact OE1-CE1 3.31Å; E430-H486 IonicContact OE1-ND1 2.55Å; E430-H486 PolarHBondContact OE1-ND1 2.96Å; E430-H486 IonicContact OE2-CE1 2.89Å; E430-H486 IonicContact OE2-ND1 3.91Å
431	A	85.8	Confident	82.9	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	114.2	172	0	0	0	0	0	110.5	R426 V427 I433 L484 V485 L488 F496	R426-A431 CarbonylContact O-C 3.57Å; R426-A431 WeakPolarHBondContact O-CA 3.46Å; V427-A431 HydrophobicContact CB-CB 4.24Å; V427-A431 HydrophobicContact CG1-CB 4.1Å; V427-A431 HydrophobicContact CG2-CB 3.6Å; A431-I433 HydrophobicContact CB-CD1 4.15Å; A431-I433 HydrophobicContact CB-CG1 4.28Å; A431-L484 CarbonylContact O-C 3.46Å; A431-L484 WeakPolarHBondContact O-CA 3.36Å; A431-V485 HydrophobicContact CB-CB 4.19Å; A431-V485 PolarHBondContact N-O 3.29Å; A431-V485 PolarHBondContact O-N 2.99Å; A431-L488 HydrophobicContact CB-CD1 3.45Å; A431-L488 VanDerWaalsContact CB-CD1 3.45Å; A431-F496 HydrophobicContact CB-CE1 4Å; A431-F496 HydrophobicContact CB-CZ 3.78Å
432	S	88.8	Confident	81.9	Confident	40 Å²	40	67.8 Å²	67.8	28%	0.28	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	106.3	165.5	-175.6	0	0	0	0	108.2	S425 R426	S425-S432 CarbonylContact C-O 3.55Å; S425-S432 VanDerWaalsContact CA-O 3.23Å; S425-S432 WeakPolarHBondContact CA-O 3.44Å; R426-S432 PolarHBondContact N-O 3Å; R426-S432 PolarHBondContact O-N 3.09Å
433	I	91.4	Very high	81.3	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119.8	-179.6	-54.3	-58.6	0	0	0	108.4	I420 V427 A431 W435 L449 S482 A483 F496 F515	I420-I433 HydrophobicContact CD1-CG2 4.34Å; I420-I433 HydrophobicContact CG1-CG2 4.34Å; I420-I433 HydrophobicContact CG2-CG2 3.91Å; V427-I433 HydrophobicContact CG2-CD1 4.03Å; A431-I433 HydrophobicContact CB-CD1 4.15Å; A431-I433 HydrophobicContact CB-CG1 4.28Å; I433-W435 HydrophobicContact CG2-CE3 4.31Å; I433-W435 VanDerWaalsContact O-CZ3 3.31Å; I433-W435 WeakPolarHBondContact O-CZ3 3.44Å; I433-L449 HydrophobicContact CB-CD1 4.39Å; I433-L449 HydrophobicContact CB-CD2 4.04Å; I433-L449 HydrophobicContact CG1-CD2 4.1Å; I433-L449 HydrophobicContact CG2-CD1 4.05Å; I433-S482 CarbonylContact O-C 3.5Å; I433-S482 WeakPolarHBondContact O-CA 3.2Å; I433-A483 PolarHBondContact N-O 3.13Å; I433-A483 PolarHBondContact O-N 2.9Å; I433-F496 HydrophobicContact CD1-CD1 3.93Å; I433-F496 HydrophobicContact CD1-CD2 4.15Å; I433-F496 HydrophobicContact CD1-CE1 4.03Å; I433-F496 HydrophobicContact CD1-CE2 4.24Å; I433-F496 HydrophobicContact CD1-CG 3.98Å; I433-F496 HydrophobicContact CD1-CZ 4.19Å; I433-F496 HydrophobicContact CG1-CD1 3.66Å; I433-F496 HydrophobicContact CG1-CE1 3.88Å; I433-F496 HydrophobicContact CG1-CG 4.14Å; I433-F515 HydrophobicContact CD1-CD2 3.91Å; I433-F515 HydrophobicContact CD1-CE2 3.76Å
434	C	91.5	Very high	81.1	Confident	29 Å²	29	63.4 Å²	63.4	20%	0.196	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	145.2	178.3	-62.2	0	0	0	0	109.5	D421 H424 S425 S481	D421-C434 PolarHBondContact N-O 3.24Å; H424-C434 HydrophobicContact CB-CB 4.03Å; S425-C434 PolarHBondContact OG-N 3.45Å; S425-C434 PolarHBondContact OG-O 3.22Å; C434-S481 WeakPolarHBondContact CA-O 3.47Å
435	W	93.2	Very high	81	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.015	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	162.2	175.1	55.5	90.1	0	0	0	111.5	P418 L419 I433 H447 V478 G480 S481 A483 V498	P418-W435 HydrophobicContact CB-CB 4.27Å; P418-W435 HydrophobicContact CB-CG 4.09Å; L419-W435 CarbonylContact O-C 3.57Å; L419-W435 WeakPolarHBondContact O-CA 3.22Å; L419-W435 VanDerWaalsContact O-CB 3.29Å; L419-W435 WeakPolarHBondContact O-CB 3.47Å; I433-W435 HydrophobicContact CG2-CE3 4.31Å; I433-W435 VanDerWaalsContact O-CZ3 3.31Å; I433-W435 WeakPolarHBondContact O-CZ3 3.44Å; W435-H447 HydrophobicContact CZ2-CB 3.66Å; W435-H447 AromaticContact CZ2-CD2 3.97Å; W435-H447 AromaticContact CZ2-CG 3.89Å; W435-H447 AromaticContact NE1-CD2 3.64Å; W435-H447 AromaticContact NE1-CE1 3.93Å; W435-H447 AromaticContact NE1-CG 3.62Å; W435-H447 AromaticContact NE1-ND1 3.8Å; W435-H447 AromaticContact NE1-NE2 3.82Å; W435-V478 HydrophobicContact CH2-CB 4.11Å; W435-V478 HydrophobicContact CH2-CG1 3.78Å; W435-V478 HydrophobicContact CH2-CG2 4.22Å; W435-V478 HydrophobicContact CZ2-CB 4.19Å; W435-V478 HydrophobicContact CZ2-CG1 3.89Å; W435-G480 WeakPolarHBondContact CZ2-O 3.14Å; W435-S481 PolarHBondContact N-O 3.34Å; W435-S481 WeakPolarHBondContact O-CB 3.46Å; W435-A483 HydrophobicContact CH2-CB 3.78Å; W435-A483 HydrophobicContact CZ3-CB 3.91Å; W435-V498 HydrophobicContact CD2-CB 4.45Å; W435-V498 HydrophobicContact CD2-CG1 3.92Å; W435-V498 HydrophobicContact CD2-CG2 4.07Å; W435-V498 HydrophobicContact CE3-CG1 4.24Å; W435-V498 HydrophobicContact CE3-CG2 3.67Å; W435-V498 HydrophobicContact CG-CG1 4.34Å; W435-V498 HydrophobicContact CH2-CG1 4.34Å; W435-V498 HydrophobicContact CZ2-CG1 4.08Å; W435-V498 HydrophobicContact CZ3-CG1 4.43Å; W435-V498 HydrophobicContact CZ3-CG2 3.93Å
436	R	89.9	Confident	80.9	Confident	156 Å²	156	62.2 Å²	62.2	59%	0.589	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	146.5	175.7	-69.6	-173.6	-92.7	146.6	-2.3	110.1	L419 D421	L419-R436 PolarHBondContact N-O 3.41Å; L419-R436 PolarHBondContact O-N 3.11Å; D421-R436 IonicContact OD1-CZ 3.79Å; D421-R436 IonicContact OD1-NE 2.64Å; D421-R436 IonicContact OD1-NH2 3.95Å; D421-R436 PolarHBondContact OD1-NH2 3.37Å; D421-R436 VanDerWaalsContact OD1-NH2 3.11Å; D421-R436 IonicContact OD2-CZ 2.95Å; D421-R436 IonicContact OD2-NE 2.83Å; D421-R436 PolarHBondContact OD2-NE 2.98Å; D421-R436 IonicContact OD2-NH2 2.71Å; D421-R436 PolarHBondContact OD2-NH2 2.94Å
437	L	84.6	Confident	81.3	Confident	48 Å²	48	59.1 Å²	59.1	25%	0.251	31%	0.305	S	S	.	.			trans	-102.9	156.7	172.6	-61.1	169.5	0	0	0	108.7	P418 H441	P418-L437 HydrophobicContact CB-CD2 3.85Å; L437-H441 HydrophobicContact CB-CB 4.04Å
438	S	77.9	Confident	81.6	Confident	60 Å²	60	59.5 Å²	59.5	42%	0.42	31%	0.308	S	S	.	.			trans	-59.6	149.8	174.4	-170.3	0	0	0	0	110.7	D440 H441	S438-D440 PolarHBondContact O-N 3.45Å; S438-H441 VanDerWaalsContact O-CB 3.28Å; S438-H441 WeakPolarHBondContact O-CB 3.16Å; S438-H441 VanDerWaalsContact O-CG 3.32Å; S438-H441 PolarHBondContact O-N 3.36Å; S438-H441 VanDerWaalsContact O-N 3.08Å; S438-H441 PolarHBondContact O-ND1 3.04Å
439	E	70	Confident	82.1	Confident	194 Å²	194	58.7 Å²	58.7	91%	0.907	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-29.6	178.8	-68.2	-176	172	0	0	111.9
440	D	66.7	Low	82.7	Confident	150 Å²	150	56 Å²	56	80%	0.802	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	20.5	177.1	-65.3	-31.1	0	0	0	113.7	S438	S438-D440 PolarHBondContact O-N 3.45Å
441	H	69.4	Low	83.1	Confident	82 Å²	82	53.2 Å²	53.2	38%	0.38	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-64.5	141.7	-175.5	69.7	-74	0	0	0	112.9	L437 S438	L437-H441 HydrophobicContact CB-CB 4.04Å; S438-H441 VanDerWaalsContact O-CB 3.28Å; S438-H441 WeakPolarHBondContact O-CB 3.16Å; S438-H441 VanDerWaalsContact O-CG 3.32Å; S438-H441 PolarHBondContact O-N 3.36Å; S438-H441 VanDerWaalsContact O-N 3.08Å; S438-H441 PolarHBondContact O-ND1 3.04Å
442	L	67.1	Low	83.4	Confident	61 Å²	61	56.2 Å²	56.2	32%	0.319	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-66.6	145.9	169.5	-66	167	0	0	0	109.9	T444	L442-T444 PolarHBondContact O-N 3.17Å; L442-T444 PolarHBondContact O-OG1 3Å
443	P	70.1	Confident	83.4	Confident	86 Å²	86	58 Å²	58	56%	0.558	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-57.8	127.8	177	22.8	-32.1	0	0	0	109.5	R502	P443-R502 WeakPolarHBondContact O-CD 3.29Å; P443-R502 VanDerWaalsContact O-CG 3.29Å; P443-R502 WeakPolarHBondContact O-CG 3.49Å; P443-R502 PolarHBondContact O-NE 2.8Å
444	T	73.5	Confident	83.1	Confident	35 Å²	35	60.5 Å²	60.5	22%	0.215	30%	0.302	C	S	.	.			trans	-106.5	136.7	-173.6	-43.6	0	0	0	0	109.3	L442 C501	L442-T444 PolarHBondContact O-N 3.17Å; L442-T444 PolarHBondContact O-OG1 3Å; T444-C501 WeakPolarHBondContact CG2-O 3.19Å
445	D	81.8	Confident	82	Confident	76 Å²	76	61.9 Å²	61.9	41%	0.406	32%	0.321	S	S	.	.	S	Bend	trans	-75	-46.3	-179.4	-58	-26.6	0	0	0	110.9	Y479 C501 R502 N503	D445-Y479 VanDerWaalsContact O-CD1 3.27Å; D445-Y479 WeakPolarHBondContact O-CD1 3.37Å; D445-C501 PolarHBondContact N-O 3.37Å; D445-R502 WeakPolarHBondContact OD2-CA 3.49Å; D445-N503 PolarHBondContact OD2-N 3.14Å
446	H	85.6	Confident	80.1	Confident	17 Å²	17	64.9 Å²	64.9	8%	0.079	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162	166.5	178.6	63.2	-74.2	0	0	0	110.9	R477 V478 Y479 C501	H446-R477 HydrophobicContact CB-CB 4.21Å; H446-V478 CarbonylContact C-O 3.52Å; H446-V478 WeakPolarHBondContact CA-O 3.25Å; H446-Y479 HydrophobicContact CB-CD1 4.2Å; H446-Y479 HydrophobicContact CB-CE1 4.11Å; H446-C501 VanDerWaalsContact CE1-CB 3.44Å; H446-C501 WeakPolarHBondContact CE1-CB 3.32Å; H446-C501 PolarHBondContact CE1-SG 3.49Å; H446-C501 PolarHBondContact N-O 3.26Å; H446-C501 WeakPolarHBondContact O-CB 3.48Å; H446-C501 PolarHBondContact O-N 3.44Å
447	H	89.9	Confident	77.8	Confident	10 Å²	10	67.1 Å²	67.1	5%	0.046	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	155.7	172.5	-53.7	-77.9	0	0	0	110.6	W435 V478 G480 V498 R499 S500	W435-H447 HydrophobicContact CZ2-CB 3.66Å; W435-H447 AromaticContact CZ2-CD2 3.97Å; W435-H447 AromaticContact CZ2-CG 3.89Å; W435-H447 AromaticContact NE1-CD2 3.64Å; W435-H447 AromaticContact NE1-CE1 3.93Å; W435-H447 AromaticContact NE1-CG 3.62Å; W435-H447 AromaticContact NE1-ND1 3.8Å; W435-H447 AromaticContact NE1-NE2 3.82Å; H447-V478 HydrophobicContact CB-CB 4.36Å; H447-V478 PolarHBondContact N-O 2.81Å; H447-V478 PolarHBondContact O-N 3.43Å; H447-G480 PolarHBondContact CD2-O 3.37Å; H447-V498 HydrophobicContact CB-CG1 4.06Å; H447-R499 CarbonylContact C-O 3.48Å; H447-R499 VanDerWaalsContact CA-O 3.27Å; H447-R499 WeakPolarHBondContact CA-O 3.42Å; H447-S500 PolarHBondContact CE1-OG 2.95Å; H447-S500 PolarHBondContact ND1-OG 2.8Å
448	V	91.4	Very high	75.6	Confident	16 Å²	16	69.4 Å²	69.4	10%	0.097	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	111.5	173.3	-177.7	0	0	0	0	107.7	E450 A474 V498 R499 F506	V448-E450 HydrophobicContact CG1-CG 4.31Å; V448-A474 HydrophobicContact CG1-CB 4.16Å; V448-V498 WeakPolarHBondContact O-CA 3.35Å; V448-R499 HydrophobicContact CB-CG 4.1Å; V448-R499 PolarHBondContact N-O 3.16Å; V448-R499 PolarHBondContact O-N 3.08Å; V448-F506 HydrophobicContact CG2-CE1 4.21Å
449	L	92.3	Very high	73.6	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	129.4	169.8	171.7	68.9	0	0	0	108.5	I433 A474 A475 A483 V485 F496 V498	I433-L449 HydrophobicContact CB-CD1 4.39Å; I433-L449 HydrophobicContact CB-CD2 4.04Å; I433-L449 HydrophobicContact CG1-CD2 4.1Å; I433-L449 HydrophobicContact CG2-CD1 4.05Å; L449-A474 WeakPolarHBondContact O-CA 3.42Å; L449-A475 HydrophobicContact CB-CB 4.21Å; L449-A475 PolarHBondContact O-N 3.25Å; L449-A483 HydrophobicContact CB-CB 4.49Å; L449-A483 HydrophobicContact CD2-CB 3.78Å; L449-V485 HydrophobicContact CD2-CG2 3.59Å; L449-F496 HydrophobicContact CD1-CB 4.25Å; L449-F496 HydrophobicContact CD1-CD1 4.2Å; L449-V498 HydrophobicContact CB-CG2 4.17Å; L449-V498 HydrophobicContact CD1-CG2 3.36Å; L449-V498 HydrophobicContact CG-CG2 4.36Å
450	E	93	Very high	71.8	Confident	17 Å²	17	71.4 Å²	71.4	8%	0.079	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	144.4	171.4	-73.4	176.2	-166.1	0	0	110.7	V448 W472 R473 A474 F496 R497 Y509	V448-E450 HydrophobicContact CG1-CG 4.31Å; E450-W472 HydrophobicContact CB-CB 4.27Å; E450-W472 HydrophobicContact CB-CD2 4.44Å; E450-W472 HydrophobicContact CB-CE3 3.82Å; E450-R473 CarbonylContact C-O 3.54Å; E450-R473 WeakPolarHBondContact CA-O 3.42Å; E450-A474 HydrophobicContact CG-CB 4.02Å; E450-F496 CarbonylContact O-C 3.38Å; E450-F496 WeakPolarHBondContact O-CA 3.3Å; E450-R497 HydrophobicContact CB-CG 3.93Å; E450-R497 PolarHBondContact N-O 2.98Å; E450-R497 PolarHBondContact O-N 2.98Å; E450-R497 IonicContact OE2-CZ 3.8Å; E450-R497 IonicContact OE2-NE 3.85Å; E450-R497 PolarHBondContact OE2-NE 3.17Å; E450-R497 IonicContact OE2-NH2 3.18Å; E450-R497 PolarHBondContact OE2-NH2 2.99Å; E450-Y509 HydrophobicContact CG-CE1 4.27Å; E450-Y509 PolarHBondContact OE1-OH 3.45Å; E450-Y509 WeakPolarHBondContact OE2-CE1 3.49Å; E450-Y509 PolarHBondContact OE2-OH 3.22Å
451	Y	91.6	Very high	70.4	Confident	37 Å²	37	70.3 Å²	70.3	15%	0.145	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	153.1	177.4	66.9	-82.1	0	0	0	111.8	R473 V485 L488 Y494 A495 F496	Y451-R473 HydrophobicContact CD1-CB 4.29Å; Y451-R473 WeakPolarHBondContact CD1-O 3.41Å; Y451-R473 HydrophobicContact CD2-CB 4.45Å; Y451-R473 HydrophobicContact CE1-CB 3.85Å; Y451-R473 HydrophobicContact CE2-CB 4.03Å; Y451-R473 PolarHBondContact N-O 3.15Å; Y451-R473 PolarHBondContact O-N 3.19Å; Y451-V485 HydrophobicContact CD1-CG1 3.87Å; Y451-V485 HydrophobicContact CD1-CG2 4.12Å; Y451-V485 HydrophobicContact CD2-CG1 4.18Å; Y451-V485 HydrophobicContact CE1-CG1 3.53Å; Y451-V485 HydrophobicContact CE1-CG2 4.28Å; Y451-V485 HydrophobicContact CE2-CG1 3.86Å; Y451-V485 HydrophobicContact CG-CG1 4.2Å; Y451-L488 HydrophobicContact CD2-CD2 4.22Å; Y451-L488 HydrophobicContact CE2-CD2 4.21Å; Y451-Y494 HydrophobicContact CD2-CD1 4.21Å; Y451-Y494 HydrophobicContact CD2-CE1 4.44Å; Y451-A495 CarbonylContact C-O 3.52Å; Y451-A495 WeakPolarHBondContact CA-O 3.12Å; Y451-F496 VanDerWaalsContact CB-CD1 3.47Å; Y451-F496 HydrophobicContact CG-CD1 4.49Å; Y451-F496 HydrophobicContact CG-CE1 4.21Å
452	R	90.9	Very high	68.6	Low	63 Å²	63	71.7 Å²	71.7	24%	0.238	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	149.6	173.3	65.5	175.6	175	-179.6	-5.7	110.9	L454 W472 Y494 A495 E512	R452-L454 HydrophobicContact CG-CD2 4.38Å; R452-W472 HydrophobicContact CB-CD2 4.28Å; R452-W472 HydrophobicContact CB-CE3 4.12Å; R452-W472 HydrophobicContact CB-CZ3 4.49Å; R452-W472 HydrophobicContact CG-CD2 4.09Å; R452-W472 HydrophobicContact CG-CE3 3.94Å; R452-W472 HydrophobicContact CG-CH2 3.99Å; R452-W472 HydrophobicContact CG-CZ2 4.11Å; R452-W472 HydrophobicContact CG-CZ3 3.89Å; R452-W472 VanDerWaalsContact CZ-CZ2 3.47Å; R452-Y494 CarbonylContact O-C 3.18Å; R452-Y494 VanDerWaalsContact O-CA 3.3Å; R452-Y494 WeakPolarHBondContact O-CA 3.3Å; R452-A495 HydrophobicContact CG-CB 4.06Å; R452-A495 PolarHBondContact N-O 3.37Å; R452-A495 PolarHBondContact O-N 2.7Å; R452-E512 IonicContact CZ-OE2 2.7Å; R452-E512 IonicContact NH2-OE1 3.45Å; R452-E512 IonicContact NH2-OE2 2.94Å; R452-E512 PolarHBondContact NH2-OE2 3.4Å
453	K	88.8	Confident	67.4	Low	77 Å²	77	75.4 Å²	75.4	34%	0.335	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	129.8	169.9	-170.4	176.5	175.5	174.7	0	109.4	E489 S492 Y494	K453-E489 IonicContact NZ-OE2 3.37Å; K453-E489 PolarHBondContact NZ-OE2 3.05Å; K453-S492 WeakPolarHBondContact CE-OG 3.46Å; K453-S492 PolarHBondContact NZ-OG 3.48Å; K453-S492 VanDerWaalsContact NZ-OG 3.08Å; K453-Y494 HydrophobicContact CB-CD1 4.1Å; K453-Y494 HydrophobicContact CB-CE1 3.69Å; K453-Y494 HydrophobicContact CG-CE1 4.19Å
454	L	85.1	Confident	65.8	Low	52 Å²	52	74.1 Å²	74.1	27%	0.272	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	117.2	172.8	-63.8	-178.4	0	0	0	108.4	R452 G456 L493 A495	R452-L454 HydrophobicContact CG-CD2 4.38Å; L454-G456 PolarHBondContact O-N 2.83Å; L454-L493 HydrophobicContact CB-CB 4.27Å; L454-L493 HydrophobicContact CB-CD2 4.13Å; L454-L493 HydrophobicContact CB-CG 4.29Å; L454-L493 HydrophobicContact CD1-CD2 3.68Å; L454-L493 HydrophobicContact CD1-CG 4Å; L454-L493 PolarHBondContact N-O 3.18Å; L454-A495 HydrophobicContact CD1-CB 4.04Å; L454-A495 HydrophobicContact CD2-CB 4.12Å; L454-A495 HydrophobicContact CG-CB 4.06Å
455	G	70.1	Confident	63.9	Low	58 Å²	58	80.5 Å²	80.5	60%	0.598	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-59.5	130.2	-170.7	0	0	0	0	0	113.8
456	G	51.7	Low	61.8	Low	68 Å²	68	80.5 Å²	80.5	70%	0.701	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-81.2	123.6	170.3	0	0	0	0	0	111.3	L454 S458	L454-G456 PolarHBondContact O-N 2.83Å; G456-S458 VanDerWaalsContact C-N 3.3Å; G456-S458 PolarHBondContact O-N 3.34Å
457	Q	41.6	Very low	59.8	Low	202 Å²	202	89.3 Å²	89.3	94%	0.944	55%	0.547	S	S	*	.	S	Bend	trans	-73	83.6	166	-74.2	-173.3	8.5	0	0	109.9
458	S	38.7	Very low	57.7	Low	97 Å²	97	92.9 Å²	92.9	68%	0.678	57%	0.567	S	S	*	*			trans	-170.2	77.2	159.3	52.1	0	0	0	0	111	G456	G456-S458 VanDerWaalsContact C-N 3.3Å; G456-S458 PolarHBondContact O-N 3.34Å
459	Q	37.1	Very low	55.8	Low	194 Å²	194	99.3 Å²	99.3	91%	0.907	60%	0.601	S	S	*	*	S	Bend	trans	172.2	138.6	135.7	-91.4	162.6	61.8	0	0	108.8
460	S	32.2	Very low	54.2	Low	102 Å²	102	101 Å²	101	71%	0.713	62%	0.618	S	S	*	*			trans	-45.6	143.7	-177.5	38.4	0	0	0	0	114.2	S462	S460-S462 PolarHBondContact O-N 3.17Å
461	P	37	Very low	53.6	Low	127 Å²	127	104.8 Å²	104.8	83%	0.825	64%	0.642	S	S	*	*			trans	-73.2	114.4	-179.1	29.9	-31.9	0	0	0	110.5
462	S	31.8	Very low	53.3	Low	110 Å²	110	105.2 Å²	105.2	77%	0.769	64%	0.644	S	S	*	*			trans	-75.3	127.8	161.5	-61.5	0	0	0	0	108.7	S460 G464	S460-S462 PolarHBondContact O-N 3.17Å; S462-G464 PolarHBondContact O-N 3.12Å
463	P	42.3	Very low	53.1	Low	139 Å²	139	107.5 Å²	107.5	90%	0.903	65%	0.652	S	S	*	*	S	Bend	trans	-82.5	104.5	179.5	30.9	-28.6	0	0	0	109
464	G	35.7	Very low	52.8	Low	59 Å²	59	106.9 Å²	106.9	61%	0.608	66%	0.662	S	S	*	*			trans	139.6	69.8	171.3	0	0	0	0	0	113.1	S462	S462-G464 PolarHBondContact O-N 3.12Å
465	N	34.1	Very low	52.4	Low	169 Å²	169	105.6 Å²	105.6	90%	0.904	66%	0.658	S	S	*	*	S	Bend	trans	-180	143.9	136.4	-85.8	-19	0	0	0	108
466	G	37.2	Very low	52.8	Low	76 Å²	76	109.9 Å²	109.9	78%	0.784	67%	0.668	S	S	*	*			trans	-47.6	144.4	-159.5	0	0	0	0	0	116.8	D468	G466-D468 PolarHBondContact O-N 3.22Å
467	E	42.6	Very low	54.3	Low	202 Å²	202	114.5 Å²	114.5	94%	0.944	66%	0.664	S	S	*	*			trans	-55.9	94.6	169.8	-60.3	169.1	144.5	0	0	111
468	D	46.4	Very low	56.4	Low	85 Å²	85	105.8 Å²	105.8	46%	0.455	63%	0.625	S	S	.	*			trans	-108.8	24.5	166.1	-161.2	32.4	0	0	0	112.1	G466 G470 R473	G466-D468 PolarHBondContact O-N 3.22Å; D468-G470 PolarHBondContact O-N 2.91Å; D468-R473 IonicContact OD2-CZ 2.64Å; D468-R473 IonicContact OD2-NH2 2.91Å; D468-R473 PolarHBondContact OD2-NH2 3.22Å
469	N	51.8	Low	58.6	Low	152 Å²	152	109.6 Å²	109.6	81%	0.813	63%	0.625	S	S	*	*	S	Bend	trans	-87.7	77.9	175.3	-85.6	-18.4	0	0	0	110.4
470	G	59.6	Low	60.9	Low	36 Å²	36	102.1 Å²	102.1	37%	0.371	60%	0.6	S	S	.	*	S	Bend	trans	147.5	-2.7	161.3	0	0	0	0	0	117.8	D468	D468-G470 PolarHBondContact O-N 2.91Å
471	V	79.6	Confident	63.5	Low	96 Å²	96	100.5 Å²	100.5	58%	0.582	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-76.4	130.2	-179	-174.4	0	0	0	0	110.2	R473	V471-R473 PolarHBondContact O-N 2.87Å
472	W	85	Confident	66	Low	46 Å²	46	97.3 Å²	97.3	17%	0.174	57%	0.569	C	S	.	*	P	Polyproline II helix	trans	-72.2	123.7	172.4	-72.2	94.6	0	0	0	109.9	E450 R452 A495 R497 E512	E450-W472 HydrophobicContact CB-CB 4.27Å; E450-W472 HydrophobicContact CB-CD2 4.44Å; E450-W472 HydrophobicContact CB-CE3 3.82Å; R452-W472 HydrophobicContact CB-CD2 4.28Å; R452-W472 HydrophobicContact CB-CE3 4.12Å; R452-W472 HydrophobicContact CB-CZ3 4.49Å; R452-W472 HydrophobicContact CG-CD2 4.09Å; R452-W472 HydrophobicContact CG-CE3 3.94Å; R452-W472 HydrophobicContact CG-CH2 3.99Å; R452-W472 HydrophobicContact CG-CZ2 4.11Å; R452-W472 HydrophobicContact CG-CZ3 3.89Å; R452-W472 VanDerWaalsContact CZ-CZ2 3.47Å; W472-A495 HydrophobicContact CH2-CB 3.97Å; W472-A495 HydrophobicContact CZ3-CB 4.39Å; W472-A495 WeakPolarHBondContact CZ3-O 3.38Å; W472-R497 VanDerWaalsContact CD1-NH2 3.26Å; W472-R497 HydrophobicContact CE3-CG 3.97Å; W472-R497 HydrophobicContact CH2-CB 4.34Å; W472-R497 HydrophobicContact CH2-CG 3.88Å; W472-R497 HydrophobicContact CZ2-CG 4.43Å; W472-R497 HydrophobicContact CZ3-CB 4.33Å; W472-R497 HydrophobicContact CZ3-CG 3.63Å; W472-E512 HydrophobicContact CH2-CG 3.98Å; W472-E512 HydrophobicContact CZ2-CG 4.22Å; W472-E512 WeakPolarHBondContact CZ2-OE1 3.39Å
473	R	86.8	Confident	68.7	Low	111 Å²	111	92.6 Å²	92.6	42%	0.419	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	126.7	173.1	-62.2	-179	-173.7	172	2	108.4	E450 Y451 D468 V471	E450-R473 CarbonylContact C-O 3.54Å; E450-R473 WeakPolarHBondContact CA-O 3.42Å; Y451-R473 HydrophobicContact CD1-CB 4.29Å; Y451-R473 WeakPolarHBondContact CD1-O 3.41Å; Y451-R473 HydrophobicContact CD2-CB 4.45Å; Y451-R473 HydrophobicContact CE1-CB 3.85Å; Y451-R473 HydrophobicContact CE2-CB 4.03Å; Y451-R473 PolarHBondContact N-O 3.15Å; Y451-R473 PolarHBondContact O-N 3.19Å; D468-R473 IonicContact OD2-CZ 2.64Å; D468-R473 IonicContact OD2-NH2 2.91Å; D468-R473 PolarHBondContact OD2-NH2 3.22Å; V471-R473 PolarHBondContact O-N 2.87Å
474	A	82.1	Confident	70.9	Confident	64 Å²	64	90.7 Å²	90.7	53%	0.529	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	135.9	176.2	0	0	0	0	0	110.3	V448 L449 E450	V448-A474 HydrophobicContact CG1-CB 4.16Å; L449-A474 WeakPolarHBondContact O-CA 3.42Å; E450-A474 HydrophobicContact CG-CB 4.02Å
475	A	76.2	Confident	73.4	Confident	25 Å²	25	88.2 Å²	88.2	21%	0.207	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-74.9	161.6	161.4	0	0	0	0	0	109.9	L449	L449-A475 HydrophobicContact CB-CB 4.21Å; L449-A475 PolarHBondContact O-N 3.25Å
476	D	78.6	Confident	75.9	Confident	148 Å²	148	84.3 Å²	84.3	79%	0.791	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-58	164.8	174.4	-71.9	-35.4	0	0	0	112.2	V478	D476-V478 WeakPolarHBondContact O-CG2 3.33Å; D476-V478 PolarHBondContact O-N 3.31Å; D476-V478 VanDerWaalsContact O-N 3.15Å
477	R	84.6	Confident	78	Confident	164 Å²	164	88 Å²	88	62%	0.619	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-57.6	120.6	179.4	-62.7	-174.9	-176.5	-171.2	-0.9	110.5	H446 Y479	H446-R477 HydrophobicContact CB-CB 4.21Å; R477-Y479 HydrophobicContact CB-CE2 4.27Å
478	V	85.8	Confident	80	Confident	20 Å²	20	79.3 Å²	79.3	12%	0.121	43%	0.43	C	S	.	.	B	Isolated β-bridge	trans	-102.2	120.7	-176.6	-170.2	0	0	0	0	109.6	W435 H446 H447 D476 S482 A483	W435-V478 HydrophobicContact CH2-CB 4.11Å; W435-V478 HydrophobicContact CH2-CG1 3.78Å; W435-V478 HydrophobicContact CH2-CG2 4.22Å; W435-V478 HydrophobicContact CZ2-CB 4.19Å; W435-V478 HydrophobicContact CZ2-CG1 3.89Å; H446-V478 CarbonylContact C-O 3.52Å; H446-V478 WeakPolarHBondContact CA-O 3.25Å; H447-V478 HydrophobicContact CB-CB 4.36Å; H447-V478 PolarHBondContact N-O 2.81Å; H447-V478 PolarHBondContact O-N 3.43Å; D476-V478 WeakPolarHBondContact O-CG2 3.33Å; D476-V478 PolarHBondContact O-N 3.31Å; D476-V478 VanDerWaalsContact O-N 3.15Å; V478-S482 VanDerWaalsContact CG1-O 3.24Å; V478-S482 WeakPolarHBondContact CG1-O 3.39Å; V478-A483 HydrophobicContact CG1-CB 4.19Å; V478-A483 HydrophobicContact CG2-CB 3.78Å
479	Y	84.9	Confident	81.8	Confident	177 Å²	177	79.9 Å²	79.9	69%	0.694	43%	0.43	S	S	*	.			trans	-93.4	0.5	-178.1	-61.5	-85.7	0	0	0	113.8	D445 H446 R477	D445-Y479 VanDerWaalsContact O-CD1 3.27Å; D445-Y479 WeakPolarHBondContact O-CD1 3.37Å; H446-Y479 HydrophobicContact CB-CD1 4.2Å; H446-Y479 HydrophobicContact CB-CE1 4.11Å; R477-Y479 HydrophobicContact CB-CE2 4.27Å
480	G	84.9	Confident	83.3	Confident	36 Å²	36	76.4 Å²	76.4	37%	0.371	42%	0.415	S	S	.	.	S	Bend	trans	-123.9	-172.8	178.1	0	0	0	0	0	112.8	W435 H447 S482	W435-G480 WeakPolarHBondContact CZ2-O 3.14Å; H447-G480 PolarHBondContact CD2-O 3.37Å; G480-S482 VanDerWaalsContact C-N 3.3Å; G480-S482 PolarHBondContact O-N 3.49Å
481	S	86.4	Confident	84.6	Confident	69 Å²	69	79 Å²	79	48%	0.483	42%	0.42	S	S	.	.	S	Bend	trans	-90.9	17.8	-178	62.5	0	0	0	0	114.1	C434 W435	C434-S481 WeakPolarHBondContact CA-O 3.47Å; W435-S481 PolarHBondContact N-O 3.34Å; W435-S481 WeakPolarHBondContact O-CB 3.46Å
482	S	89.6	Confident	85	Confident	59 Å²	59	74.8 Å²	74.8	41%	0.413	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	148.6	-179	61.1	0	0	0	0	112	I433 V478 G480	I433-S482 CarbonylContact O-C 3.5Å; I433-S482 WeakPolarHBondContact O-CA 3.2Å; V478-S482 VanDerWaalsContact CG1-O 3.24Å; V478-S482 WeakPolarHBondContact CG1-O 3.39Å; G480-S482 VanDerWaalsContact C-N 3.3Å; G480-S482 PolarHBondContact O-N 3.49Å
483	A	89.5	Confident	85.2	Confident	11 Å²	11	75.7 Å²	75.7	9%	0.091	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	150.2	175	0	0	0	0	0	112.5	I433 W435 L449 V478	I433-A483 PolarHBondContact N-O 3.13Å; I433-A483 PolarHBondContact O-N 2.9Å; W435-A483 HydrophobicContact CH2-CB 3.78Å; W435-A483 HydrophobicContact CZ3-CB 3.91Å; L449-A483 HydrophobicContact CB-CB 4.49Å; L449-A483 HydrophobicContact CD2-CB 3.78Å; V478-A483 HydrophobicContact CG1-CB 4.19Å; V478-A483 HydrophobicContact CG2-CB 3.78Å
484	L	88	Confident	85.4	Confident	100 Å²	100	70.7 Å²	70.7	52%	0.524	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	132.2	173.2	-75.1	164.8	0	0	0	109.9	A431	A431-L484 CarbonylContact O-C 3.46Å; A431-L484 WeakPolarHBondContact O-CA 3.36Å
485	V	87.4	Confident	85.8	Confident	6 Å²	6	67.6 Å²	67.6	4%	0.036	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	122.8	173.6	-178.3	0	0	0	0	108.4	E430 A431 L449 Y451 L488 F496	E430-V485 WeakPolarHBondContact CA-O 3.39Å; A431-V485 HydrophobicContact CB-CB 4.19Å; A431-V485 PolarHBondContact N-O 3.29Å; A431-V485 PolarHBondContact O-N 2.99Å; L449-V485 HydrophobicContact CD2-CG2 3.59Å; Y451-V485 HydrophobicContact CD1-CG1 3.87Å; Y451-V485 HydrophobicContact CD1-CG2 4.12Å; Y451-V485 HydrophobicContact CD2-CG1 4.18Å; Y451-V485 HydrophobicContact CE1-CG1 3.53Å; Y451-V485 HydrophobicContact CE1-CG2 4.28Å; Y451-V485 HydrophobicContact CE2-CG1 3.86Å; Y451-V485 HydrophobicContact CG-CG1 4.2Å; V485-L488 HydrophobicContact CG1-CD2 4.05Å; V485-L488 HydrophobicContact CG1-CG 4.42Å; V485-F496 HydrophobicContact CG2-CE1 4.37Å
486	H	86.2	Confident	86.6	Confident	87 Å²	87	66.4 Å²	66.4	40%	0.403	35%	0.349	S	S	.	.			trans	-96.3	173.8	179.6	-54.8	-78.4	0	0	0	111.2	E430 L488	E430-H486 VanDerWaalsContact CD-CE1 3.44Å; E430-H486 IonicContact OE1-CE1 3.11Å; E430-H486 PolarHBondContact OE1-CE1 3.35Å; E430-H486 VanDerWaalsContact OE1-CE1 3.31Å; E430-H486 IonicContact OE1-ND1 2.55Å; E430-H486 PolarHBondContact OE1-ND1 2.96Å; E430-H486 IonicContact OE2-CE1 2.89Å; E430-H486 IonicContact OE2-ND1 3.91Å; H486-L488 VanDerWaalsContact C-N 3.32Å; H486-L488 PolarHBondContact O-N 3.4Å
487	D	81.3	Confident	87.3	Confident	154 Å²	154	61.5 Å²	61.5	82%	0.824	32%	0.32	S	S	*	.			trans	57.9	35.5	170.5	-54.2	-41	0	0	0	115.3
488	L	84.4	Confident	87.7	Confident	20 Å²	20	53.7 Å²	53.7	11%	0.105	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-75.7	138.2	171.6	-61.7	174.1	0	0	0	110.4	V427 A431 Y451 V485 H486 Y494 F496 T517	V427-L488 HydrophobicContact CG1-CD1 3.84Å; A431-L488 HydrophobicContact CB-CD1 3.45Å; A431-L488 VanDerWaalsContact CB-CD1 3.45Å; Y451-L488 HydrophobicContact CD2-CD2 4.22Å; Y451-L488 HydrophobicContact CE2-CD2 4.21Å; V485-L488 HydrophobicContact CG1-CD2 4.05Å; V485-L488 HydrophobicContact CG1-CG 4.42Å; H486-L488 VanDerWaalsContact C-N 3.32Å; H486-L488 PolarHBondContact O-N 3.4Å; L488-Y494 HydrophobicContact CB-CE2 4.04Å; L488-Y494 HydrophobicContact CD2-CD1 3.77Å; L488-Y494 HydrophobicContact CD2-CD2 4.17Å; L488-Y494 HydrophobicContact CD2-CE1 3.58Å; L488-Y494 HydrophobicContact CD2-CE2 3.99Å; L488-Y494 HydrophobicContact CD2-CG 4.07Å; L488-F496 HydrophobicContact CD1-CZ 4.42Å; L488-T517 HydrophobicContact CB-CG2 3.86Å; L488-T517 HydrophobicContact CD1-CG2 4.15Å
489	E	84.5	Confident	88	Confident	97 Å²	97	55.4 Å²	55.4	45%	0.453	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-70.4	140.5	176.2	-67.4	-179.4	-157.4	0	0	110.1	K453 S492 Y494 T517	K453-E489 IonicContact NZ-OE2 3.37Å; K453-E489 PolarHBondContact NZ-OE2 3.05Å; E489-S492 WeakPolarHBondContact O-CB 3.42Å; E489-Y494 WeakPolarHBondContact CB-OH 3.45Å; E489-Y494 PolarHBondContact N-OH 2.94Å; E489-T517 WeakPolarHBondContact O-CB 3.49Å; E489-T517 WeakPolarHBondContact O-CG2 3.37Å; E489-T517 PolarHBondContact O-OG1 3.49Å
490	P	84.1	Confident	88.2	Confident	78 Å²	78	47 Å²	47	51%	0.506	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	160.3	174.8	29	-34.4	0	0	0	111	S492	P490-S492 PolarHBondContact O-N 3.35Å; P490-S492 VanDerWaalsContact O-N 3.17Å; P490-S492 PolarHBondContact O-OG 3.34Å
491	D	86.2	Confident	88.2	Confident	90 Å²	90	45.3 Å²	45.3	48%	0.481	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	39.3	176.5	-152.9	28.6	0	0	0	114.5	H516 T517 P518	D491-H516 IonicContact OD1-CE1 2.75Å; D491-H516 PolarHBondContact OD1-CE1 3.13Å; D491-T517 PolarHBondContact N-OG1 2.93Å; D491-P518 PolarHBondContact N-O 3.36Å
492	S	88.3	Confident	87.9	Confident	9 Å²	9	43 Å²	43	6%	0.063	23%	0.225	C	C	.	.			trans	-132.3	139	-169.9	-69.2	0	0	0	0	111.3	K453 E489 P490 T517	K453-S492 WeakPolarHBondContact CE-OG 3.46Å; K453-S492 PolarHBondContact NZ-OG 3.48Å; K453-S492 VanDerWaalsContact NZ-OG 3.08Å; E489-S492 WeakPolarHBondContact O-CB 3.42Å; P490-S492 PolarHBondContact O-N 3.35Å; P490-S492 VanDerWaalsContact O-N 3.17Å; P490-S492 PolarHBondContact O-OG 3.34Å; S492-T517 PolarHBondContact N-OG1 3.45Å; S492-T517 PolarHBondContact O-N 3.1Å; S492-T517 PolarHBondContact O-OG1 2.8Å; S492-T517 VanDerWaalsContact O-OG1 3.06Å
493	L	89.5	Confident	87	Confident	65 Å²	65	44.5 Å²	44.5	34%	0.34	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	127.3	175.7	-170.6	70.2	0	0	0	109.9	L454 H516	L454-L493 HydrophobicContact CB-CB 4.27Å; L454-L493 HydrophobicContact CB-CD2 4.13Å; L454-L493 HydrophobicContact CB-CG 4.29Å; L454-L493 HydrophobicContact CD1-CD2 3.68Å; L454-L493 HydrophobicContact CD1-CG 4Å; L454-L493 PolarHBondContact N-O 3.18Å; L493-H516 HydrophobicContact CD1-CB 4.05Å
494	Y	90.2	Very high	86.3	Confident	5 Å²	5	48.9 Å²	48.9	2%	0.02	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.3	177.4	-75.2	-92.4	0	0	0	110.8	Y451 R452 K453 L488 E489 F496 S514 F515 T517	Y451-Y494 HydrophobicContact CD2-CD1 4.21Å; Y451-Y494 HydrophobicContact CD2-CE1 4.44Å; R452-Y494 CarbonylContact O-C 3.18Å; R452-Y494 VanDerWaalsContact O-CA 3.3Å; R452-Y494 WeakPolarHBondContact O-CA 3.3Å; K453-Y494 HydrophobicContact CB-CD1 4.1Å; K453-Y494 HydrophobicContact CB-CE1 3.69Å; K453-Y494 HydrophobicContact CG-CE1 4.19Å; L488-Y494 HydrophobicContact CB-CE2 4.04Å; L488-Y494 HydrophobicContact CD2-CD1 3.77Å; L488-Y494 HydrophobicContact CD2-CD2 4.17Å; L488-Y494 HydrophobicContact CD2-CE1 3.58Å; L488-Y494 HydrophobicContact CD2-CE2 3.99Å; L488-Y494 HydrophobicContact CD2-CG 4.07Å; E489-Y494 WeakPolarHBondContact CB-OH 3.45Å; E489-Y494 PolarHBondContact N-OH 2.94Å; Y494-F496 VanDerWaalsContact CB-CE2 3.5Å; Y494-S514 CarbonylContact O-C 3.55Å; Y494-S514 WeakPolarHBondContact O-CA 3.35Å; Y494-F515 PolarHBondContact N-O 2.76Å; Y494-F515 PolarHBondContact O-N 3.09Å; Y494-T517 HydrophobicContact CD2-CG2 3.87Å; Y494-T517 HydrophobicContact CE2-CG2 3.93Å
495	A	91.8	Very high	85.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	140.1	169.4	0	0	0	0	0	109.9	Y451 R452 L454 W472 V513	Y451-A495 CarbonylContact C-O 3.52Å; Y451-A495 WeakPolarHBondContact CA-O 3.12Å; R452-A495 HydrophobicContact CG-CB 4.06Å; R452-A495 PolarHBondContact N-O 3.37Å; R452-A495 PolarHBondContact O-N 2.7Å; L454-A495 HydrophobicContact CD1-CB 4.04Å; L454-A495 HydrophobicContact CD2-CB 4.12Å; L454-A495 HydrophobicContact CG-CB 4.06Å; W472-A495 HydrophobicContact CH2-CB 3.97Å; W472-A495 HydrophobicContact CZ3-CB 4.39Å; W472-A495 WeakPolarHBondContact CZ3-O 3.38Å; A495-V513 CarbonylContact C-O 3.51Å; A495-V513 WeakPolarHBondContact CA-O 3.44Å
496	F	92.9	Very high	85.4	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	143.2	-179.1	-62.3	-94.3	0	0	0	110.1	I420 V427 A431 I433 L449 E450 Y451 V485 L488 Y494 E512 V513 F515	I420-F496 HydrophobicContact CD1-CB 4.15Å; V427-F496 HydrophobicContact CG2-CE2 4.15Å; V427-F496 HydrophobicContact CG2-CZ 4.28Å; A431-F496 HydrophobicContact CB-CE1 4Å; A431-F496 HydrophobicContact CB-CZ 3.78Å; I433-F496 HydrophobicContact CD1-CD1 3.93Å; I433-F496 HydrophobicContact CD1-CD2 4.15Å; I433-F496 HydrophobicContact CD1-CE1 4.03Å; I433-F496 HydrophobicContact CD1-CE2 4.24Å; I433-F496 HydrophobicContact CD1-CG 3.98Å; I433-F496 HydrophobicContact CD1-CZ 4.19Å; I433-F496 HydrophobicContact CG1-CD1 3.66Å; I433-F496 HydrophobicContact CG1-CE1 3.88Å; I433-F496 HydrophobicContact CG1-CG 4.14Å; L449-F496 HydrophobicContact CD1-CB 4.25Å; L449-F496 HydrophobicContact CD1-CD1 4.2Å; E450-F496 CarbonylContact O-C 3.38Å; E450-F496 WeakPolarHBondContact O-CA 3.3Å; Y451-F496 VanDerWaalsContact CB-CD1 3.47Å; Y451-F496 HydrophobicContact CG-CD1 4.49Å; Y451-F496 HydrophobicContact CG-CE1 4.21Å; V485-F496 HydrophobicContact CG2-CE1 4.37Å; L488-F496 HydrophobicContact CD1-CZ 4.42Å; Y494-F496 VanDerWaalsContact CB-CE2 3.5Å; F496-E512 WeakPolarHBondContact O-CA 3.29Å; F496-V513 PolarHBondContact N-O 3.42Å; F496-V513 PolarHBondContact O-N 3.37Å; F496-F515 AromaticContact CD2-CD2 3.72Å; F496-F515 HydrophobicContact CD2-CD2 3.72Å; F496-F515 HydrophobicContact CD2-CE2 4.47Å; F496-F515 HydrophobicContact CE2-CB 4.23Å; F496-F515 AromaticContact CE2-CD2 3.91Å; F496-F515 HydrophobicContact CE2-CD2 3.91Å
497	R	93.5	Very high	85.4	Confident	45 Å²	45	48.8 Å²	48.8	17%	0.17	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	144.9	172.6	65.9	-176.4	-173.7	-178.8	4.9	110.4	E450 W472 Y509 S510 E512	E450-R497 HydrophobicContact CB-CG 3.93Å; E450-R497 PolarHBondContact N-O 2.98Å; E450-R497 PolarHBondContact O-N 2.98Å; E450-R497 IonicContact OE2-CZ 3.8Å; E450-R497 IonicContact OE2-NE 3.85Å; E450-R497 PolarHBondContact OE2-NE 3.17Å; E450-R497 IonicContact OE2-NH2 3.18Å; E450-R497 PolarHBondContact OE2-NH2 2.99Å; W472-R497 VanDerWaalsContact CD1-NH2 3.26Å; W472-R497 HydrophobicContact CE3-CG 3.97Å; W472-R497 HydrophobicContact CH2-CB 4.34Å; W472-R497 HydrophobicContact CH2-CG 3.88Å; W472-R497 HydrophobicContact CZ2-CG 4.43Å; W472-R497 HydrophobicContact CZ3-CB 4.33Å; W472-R497 HydrophobicContact CZ3-CG 3.63Å; R497-Y509 HydrophobicContact CB-CD1 4.14Å; R497-Y509 HydrophobicContact CG-CD1 3.55Å; R497-Y509 HydrophobicContact CG-CE1 4.04Å; R497-Y509 HydrophobicContact CG-CG 4.18Å; R497-S510 WeakPolarHBondContact CA-OG 3.43Å; R497-E512 HydrophobicContact CB-CG 4.46Å
498	V	93.3	Very high	85.7	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	145	-179.4	-175.2	0	0	0	0	109.4	P418 I420 W435 H447 V448 L449 Y509 S510	P418-V498 HydrophobicContact CB-CG1 4.31Å; P418-V498 HydrophobicContact CG-CB 3.79Å; P418-V498 HydrophobicContact CG-CG1 3.59Å; P418-V498 WeakPolarHBondContact CG-O 3.16Å; I420-V498 HydrophobicContact CD1-CG2 4.06Å; I420-V498 HydrophobicContact CG1-CG2 3.96Å; W435-V498 HydrophobicContact CD2-CB 4.45Å; W435-V498 HydrophobicContact CD2-CG1 3.92Å; W435-V498 HydrophobicContact CD2-CG2 4.07Å; W435-V498 HydrophobicContact CE3-CG1 4.24Å; W435-V498 HydrophobicContact CE3-CG2 3.67Å; W435-V498 HydrophobicContact CG-CG1 4.34Å; W435-V498 HydrophobicContact CH2-CG1 4.34Å; W435-V498 HydrophobicContact CZ2-CG1 4.08Å; W435-V498 HydrophobicContact CZ3-CG1 4.43Å; W435-V498 HydrophobicContact CZ3-CG2 3.93Å; H447-V498 HydrophobicContact CB-CG1 4.06Å; V448-V498 WeakPolarHBondContact O-CA 3.35Å; L449-V498 HydrophobicContact CB-CG2 4.17Å; L449-V498 HydrophobicContact CD1-CG2 3.36Å; L449-V498 HydrophobicContact CG-CG2 4.36Å; V498-Y509 CarbonylContact O-C 3.52Å; V498-S510 PolarHBondContact N-OG 3.16Å; V498-S510 WeakPolarHBondContact O-CB 3.42Å; V498-S510 PolarHBondContact O-N 3.43Å
499	R	91.1	Very high	86	Confident	55 Å²	55	47.7 Å²	47.7	21%	0.208	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	152.4	166.4	59.9	176.4	176	155.6	-1.4	111.1	H447 V448 F506 S507 Y509	H447-R499 CarbonylContact C-O 3.48Å; H447-R499 VanDerWaalsContact CA-O 3.27Å; H447-R499 WeakPolarHBondContact CA-O 3.42Å; V448-R499 HydrophobicContact CB-CG 4.1Å; V448-R499 PolarHBondContact N-O 3.16Å; V448-R499 PolarHBondContact O-N 3.08Å; R499-F506 HydrophobicContact CG-CD1 4.31Å; R499-F506 VanDerWaalsContact CZ-CD1 3.49Å; R499-F506 VanDerWaalsContact NH1-CD1 3.3Å; R499-S507 WeakPolarHBondContact CA-OG 3.45Å; R499-Y509 HydrophobicContact CB-CD1 3.87Å; R499-Y509 HydrophobicContact CB-CE1 4.15Å; R499-Y509 HydrophobicContact CB-CG 4.33Å; R499-Y509 VanDerWaalsContact CD-CE1 3.49Å; R499-Y509 VanDerWaalsContact CD-CZ 3.45Å; R499-Y509 HydrophobicContact CG-CD1 3.91Å; R499-Y509 HydrophobicContact CG-CE1 3.64Å; R499-Y509 PolarHBondContact NE-OH 2.97Å; R499-Y509 VanDerWaalsContact NE-OH 3.12Å
500	S	90.1	Very high	86.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	143.9	178	-68.4	0	0	0	0	110	H447 F506 S507	H447-S500 PolarHBondContact CE1-OG 2.95Å; H447-S500 PolarHBondContact ND1-OG 2.8Å; S500-F506 CarbonylContact O-C 3.56Å; S500-F506 WeakPolarHBondContact O-CA 3.31Å; S500-S507 PolarHBondContact N-OG 3.02Å; S500-S507 PolarHBondContact O-N 2.88Å
501	C	84.1	Confident	86.7	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.014	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	131.8	177.5	-173.7	0	0	0	0	110.4	T444 D445 H446 M505 F506	T444-C501 WeakPolarHBondContact CG2-O 3.19Å; D445-C501 PolarHBondContact N-O 3.37Å; H446-C501 VanDerWaalsContact CE1-CB 3.44Å; H446-C501 WeakPolarHBondContact CE1-CB 3.32Å; H446-C501 PolarHBondContact CE1-SG 3.49Å; H446-C501 PolarHBondContact N-O 3.26Å; H446-C501 WeakPolarHBondContact O-CB 3.48Å; H446-C501 PolarHBondContact O-N 3.44Å; C501-M505 WeakPolarHBondContact CA-O 3.38Å; C501-F506 HydrophobicContact CB-CD1 3.79Å; C501-F506 HydrophobicContact CB-CE1 3.69Å; C501-F506 HydrophobicContact CB-CZ 4.4Å
502	R	80.1	Confident	86.9	Confident	19 Å²	19	43.9 Å²	43.9	7%	0.072	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	125	175.1	-176.3	-173.3	-167.6	-145.7	5.8	109.3	G412 P415 P443 D445 S504 M505	G412-R502 PolarHBondContact O-NH1 2.86Å; P415-R502 HydrophobicContact CG-CB 3.53Å; P443-R502 WeakPolarHBondContact O-CD 3.29Å; P443-R502 VanDerWaalsContact O-CG 3.29Å; P443-R502 WeakPolarHBondContact O-CG 3.49Å; P443-R502 PolarHBondContact O-NE 2.8Å; D445-R502 WeakPolarHBondContact OD2-CA 3.49Å; R502-S504 PolarHBondContact O-N 3.03Å; R502-M505 PolarHBondContact N-O 3.02Å; R502-M505 WeakPolarHBondContact O-CA 3.45Å; R502-M505 VanDerWaalsContact O-CB 3.28Å; R502-M505 WeakPolarHBondContact O-CB 3.35Å; R502-M505 PolarHBondContact O-N 3.39Å
503	N	71.3	Confident	87	Confident	92 Å²	92	43.7 Å²	43.7	49%	0.492	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	41.4	179.9	-64.3	-23	0	0	0	112.7	C410 D445 M505	C410-N503 PolarHBondContact O-ND2 3.49Å; D445-N503 PolarHBondContact OD2-N 3.14Å; N503-M505 PolarHBondContact O-N 3.49Å; N503-M505 VanDerWaalsContact O-N 3.13Å
504	S	73.4	Confident	87.1	Confident	102 Å²	102	42.9 Å²	42.9	71%	0.713	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.3	3	-174.3	-52.5	0	0	0	0	116	R502	R502-S504 PolarHBondContact O-N 3.03Å
505	M	75.1	Confident	87	Confident	105 Å²	105	43.9 Å²	43.9	52%	0.517	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	130.1	170.3	-60.7	-66.2	-70.4	0	0	109.5	V414 C501 R502 N503	V414-M505 HydrophobicContact CG2-CE 4.12Å; C501-M505 WeakPolarHBondContact CA-O 3.38Å; R502-M505 PolarHBondContact N-O 3.02Å; R502-M505 WeakPolarHBondContact O-CA 3.45Å; R502-M505 VanDerWaalsContact O-CB 3.28Å; R502-M505 WeakPolarHBondContact O-CB 3.35Å; R502-M505 PolarHBondContact O-N 3.39Å; N503-M505 PolarHBondContact O-N 3.49Å; N503-M505 VanDerWaalsContact O-N 3.13Å
506	F	82.1	Confident	86.8	Confident	82 Å²	82	46.5 Å²	46.5	36%	0.36	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	137.1	179.6	-68.3	-88.5	0	0	0	111.2	V414 V448 R499 S500 C501	V414-F506 WeakPolarHBondContact CG1-O 3.22Å; V448-F506 HydrophobicContact CG2-CE1 4.21Å; R499-F506 HydrophobicContact CG-CD1 4.31Å; R499-F506 VanDerWaalsContact CZ-CD1 3.49Å; R499-F506 VanDerWaalsContact NH1-CD1 3.3Å; S500-F506 CarbonylContact O-C 3.56Å; S500-F506 WeakPolarHBondContact O-CA 3.31Å; C501-F506 HydrophobicContact CB-CD1 3.79Å; C501-F506 HydrophobicContact CB-CE1 3.69Å; C501-F506 HydrophobicContact CB-CZ 4.4Å
507	S	86.6	Confident	86.6	Confident	5 Å²	5	46.6 Å²	46.6	4%	0.035	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-61.5	158.8	164.6	76.5	0	0	0	0	110.8	P415 R499 S500	P415-S507 WeakPolarHBondContact O-CB 3.43Å; R499-S507 WeakPolarHBondContact CA-OG 3.45Å; S500-S507 PolarHBondContact N-OG 3.02Å; S500-S507 PolarHBondContact O-N 2.88Å
508	P	87.6	Confident	86.4	Confident	80 Å²	80	44.6 Å²	44.6	52%	0.519	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-51.1	154.8	155.2	-21.4	33.5	0	0	0	110.3	P417	P417-P508 HydrophobicContact CB-CB 4.47Å; P417-P508 WeakPolarHBondContact CB-O 3.39Å
509	Y	89.8	Confident	86.1	Confident	70 Å²	70	45 Å²	45	28%	0.275	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-67.6	149.9	171.4	-72	-84.9	0	0	0	110.7	E450 R497 V498 R499	E450-Y509 HydrophobicContact CG-CE1 4.27Å; E450-Y509 PolarHBondContact OE1-OH 3.45Å; E450-Y509 WeakPolarHBondContact OE2-CE1 3.49Å; E450-Y509 PolarHBondContact OE2-OH 3.22Å; R497-Y509 HydrophobicContact CB-CD1 4.14Å; R497-Y509 HydrophobicContact CG-CD1 3.55Å; R497-Y509 HydrophobicContact CG-CE1 4.04Å; R497-Y509 HydrophobicContact CG-CG 4.18Å; V498-Y509 CarbonylContact O-C 3.52Å; R499-Y509 HydrophobicContact CB-CD1 3.87Å; R499-Y509 HydrophobicContact CB-CE1 4.15Å; R499-Y509 HydrophobicContact CB-CG 4.33Å; R499-Y509 VanDerWaalsContact CD-CE1 3.49Å; R499-Y509 VanDerWaalsContact CD-CZ 3.45Å; R499-Y509 HydrophobicContact CG-CD1 3.91Å; R499-Y509 HydrophobicContact CG-CE1 3.64Å; R499-Y509 PolarHBondContact NE-OH 2.97Å; R499-Y509 VanDerWaalsContact NE-OH 3.12Å
510	S	92.2	Very high	86	Confident	5 Å²	5	42.5 Å²	42.5	4%	0.035	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-55.1	157.2	165.2	74.9	0	0	0	0	110.6	P418 R497 V498 E512	P418-S510 WeakPolarHBondContact O-CA 3.34Å; P418-S510 WeakPolarHBondContact O-CB 3.44Å; R497-S510 WeakPolarHBondContact CA-OG 3.43Å; V498-S510 PolarHBondContact N-OG 3.16Å; V498-S510 WeakPolarHBondContact O-CB 3.42Å; V498-S510 PolarHBondContact O-N 3.43Å; S510-E512 PolarHBondContact O-N 3.16Å
511	P	91.3	Very high	85.8	Confident	84 Å²	84	46.1 Å²	46.1	55%	0.545	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-49.5	139.4	162.5	-25.1	34.8	0	0	0	110.7	L419 V513	L419-P511 HydrophobicContact CD2-CG 4.41Å; P511-V513 PolarHBondContact O-N 3.35Å
512	E	91.3	Very high	86	Confident	97 Å²	97	46.6 Å²	46.6	45%	0.453	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-68.5	130.7	177.7	-65.7	-176.7	-158.5	0	0	109.7	R452 W472 F496 R497 S510	R452-E512 IonicContact CZ-OE2 2.7Å; R452-E512 IonicContact NH2-OE1 3.45Å; R452-E512 IonicContact NH2-OE2 2.94Å; R452-E512 PolarHBondContact NH2-OE2 3.4Å; W472-E512 HydrophobicContact CH2-CG 3.98Å; W472-E512 HydrophobicContact CZ2-CG 4.22Å; W472-E512 WeakPolarHBondContact CZ2-OE1 3.39Å; F496-E512 WeakPolarHBondContact O-CA 3.29Å; R497-E512 HydrophobicContact CB-CG 4.46Å; S510-E512 PolarHBondContact O-N 3.16Å
513	V	90.4	Very high	86.5	Confident	5 Å²	5	46.7 Å²	46.7	3%	0.03	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	132.7	178.3	167.6	0	0	0	0	108	I420 W422 A495 F496 P511 F515	I420-V513 HydrophobicContact CB-CB 4.39Å; I420-V513 HydrophobicContact CB-CG2 3.84Å; I420-V513 HydrophobicContact CD1-CB 4.13Å; I420-V513 HydrophobicContact CD1-CG2 4.19Å; I420-V513 HydrophobicContact CG2-CB 4.14Å; I420-V513 HydrophobicContact CG2-CG1 4.09Å; I420-V513 HydrophobicContact CG2-CG2 4.01Å; W422-V513 HydrophobicContact CD2-CG1 3.83Å; W422-V513 HydrophobicContact CD2-CG2 4.48Å; W422-V513 HydrophobicContact CE3-CG1 3.79Å; W422-V513 HydrophobicContact CH2-CB 4.18Å; W422-V513 HydrophobicContact CH2-CG1 3.52Å; W422-V513 HydrophobicContact CH2-CG2 4.36Å; W422-V513 HydrophobicContact CZ2-CB 3.86Å; W422-V513 HydrophobicContact CZ2-CG1 3.52Å; W422-V513 HydrophobicContact CZ2-CG2 3.55Å; W422-V513 HydrophobicContact CZ3-CG1 3.63Å; A495-V513 CarbonylContact C-O 3.51Å; A495-V513 WeakPolarHBondContact CA-O 3.44Å; F496-V513 PolarHBondContact N-O 3.42Å; F496-V513 PolarHBondContact O-N 3.37Å; P511-V513 PolarHBondContact O-N 3.35Å; V513-F515 HydrophobicContact CB-CE2 4.42Å; V513-F515 HydrophobicContact CG1-CD2 3.93Å; V513-F515 HydrophobicContact CG1-CE1 4.35Å; V513-F515 HydrophobicContact CG1-CE2 3.22Å; V513-F515 HydrophobicContact CG1-CZ 3.45Å; V513-F515 VanDerWaalsContact CG1-CZ 3.45Å
514	S	90.6	Very high	87.4	Confident	47 Å²	47	44.1 Å²	44.1	33%	0.329	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.6	-179.3	-59.1	0	0	0	0	111.7	Y494	Y494-S514 CarbonylContact O-C 3.55Å; Y494-S514 WeakPolarHBondContact O-CA 3.35Å
515	F	88.4	Confident	88.2	Confident	27 Å²	27	39.2 Å²	39.2	12%	0.118	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	145.7	174.3	-64.4	-76.6	0	0	0	109.9	W422 S425 V427 I433 Y494 F496 V513	W422-F515 AromaticContact CE3-CE1 3.9Å; W422-F515 HydrophobicContact CE3-CE1 3.9Å; W422-F515 HydrophobicContact CE3-CZ 4.02Å; W422-F515 HydrophobicContact CZ3-CE1 4.26Å; W422-F515 HydrophobicContact CZ3-CZ 4.46Å; S425-F515 VanDerWaalsContact CB-CZ 3.49Å; V427-F515 HydrophobicContact CB-CB 3.71Å; V427-F515 HydrophobicContact CB-CG 4.29Å; V427-F515 HydrophobicContact CG1-CB 4.28Å; V427-F515 HydrophobicContact CG2-CB 3.31Å; V427-F515 HydrophobicContact CG2-CD1 4.24Å; V427-F515 HydrophobicContact CG2-CD2 3.69Å; V427-F515 HydrophobicContact CG2-CG 3.5Å; I433-F515 HydrophobicContact CD1-CD2 3.91Å; I433-F515 HydrophobicContact CD1-CE2 3.76Å; Y494-F515 PolarHBondContact N-O 2.76Å; Y494-F515 PolarHBondContact O-N 3.09Å; F496-F515 AromaticContact CD2-CD2 3.72Å; F496-F515 HydrophobicContact CD2-CD2 3.72Å; F496-F515 HydrophobicContact CD2-CE2 4.47Å; F496-F515 HydrophobicContact CE2-CB 4.23Å; F496-F515 AromaticContact CE2-CD2 3.91Å; F496-F515 HydrophobicContact CE2-CD2 3.91Å; V513-F515 HydrophobicContact CB-CE2 4.42Å; V513-F515 HydrophobicContact CG1-CD2 3.93Å; V513-F515 HydrophobicContact CG1-CE1 4.35Å; V513-F515 HydrophobicContact CG1-CE2 3.22Å; V513-F515 HydrophobicContact CG1-CZ 3.45Å; V513-F515 VanDerWaalsContact CG1-CZ 3.45Å
516	H	88.4	Confident	89	Confident	55 Å²	55	34.8 Å²	34.8	26%	0.255	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	127	178.2	-162.5	-65.7	0	0	0	109.3	D491 L493 M704	D491-H516 IonicContact OD1-CE1 2.75Å; D491-H516 PolarHBondContact OD1-CE1 3.13Å; L493-H516 HydrophobicContact CD1-CB 4.05Å; H516-M704 HydrophobicContact CB-CB 3.84Å; H516-M704 HydrophobicContact CB-CG 3.81Å
517	T	88.8	Confident	89.3	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.012	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-70.4	147.6	173.6	54.5	0	0	0	0	109.9	V427 L488 E489 D491 S492 Y494	V427-T517 HydrophobicContact CG1-CG2 3.59Å; L488-T517 HydrophobicContact CB-CG2 3.86Å; L488-T517 HydrophobicContact CD1-CG2 4.15Å; E489-T517 WeakPolarHBondContact O-CB 3.49Å; E489-T517 WeakPolarHBondContact O-CG2 3.37Å; E489-T517 PolarHBondContact O-OG1 3.49Å; D491-T517 PolarHBondContact N-OG1 2.93Å; S492-T517 PolarHBondContact N-OG1 3.45Å; S492-T517 PolarHBondContact O-N 3.1Å; S492-T517 PolarHBondContact O-OG1 2.8Å; S492-T517 VanDerWaalsContact O-OG1 3.06Å; Y494-T517 HydrophobicContact CD2-CG2 3.87Å; Y494-T517 HydrophobicContact CE2-CG2 3.93Å
518	P	87.8	Confident	89.3	Confident	3 Å²	3	31.2 Å²	31.2	2%	0.019	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-57.9	153.8	177.8	-22.7	31.4	0	0	0	112.4	Y428 D491 A520 Y585 M704	Y428-P518 HydrophobicContact CD1-CG 3.66Å; Y428-P518 HydrophobicContact CE1-CG 4.49Å; Y428-P518 HydrophobicContact CG-CG 4.46Å; D491-P518 PolarHBondContact N-O 3.36Å; P518-A520 PolarHBondContact O-N 2.97Å; P518-A520 VanDerWaalsContact O-N 3.09Å; P518-Y585 HydrophobicContact CB-CD1 3.68Å; P518-Y585 HydrophobicContact CB-CD2 4.24Å; P518-Y585 HydrophobicContact CB-CE1 4.02Å; P518-Y585 HydrophobicContact CB-CG 3.79Å; P518-Y585 HydrophobicContact CG-CD1 4.07Å; P518-Y585 HydrophobicContact CG-CE1 4.13Å; P518-M704 HydrophobicContact CB-CE 4.22Å; P518-M704 HydrophobicContact CG-CE 3.81Å
519	P	87.4	Confident	89	Confident	7 Å²	7	30.8 Å²	30.8	5%	0.045	17%	0.168	C	C	.	.	S	Bend	trans	-68.7	-7.8	-178.5	28.7	-37.3	0	0	0	114.1	R583 Y585 C688 Y699	P519-R583 PolarHBondContact O-NH1 2.97Å; P519-Y585 HydrophobicContact CG-CD2 4.11Å; P519-C688 HydrophobicContact CG-CB 4.12Å; P519-Y699 HydrophobicContact CG-CD2 4.39Å; P519-Y699 HydrophobicContact CG-CE1 4.36Å; P519-Y699 HydrophobicContact CG-CE2 3.75Å
520	A	88.4	Confident	88.1	Confident	4 Å²	4	36.3 Å²	36.3	3%	0.033	19%	0.194	C	C	.	.	S	Bend	trans	-155.2	160	179.2	0	0	0	0	0	110.2	P518 R583 Y585	P518-A520 PolarHBondContact O-N 2.97Å; P518-A520 VanDerWaalsContact O-N 3.09Å; A520-R583 HydrophobicContact CB-CB 3.95Å; A520-R583 HydrophobicContact CB-CG 3.63Å; A520-Y585 WeakPolarHBondContact O-CB 3.37Å
521	P	87.5	Confident	86.7	Confident	76 Å²	76	37.9 Å²	37.9	49%	0.494	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-54.9	142.9	174.3	-25.3	35	0	0	0	112.3	F523 Y585	P521-F523 PolarHBondContact O-N 3.3Å; P521-Y585 PolarHBondContact O-N 3.18Å
522	V	88.2	Confident	85.2	Confident	11 Å²	11	35 Å²	35	7%	0.067	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-65.1	126.1	177	173.3	0	0	0	0	111.1	Y428 N429 Y585 F735 I736	Y428-V522 HydrophobicContact CD1-CG2 4.16Å; Y428-V522 HydrophobicContact CG-CG2 4.29Å; N429-V522 PolarHBondContact OD1-N 3.23Å; V522-Y585 CarbonylContact C-O 3.44Å; V522-Y585 VanDerWaalsContact CA-O 3.25Å; V522-Y585 WeakPolarHBondContact CA-O 3.48Å; V522-Y585 HydrophobicContact CG2-CD1 4.36Å; V522-F735 HydrophobicContact CG1-CD2 3.94Å; V522-F735 HydrophobicContact CG1-CE2 4.1Å; V522-F735 HydrophobicContact CG2-CD2 4.12Å; V522-F735 HydrophobicContact CG2-CE2 4.05Å; V522-I736 HydrophobicContact CG1-CD1 3.32Å
523	F	89.9	Confident	83.9	Confident	22 Å²	22	33 Å²	33	10%	0.096	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-93.8	124	176.2	-178.8	-105.2	0	0	0	111.1	P521 F525 T577 I579 H584 Y585 W586 P720	P521-F523 PolarHBondContact O-N 3.3Å; F523-F525 HydrophobicContact CD1-CB 4.49Å; F523-F525 AromaticContact CD1-CD1 3.75Å; F523-F525 HydrophobicContact CD1-CD1 3.75Å; F523-F525 HydrophobicContact CD1-CG 4.49Å; F523-F525 HydrophobicContact CE1-CB 3.99Å; F523-F525 AromaticContact CE1-CD1 3.94Å; F523-F525 HydrophobicContact CE1-CD1 3.94Å; F523-F525 HydrophobicContact CE1-CG 4.26Å; F523-T577 HydrophobicContact CE2-CG2 4.23Å; F523-T577 HydrophobicContact CZ-CG2 3.78Å; F523-I579 HydrophobicContact CD1-CD1 3.96Å; F523-I579 HydrophobicContact CD1-CG1 4.22Å; F523-I579 HydrophobicContact CD2-CD1 4.28Å; F523-I579 HydrophobicContact CD2-CG1 3.93Å; F523-I579 HydrophobicContact CE1-CD1 3.94Å; F523-I579 HydrophobicContact CE1-CG1 3.84Å; F523-I579 HydrophobicContact CE2-CD1 4.27Å; F523-I579 HydrophobicContact CE2-CG1 3.52Å; F523-I579 HydrophobicContact CG-CD1 4.14Å; F523-I579 HydrophobicContact CG-CG1 4.27Å; F523-I579 HydrophobicContact CZ-CD1 4.1Å; F523-I579 HydrophobicContact CZ-CG1 3.47Å; F523-I579 VanDerWaalsContact CZ-CG1 3.47Å; F523-H584 HydrophobicContact CB-CB 3.87Å; F523-H584 HydrophobicContact CD2-CB 4.41Å; F523-H584 AromaticContact CD2-ND1 3.59Å; F523-H584 HydrophobicContact CG-CB 4.26Å; F523-Y585 PolarHBondContact N-O 3.36Å; F523-W586 HydrophobicContact CB-CE3 4.42Å; F523-W586 HydrophobicContact CD1-CE3 4.37Å; F523-P720 HydrophobicContact CD1-CG 4.45Å; F523-P720 HydrophobicContact CE1-CG 4.17Å
524	N	89.6	Confident	82.8	Confident	37 Å²	37	34 Å²	34	20%	0.198	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-97.8	125.2	-175.1	-58.4	-64	0	0	0	111.1	F735 I736	N524-F735 PolarHBondContact OD1-O 3.31Å; N524-I736 WeakPolarHBondContact CA-O 3.3Å; N524-I736 WeakPolarHBondContact CB-O 3.39Å; N524-I736 VanDerWaalsContact OD1-C 3.32Å; N524-I736 PolarHBondContact OD1-O 3.16Å
525	F	90.9	Very high	81.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.205	C	C	.	.			trans	-151.8	163.9	174.3	71.7	-82.1	0	0	0	110.9	F523 G575 W586 P720 F722 L732 I736	F523-F525 HydrophobicContact CD1-CB 4.49Å; F523-F525 AromaticContact CD1-CD1 3.75Å; F523-F525 HydrophobicContact CD1-CD1 3.75Å; F523-F525 HydrophobicContact CD1-CG 4.49Å; F523-F525 HydrophobicContact CE1-CB 3.99Å; F523-F525 AromaticContact CE1-CD1 3.94Å; F523-F525 HydrophobicContact CE1-CD1 3.94Å; F523-F525 HydrophobicContact CE1-CG 4.26Å; F525-G575 VanDerWaalsContact CD2-CA 3.48Å; F525-W586 HydrophobicContact CE1-CB 3.86Å; F525-W586 AromaticContact CE1-CD1 3.65Å; F525-W586 HydrophobicContact CE1-CD2 4.23Å; F525-W586 AromaticContact CE1-CG 3.64Å; F525-W586 HydrophobicContact CE1-CG 3.64Å; F525-W586 AromaticContact CZ-CD1 3.9Å; F525-W586 HydrophobicContact CZ-CG 4.34Å; F525-P720 HydrophobicContact CD1-CG 3.93Å; F525-P720 HydrophobicContact CD2-CB 4.47Å; F525-P720 HydrophobicContact CD2-CG 4.32Å; F525-P720 HydrophobicContact CE1-CB 4.01Å; F525-P720 HydrophobicContact CE1-CG 3.71Å; F525-P720 HydrophobicContact CE2-CB 3.86Å; F525-P720 HydrophobicContact CE2-CG 4.12Å; F525-P720 HydrophobicContact CG-CG 4.22Å; F525-P720 HydrophobicContact CZ-CB 3.59Å; F525-P720 HydrophobicContact CZ-CG 3.81Å; F525-F722 HydrophobicContact CE2-CE2 4.16Å; F525-F722 HydrophobicContact CZ-CE2 4.12Å; F525-F722 HydrophobicContact CZ-CZ 4.32Å; F525-L732 HydrophobicContact CD2-CD1 4.16Å; F525-L732 HydrophobicContact CE1-CD2 4.39Å; F525-L732 HydrophobicContact CE2-CD1 3.86Å; F525-L732 HydrophobicContact CE2-CD2 3.93Å; F525-L732 HydrophobicContact CZ-CD1 4.19Å; F525-L732 HydrophobicContact CZ-CD2 3.61Å; F525-L732 WeakPolarHBondContact O-CD1 3.21Å; F525-I736 HydrophobicContact CD1-CG2 4.13Å; F525-I736 HydrophobicContact CE1-CG2 4.19Å
526	L	91.1	Very high	80.5	Confident	11 Å²	11	42.8 Å²	42.8	6%	0.058	23%	0.231	C	C	.	.			trans	-120.4	165.7	169.5	-63.5	174.9	0	0	0	109.2	R544 D545 G575 D576 T737 K740	L526-R544 HydrophobicContact CB-CB 4.16Å; L526-D545 HydrophobicContact CD2-CB 4.29Å; L526-G575 CarbonylContact O-C 3.51Å; L526-G575 WeakPolarHBondContact O-CA 2.89Å; L526-D576 PolarHBondContact N-OD1 2.98Å; L526-D576 WeakPolarHBondContact O-CB 3.42Å; L526-D576 PolarHBondContact O-N 3.21Å; L526-T737 HydrophobicContact CD2-CG2 3.64Å; L526-K740 HydrophobicContact CD1-CB 4.37Å; L526-K740 HydrophobicContact CD1-CD 4.18Å; L526-K740 HydrophobicContact CG-CD 4.1Å
527	F	89.9	Confident	79.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-69.2	132.8	173.8	-67.8	-63.5	0	0	0	111.4	L540 R544 V547 I573 F722 V730 L732	F527-L540 HydrophobicContact CB-CD2 3.51Å; F527-L540 HydrophobicContact CD2-CD2 4.24Å; F527-L540 HydrophobicContact CG-CD2 4.12Å; F527-R544 WeakPolarHBondContact CD2-O 3.48Å; F527-R544 PolarHBondContact N-O 2.99Å; F527-V547 HydrophobicContact CD1-CG1 4.24Å; F527-V547 HydrophobicContact CD2-CB 4.11Å; F527-V547 HydrophobicContact CD2-CG1 4.12Å; F527-V547 HydrophobicContact CE1-CG1 3.93Å; F527-V547 HydrophobicContact CE2-CB 4.21Å; F527-V547 HydrophobicContact CE2-CG1 3.8Å; F527-V547 HydrophobicContact CG-CB 4.37Å; F527-V547 HydrophobicContact CG-CG1 4.34Å; F527-V547 HydrophobicContact CZ-CG1 3.7Å; F527-I573 HydrophobicContact CB-CD1 3.78Å; F527-I573 HydrophobicContact CB-CG1 4.36Å; F527-I573 HydrophobicContact CD1-CD1 4.22Å; F527-I573 HydrophobicContact CD1-CG1 4.27Å; F527-I573 HydrophobicContact CD1-CG2 4.2Å; F527-I573 HydrophobicContact CE1-CG2 4.43Å; F527-I573 HydrophobicContact CG-CD1 4.21Å; F527-F722 HydrophobicContact CD1-CD2 4.47Å; F527-F722 AromaticContact CE1-CD2 3.66Å; F527-F722 HydrophobicContact CE1-CD2 3.66Å; F527-F722 AromaticContact CE1-CE2 3.76Å; F527-F722 HydrophobicContact CE1-CE2 3.76Å; F527-F722 HydrophobicContact CE1-CG 4.23Å; F527-F722 HydrophobicContact CE1-CZ 4.4Å; F527-F722 HydrophobicContact CZ-CE2 4.49Å; F527-V730 HydrophobicContact CZ-CB 4.23Å; F527-V730 HydrophobicContact CZ-CG1 3.91Å; F527-L732 HydrophobicContact CD2-CD1 4.36Å; F527-L732 HydrophobicContact CD2-CG 4.46Å; F527-L732 HydrophobicContact CE1-CD2 4.44Å; F527-L732 HydrophobicContact CE2-CD1 4.1Å; F527-L732 HydrophobicContact CE2-CD2 4.27Å; F527-L732 HydrophobicContact CE2-CG 3.74Å; F527-L732 HydrophobicContact CZ-CD1 4.33Å; F527-L732 HydrophobicContact CZ-CD2 3.84Å; F527-L732 HydrophobicContact CZ-CG 3.84Å
528	S	85.6	Confident	79.5	Confident	12 Å²	12	44.7 Å²	44.7	8%	0.084	24%	0.236	C	C	.	.			trans	-77	132.9	-179.9	-175.2	0	0	0	0	111.6	K530 I574	S528-K530 PolarHBondContact OG-N 3.48Å; S528-I574 WeakPolarHBondContact CB-O 3.22Å; S528-I574 PolarHBondContact N-O 3.48Å
529	D	80.6	Confident	79.4	Confident	71 Å²	71	49.2 Å²	49.2	38%	0.38	26%	0.259	S	S	.	.	S	Bend	trans	-90.4	0.9	171.3	51.2	15.6	0	0	0	112.9	L540 R544	D529-L540 HydrophobicContact CB-CD1 4.23Å; D529-R544 IonicContact OD1-NH1 3.03Å; D529-R544 IonicContact OD2-CZ 2.84Å; D529-R544 IonicContact OD2-NH1 3.96Å; D529-R544 PolarHBondContact OD2-NH1 2.75Å
530	K	71.1	Confident	79.3	Confident	187 Å²	187	50.3 Å²	50.3	81%	0.813	26%	0.264	S	S	*	.	S	Bend	trans	-107.2	-24.9	-172.8	-58.3	-175.9	-176.9	174	0	115	S528	S528-K530 PolarHBondContact OG-N 3.48Å
531	C	63.1	Low	79.3	Confident	38 Å²	38	52.8 Å²	52.8	26%	0.257	28%	0.277	S	S	.	.	S	Bend	trans	-137.6	130.3	-168.5	-169.5	0	0	0	0	111.2	F533 I574 F611	C531-F533 PolarHBondContact O-N 3.07Å; C531-I574 HydrophobicContact CB-CD1 3.72Å; C531-I574 HydrophobicContact CB-CG1 4.09Å; C531-F611 WeakPolarHBondContact SG-CE2 3.41Å
532	G	60.3	Low	79.2	Confident	24 Å²	24	57.3 Å²	57.3	25%	0.247	30%	0.297	C	S	.	.	S	Bend	trans	74.4	-24.3	-173.5	0	0	0	0	0	115.1	Y572 F611	G532-Y572 CarbonylContact C-O 3.53Å; G532-Y572 WeakPolarHBondContact CA-O 3.5Å; G532-F611 VanDerWaalsContact CA-CZ 3.48Å
533	F	63.1	Low	79	Confident	53 Å²	53	62.2 Å²	62.2	23%	0.232	31%	0.314	C	S	.	.			trans	-68.3	127.8	-174.1	-178.3	-116.2	0	0	0	114.2	C531 T535 L538 L540 I573	C531-F533 PolarHBondContact O-N 3.07Å; F533-T535 HydrophobicContact CD1-CG2 4.02Å; F533-T535 HydrophobicContact CE1-CG2 3.34Å; F533-T535 HydrophobicContact CZ-CG2 4.08Å; F533-L538 HydrophobicContact CD2-CB 3.83Å; F533-L538 HydrophobicContact CD2-CD1 4.29Å; F533-L538 HydrophobicContact CE2-CB 3.74Å; F533-L538 WeakPolarHBondContact CE2-O 3.36Å; F533-L538 WeakPolarHBondContact CZ-O 3.5Å; F533-L540 HydrophobicContact CD2-CD1 4.1Å; F533-L540 HydrophobicContact CD2-CG 4.31Å; F533-L540 HydrophobicContact CE2-CD1 3.84Å; F533-L540 HydrophobicContact CE2-CG 3.77Å; F533-L540 HydrophobicContact CZ-CD1 4.19Å; F533-L540 HydrophobicContact CZ-CG 4.34Å; F533-I573 HydrophobicContact CD2-CD1 4.2Å
534	S	67.2	Low	78.9	Confident	27 Å²	27	65.5 Å²	65.5	19%	0.189	33%	0.326	C	S	.	.			trans	-108.6	110.7	167.4	177.4	0	0	0	0	109.2	E536 R537 L538	S534-E536 PolarHBondContact O-N 3.34Å; S534-E536 VanDerWaalsContact O-N 3.08Å; S534-R537 PolarHBondContact O-N 3.41Å; S534-R537 VanDerWaalsContact O-N 3.08Å; S534-L538 PolarHBondContact O-N 3.49Å
535	T	64.5	Low	78.9	Confident	116 Å²	116	64.1 Å²	64.1	71%	0.712	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-19.9	178.2	45.1	0	0	0	0	113.8	F533	F533-T535 HydrophobicContact CD1-CG2 4.02Å; F533-T535 HydrophobicContact CE1-CG2 3.34Å; F533-T535 HydrophobicContact CZ-CG2 4.08Å
536	E	66.3	Low	78.8	Confident	143 Å²	143	64.5 Å²	64.5	67%	0.668	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-21.1	179.9	-62.4	-174.4	173.2	0	0	113.4	S534	S534-E536 PolarHBondContact O-N 3.34Å; S534-E536 VanDerWaalsContact O-N 3.08Å
537	R	73.6	Confident	78.8	Confident	94 Å²	94	64 Å²	64	36%	0.355	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	-20.4	-171.3	-65.3	-171.9	-75.6	-177.2	3.9	114.9	S534 S549 V550 D571	S534-R537 PolarHBondContact O-N 3.41Å; S534-R537 VanDerWaalsContact O-N 3.08Å; R537-S549 CarbonylContact O-C 3.53Å; R537-S549 WeakPolarHBondContact O-CA 3.25Å; R537-V550 PolarHBondContact O-N 3.45Å; R537-D571 WeakPolarHBondContact CB-OD2 3.39Å; R537-D571 IonicContact CZ-OD1 3.71Å; R537-D571 IonicContact NE-OD1 3.8Å; R537-D571 PolarHBondContact NE-OD1 3.45Å; R537-D571 IonicContact NE-OD2 2.76Å; R537-D571 IonicContact NH1-OD1 3.41Å; R537-D571 IonicContact NH2-OD1 3.72Å; R537-D571 PolarHBondContact NH2-OD1 2.94Å
538	L	82.8	Confident	78.7	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.01	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	129.7	175.5	-65	-179.3	0	0	0	109.9	F533 S534 V547 E548 D571 I573 L724	F533-L538 HydrophobicContact CD2-CB 3.83Å; F533-L538 HydrophobicContact CD2-CD1 4.29Å; F533-L538 HydrophobicContact CE2-CB 3.74Å; F533-L538 WeakPolarHBondContact CE2-O 3.36Å; F533-L538 WeakPolarHBondContact CZ-O 3.5Å; S534-L538 PolarHBondContact O-N 3.49Å; L538-V547 HydrophobicContact CB-CG2 4.23Å; L538-V547 HydrophobicContact CD2-CG2 4.19Å; L538-E548 WeakPolarHBondContact CA-O 3.46Å; L538-D571 HydrophobicContact CD1-CB 4.02Å; L538-D571 HydrophobicContact CD2-CB 3.7Å; L538-D571 HydrophobicContact CG-CB 3.82Å; L538-I573 HydrophobicContact CD1-CB 4.04Å; L538-I573 HydrophobicContact CD1-CD1 4.5Å; L538-L724 HydrophobicContact CD2-CB 4.28Å; L538-L724 HydrophobicContact CD2-CD1 4.38Å
539	I	85.3	Confident	78.7	Confident	99 Å²	99	66.4 Å²	66.4	51%	0.508	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	118	174.2	-56.7	-174.5	0	0	0	108.2	V547 E548 V550	I539-V547 WeakPolarHBondContact O-CA 3.27Å; I539-E548 PolarHBondContact N-O 3.21Å; I539-E548 PolarHBondContact O-N 3Å; I539-V550 HydrophobicContact CD1-CB 4.25Å; I539-V550 HydrophobicContact CD1-CG2 3.53Å; I539-V550 HydrophobicContact CG1-CG2 3.9Å
540	L	87.3	Confident	78.5	Confident	29 Å²	29	65.6 Å²	65.6	15%	0.152	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	140	168.4	-70.7	174.3	0	0	0	109.6	F527 D529 F533 R544 V547 I573	F527-L540 HydrophobicContact CB-CD2 3.51Å; F527-L540 HydrophobicContact CD2-CD2 4.24Å; F527-L540 HydrophobicContact CG-CD2 4.12Å; D529-L540 HydrophobicContact CB-CD1 4.23Å; F533-L540 HydrophobicContact CD2-CD1 4.1Å; F533-L540 HydrophobicContact CD2-CG 4.31Å; F533-L540 HydrophobicContact CE2-CD1 3.84Å; F533-L540 HydrophobicContact CE2-CG 3.77Å; F533-L540 HydrophobicContact CZ-CD1 4.19Å; F533-L540 HydrophobicContact CZ-CG 4.34Å; L540-R544 HydrophobicContact CD1-CG 4.48Å; L540-V547 HydrophobicContact CD2-CB 3.72Å; L540-V547 HydrophobicContact CD2-CG2 3.9Å; L540-I573 HydrophobicContact CD1-CD1 4.31Å; L540-I573 HydrophobicContact CD2-CD1 3.69Å; L540-I573 HydrophobicContact CG-CD1 4.28Å
541	N	88.1	Confident	78.1	Confident	56 Å²	56	59.3 Å²	59.3	30%	0.299	31%	0.311	S	S	.	.			trans	-75.2	166.7	169.9	77.6	-14.9	0	0	0	111.5	R543 R544 D545 A546	N541-R543 PolarHBondContact O-N 2.74Å; N541-R544 PolarHBondContact O-N 3.12Å; N541-R544 WeakPolarHBondContact OD1-CA 3.48Å; N541-R544 PolarHBondContact OD1-N 3.01Å; N541-D545 PolarHBondContact ND2-OD1 3.48Å; N541-D545 PolarHBondContact OD1-N 3.36Å; N541-D545 PolarHBondContact OD1-OD1 3.1Å; N541-A546 HydrophobicContact CB-CB 4.44Å; N541-A546 PolarHBondContact N-O 2.85Å; N541-A546 VanDerWaalsContact N-O 3.11Å; N541-A546 PolarHBondContact OD1-N 2.9Å; N541-A546 VanDerWaalsContact OD1-N 3.16Å
542	N	83.8	Confident	77.9	Confident	172 Å²	172	58.3 Å²	58.3	92%	0.92	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-27.8	-175.6	-66.3	-9.1	0	0	0	113.8
543	R	84.6	Confident	77.7	Confident	113 Å²	113	64.7 Å²	64.7	43%	0.426	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-9	179.6	-60.6	-179.5	91.4	-152.7	21.6	113.2	N541 D545 L741	N541-R543 PolarHBondContact O-N 2.74Å; R543-D545 HydrophobicContact CB-CB 4.45Å; R543-D545 IonicContact CZ-OD2 3.82Å; R543-D545 IonicContact NE-OD2 3.21Å; R543-D545 IonicContact NH1-OD2 3.65Å; R543-D545 PolarHBondContact NH1-OD2 3.47Å; R543-D545 PolarHBondContact O-N 3.29Å; R543-L741 HydrophobicContact CB-CD2 4.23Å; R543-L741 HydrophobicContact CG-CD2 4.38Å; R543-L741 VanDerWaalsContact CZ-CD1 3.45Å; R543-L741 VanDerWaalsContact NH2-CD1 3.26Å
544	R	88.2	Confident	77.3	Confident	91 Å²	91	65.2 Å²	65.2	34%	0.343	35%	0.346	S	S	.	.	S	Bend	trans	54.4	26.7	-171.8	-59	-177.1	-68.4	-170.9	2.8	113.6	L526 F527 D529 L540 N541	L526-R544 HydrophobicContact CB-CB 4.16Å; F527-R544 WeakPolarHBondContact CD2-O 3.48Å; F527-R544 PolarHBondContact N-O 2.99Å; D529-R544 IonicContact OD1-NH1 3.03Å; D529-R544 IonicContact OD2-CZ 2.84Å; D529-R544 IonicContact OD2-NH1 3.96Å; D529-R544 PolarHBondContact OD2-NH1 2.75Å; L540-R544 HydrophobicContact CD1-CG 4.48Å; N541-R544 PolarHBondContact O-N 3.12Å; N541-R544 WeakPolarHBondContact OD1-CA 3.48Å; N541-R544 PolarHBondContact OD1-N 3.01Å
545	D	88.9	Confident	76.8	Confident	8 Å²	8	67.2 Å²	67.2	4%	0.043	35%	0.351	C	S	.	.	S	Bend	trans	-100.1	-6.2	175.7	65.1	7.9	0	0	0	112.3	L526 N541 R543 L732 T737	L526-D545 HydrophobicContact CD2-CB 4.29Å; N541-D545 PolarHBondContact ND2-OD1 3.48Å; N541-D545 PolarHBondContact OD1-N 3.36Å; N541-D545 PolarHBondContact OD1-OD1 3.1Å; R543-D545 HydrophobicContact CB-CB 4.45Å; R543-D545 IonicContact CZ-OD2 3.82Å; R543-D545 IonicContact NE-OD2 3.21Å; R543-D545 IonicContact NH1-OD2 3.65Å; R543-D545 PolarHBondContact NH1-OD2 3.47Å; R543-D545 PolarHBondContact O-N 3.29Å; D545-L732 PolarHBondContact O-N 3.37Å; D545-T737 HydrophobicContact CB-CG2 3.77Å
546	A	90.2	Very high	76.6	Confident	8 Å²	8	66.6 Å²	66.6	7%	0.066	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	143	171.8	0	0	0	0	0	112	N541 V730 Q731	N541-A546 HydrophobicContact CB-CB 4.44Å; N541-A546 PolarHBondContact N-O 2.85Å; N541-A546 VanDerWaalsContact N-O 3.11Å; N541-A546 PolarHBondContact OD1-N 2.9Å; N541-A546 VanDerWaalsContact OD1-N 3.16Å; A546-V730 VanDerWaalsContact CA-O 3.29Å; A546-V730 WeakPolarHBondContact CA-O 3.26Å; A546-Q731 HydrophobicContact CB-CB 4.33Å; A546-Q731 HydrophobicContact CB-CG 4.29Å
547	V	89.8	Confident	76.1	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	134.9	175.1	62.2	0	0	0	0	110.1	F527 L538 I539 L540 I573 L724 K729 V730	F527-V547 HydrophobicContact CD1-CG1 4.24Å; F527-V547 HydrophobicContact CD2-CB 4.11Å; F527-V547 HydrophobicContact CD2-CG1 4.12Å; F527-V547 HydrophobicContact CE1-CG1 3.93Å; F527-V547 HydrophobicContact CE2-CB 4.21Å; F527-V547 HydrophobicContact CE2-CG1 3.8Å; F527-V547 HydrophobicContact CG-CB 4.37Å; F527-V547 HydrophobicContact CG-CG1 4.34Å; F527-V547 HydrophobicContact CZ-CG1 3.7Å; L538-V547 HydrophobicContact CB-CG2 4.23Å; L538-V547 HydrophobicContact CD2-CG2 4.19Å; I539-V547 WeakPolarHBondContact O-CA 3.27Å; L540-V547 HydrophobicContact CD2-CB 3.72Å; L540-V547 HydrophobicContact CD2-CG2 3.9Å; V547-I573 HydrophobicContact CB-CD1 4.31Å; V547-I573 HydrophobicContact CG1-CG2 4.1Å; V547-I573 HydrophobicContact CG2-CD1 3.85Å; V547-I573 HydrophobicContact CG2-CG2 4.34Å; V547-L724 HydrophobicContact CG1-CD1 4.21Å; V547-L724 HydrophobicContact CG1-CD2 4.16Å; V547-K729 WeakPolarHBondContact O-CA 3.49Å; V547-V730 HydrophobicContact CG1-CB 3.95Å; V547-V730 HydrophobicContact CG1-CG2 4.48Å; V547-V730 PolarHBondContact N-O 3.45Å; V547-V730 PolarHBondContact O-N 2.91Å
548	E	88.2	Confident	75.1	Confident	58 Å²	58	62.8 Å²	62.8	27%	0.271	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.7	179.3	-172.3	167.5	167.9	0	0	109.8	L538 I539 V550 G728 K729	L538-E548 WeakPolarHBondContact CA-O 3.46Å; I539-E548 PolarHBondContact N-O 3.21Å; I539-E548 PolarHBondContact O-N 3Å; E548-V550 HydrophobicContact CG-CG2 4.44Å; E548-G728 CarbonylContact C-O 3.58Å; E548-G728 WeakPolarHBondContact CA-O 3.44Å; E548-K729 HydrophobicContact CB-CB 4.39Å; E548-K729 HydrophobicContact CB-CD 4.37Å; E548-K729 HydrophobicContact CB-CG 4.15Å; E548-K729 HydrophobicContact CG-CB 4.18Å; E548-K729 HydrophobicContact CG-CD 4.32Å; E548-K729 HydrophobicContact CG-CG 4.34Å; E548-K729 WeakPolarHBondContact OE2-CD 3.33Å; E548-K729 WeakPolarHBondContact OE2-CE 3.38Å; E548-K729 IonicContact OE2-NZ 3.86Å; E548-K729 PolarHBondContact OE2-NZ 2.82Å
549	S	85	Confident	73.7	Confident	5 Å²	5	65 Å²	65	4%	0.035	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	131	173.2	175.5	0	0	0	0	109.8	R537 G726 S727 G728	R537-S549 CarbonylContact O-C 3.53Å; R537-S549 WeakPolarHBondContact O-CA 3.25Å; S549-G726 WeakPolarHBondContact CB-O 3.44Å; S549-G726 PolarHBondContact OG-O 3.21Å; S549-G726 VanDerWaalsContact OG-O 3.06Å; S549-S727 WeakPolarHBondContact O-CA 3.21Å; S549-G728 PolarHBondContact N-O 3.4Å
550	V	76.8	Confident	71.9	Confident	54 Å²	54	68 Å²	68	33%	0.327	37%	0.369	S	S	.	.			trans	-125.9	133.1	-178.4	-177.9	0	0	0	0	108.4	R537 I539 E548 G552	R537-V550 PolarHBondContact O-N 3.45Å; I539-V550 HydrophobicContact CD1-CB 4.25Å; I539-V550 HydrophobicContact CD1-CG2 3.53Å; I539-V550 HydrophobicContact CG1-CG2 3.9Å; E548-V550 HydrophobicContact CG-CG2 4.44Å; V550-G552 PolarHBondContact O-N 3Å
551	A	64.1	Low	70.1	Confident	56 Å²	56	77.1 Å²	77.1	46%	0.463	40%	0.401	S	S	.	.			trans	-69.7	99.7	170.4	0	0	0	0	0	108.8	L556	A551-L556 HydrophobicContact CB-CD2 4.3Å; A551-L556 HydrophobicContact CB-CG 4.38Å
552	G	58.8	Low	68.2	Low	16 Å²	16	78.4 Å²	78.4	17%	0.165	41%	0.411	C	S	.	.			trans	-58.2	146.2	177	0	0	0	0	0	112.1	V550 A554 F555 L556	V550-G552 PolarHBondContact O-N 3Å; G552-A554 PolarHBondContact O-N 3.26Å; G552-A554 VanDerWaalsContact O-N 3.11Å; G552-F555 WeakPolarHBondContact O-CB 3.44Å; G552-F555 PolarHBondContact O-N 3.46Å; G552-L556 PolarHBondContact O-N 3.48Å
553	M	55.3	Low	66.4	Low	158 Å²	158	80 Å²	80	78%	0.778	41%	0.413	S	S	*	.	H	α-helix	trans	-54.2	-32.6	179.9	-84.8	-171.7	-87.7	0	0	113.3	F555 L556 L557	M553-F555 VanDerWaalsContact C-N 3.34Å; M553-F555 PolarHBondContact O-N 2.9Å; M553-L556 PolarHBondContact O-N 2.97Å; M553-L557 WeakPolarHBondContact O-CB 3.38Å; M553-L557 WeakPolarHBondContact O-CD1 3.44Å; M553-L557 VanDerWaalsContact O-CG 3.23Å; M553-L557 WeakPolarHBondContact O-CG 3.43Å; M553-L557 PolarHBondContact O-N 3.19Å
554	A	55.6	Low	64.2	Low	65 Å²	65	79 Å²	79	54%	0.537	42%	0.423	S	S	.	.	H	α-helix	trans	-64.7	-35	176.8	0	0	0	0	0	113.1	G552 S558	G552-A554 PolarHBondContact O-N 3.26Å; G552-A554 VanDerWaalsContact O-N 3.11Å; A554-S558 WeakPolarHBondContact O-CB 3.41Å; A554-S558 PolarHBondContact O-N 2.95Å; A554-S558 VanDerWaalsContact O-N 3.1Å; A554-S558 PolarHBondContact O-OG 3.26Å
555	F	56.7	Low	61.8	Low	68 Å²	68	77.7 Å²	77.7	30%	0.298	44%	0.438	S	S	.	.	H	α-helix	trans	-71.4	-42.6	176.2	-176.9	-98.6	0	0	0	111.4	G552 M553 L557 S558 A559	G552-F555 WeakPolarHBondContact O-CB 3.44Å; G552-F555 PolarHBondContact O-N 3.46Å; M553-F555 VanDerWaalsContact C-N 3.34Å; M553-F555 PolarHBondContact O-N 2.9Å; F555-L557 VanDerWaalsContact C-N 3.33Å; F555-L557 PolarHBondContact O-N 3.31Å; F555-S558 WeakPolarHBondContact CA-OG 3.19Å; F555-S558 PolarHBondContact O-N 3.18Å; F555-S558 PolarHBondContact O-OG 2.99Å; F555-A559 WeakPolarHBondContact O-CB 3.5Å; F555-A559 PolarHBondContact O-N 3.07Å
556	L	59.3	Low	59.5	Low	103 Å²	103	79.9 Å²	79.9	54%	0.539	45%	0.454	S	S	.	.	H	α-helix	trans	-62.2	-40	175.8	-65.5	173.4	0	0	0	111.9	A551 G552 M553	A551-L556 HydrophobicContact CB-CD2 4.3Å; A551-L556 HydrophobicContact CB-CG 4.38Å; G552-L556 PolarHBondContact O-N 3.48Å; M553-L556 PolarHBondContact O-N 2.97Å
557	L	55.6	Low	57.3	Low	101 Å²	101	88.4 Å²	88.4	53%	0.529	49%	0.486	S	S	.	.	H	α-helix	trans	-74.3	-25.7	178.1	-70.8	167.5	0	0	0	114.1	M553 F555	M553-L557 WeakPolarHBondContact O-CB 3.38Å; M553-L557 WeakPolarHBondContact O-CD1 3.44Å; M553-L557 VanDerWaalsContact O-CG 3.23Å; M553-L557 WeakPolarHBondContact O-CG 3.43Å; M553-L557 PolarHBondContact O-N 3.19Å; F555-L557 VanDerWaalsContact C-N 3.33Å; F555-L557 PolarHBondContact O-N 3.31Å
558	S	53.8	Low	55.6	Low	57 Å²	57	93.5 Å²	93.5	40%	0.399	51%	0.512	S	S	.	.	H	α-helix	trans	-87	-30.5	178.6	42.5	0	0	0	0	112.7	A554 F555 E560 R561	A554-S558 WeakPolarHBondContact O-CB 3.41Å; A554-S558 PolarHBondContact O-N 2.95Å; A554-S558 VanDerWaalsContact O-N 3.1Å; A554-S558 PolarHBondContact O-OG 3.26Å; F555-S558 WeakPolarHBondContact CA-OG 3.19Å; F555-S558 PolarHBondContact O-N 3.18Å; F555-S558 PolarHBondContact O-OG 2.99Å; S558-E560 PolarHBondContact O-N 3.45Å; S558-R561 PolarHBondContact O-N 3.43Å
559	A	53	Low	54.3	Low	48 Å²	48	92.5 Å²	92.5	40%	0.397	52%	0.517	S	S	.	.	H	α-helix	trans	-62.3	-28.8	169.9	0	0	0	0	0	112.9	F555	F555-A559 WeakPolarHBondContact O-CB 3.5Å; F555-A559 PolarHBondContact O-N 3.07Å
560	E	47.6	Very low	53.6	Low	163 Å²	163	93.8 Å²	93.8	76%	0.762	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-21.6	178.5	-153.1	176.1	-157.6	0	0	113.2	S558	S558-E560 PolarHBondContact O-N 3.45Å
561	R	48.9	Very low	53.7	Low	219 Å²	219	91.9 Å²	91.9	83%	0.826	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-15.4	-175.6	-68.4	-174	-170	-164.3	1.9	114.9	S558	S558-R561 PolarHBondContact O-N 3.43Å
562	V	48.6	Very low	54.5	Low	84 Å²	84	90.6 Å²	90.6	51%	0.509	50%	0.495	S	S	.	.			trans	-120.2	100.9	-175	-168.8	0	0	0	0	108.6	S564	V562-S564 WeakPolarHBondContact CG1-O 3.5Å; V562-S564 PolarHBondContact O-N 3.04Å
563	Q	45.3	Very low	55.8	Low	206 Å²	206	89.9 Å²	89.9	96%	0.963	49%	0.487	S	S	*	.	S	Bend	trans	-72	40.3	167.9	-74.8	-178.3	-17.3	0	0	112
564	S	37.8	Very low	57.4	Low	90 Å²	90	82.7 Å²	82.7	63%	0.629	45%	0.452	S	S	*	.	S	Bend	trans	-145.1	130.1	175.6	-116.5	0	0	0	0	106.7	V562 S566	V562-S564 WeakPolarHBondContact CG1-O 3.5Å; V562-S564 PolarHBondContact O-N 3.04Å; S564-S566 PolarHBondContact O-N 3.24Å
565	G	39.3	Very low	59	Low	65 Å²	65	79.7 Å²	79.7	67%	0.67	43%	0.427	S	S	*	.			trans	-45.5	107.2	-165.4	0	0	0	0	0	114.4	Y567	G565-Y567 WeakPolarHBondContact O-CD2 3.37Å; G565-Y567 PolarHBondContact O-N 3.06Å; G565-Y567 VanDerWaalsContact O-N 3.07Å
566	S	39.8	Very low	60.6	Low	54 Å²	54	79.1 Å²	79.1	38%	0.378	43%	0.427	S	S	.	.			trans	-66.7	103.4	163.4	176.8	0	0	0	0	107.6	S564 I568	S564-S566 PolarHBondContact O-N 3.24Å; S566-I568 PolarHBondContact O-N 2.82Å
567	Y	44	Very low	62	Low	187 Å²	187	76.3 Å²	76.3	73%	0.733	41%	0.414	S	S	*	.			trans	-56.3	118.8	-178.9	-63.8	-86.7	0	0	0	110.2	G565 G569	G565-Y567 WeakPolarHBondContact O-CD2 3.37Å; G565-Y567 PolarHBondContact O-N 3.06Å; G565-Y567 VanDerWaalsContact O-N 3.07Å; Y567-G569 VanDerWaalsContact C-N 3.34Å; Y567-G569 PolarHBondContact O-N 2.87Å
568	I	53.5	Low	63.7	Low	106 Å²	106	72.6 Å²	72.6	54%	0.544	40%	0.401	S	S	.	.			trans	-72.3	89	178.2	-47.5	169.9	0	0	0	107.5	S566 M725	S566-I568 PolarHBondContact O-N 2.82Å; I568-M725 HydrophobicContact CB-SD 4.11Å; I568-M725 HydrophobicContact CG2-CE 4.3Å; I568-M725 HydrophobicContact CG2-CG 3.52Å; I568-M725 HydrophobicContact CG2-SD 3.52Å; I568-M725 VanDerWaalsContact CG2-SD 3.52Å; I568-M725 WeakPolarHBondContact O-CE 3.1Å
569	G	60.7	Low	65.5	Low	37 Å²	37	70 Å²	70	38%	0.381	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-68.4	146.4	179.3	0	0	0	0	0	112.3	Y567	Y567-G569 VanDerWaalsContact C-N 3.34Å; Y567-G569 PolarHBondContact O-N 2.87Å
570	L	71.5	Confident	67.3	Low	33 Å²	33	71.1 Å²	71.1	17%	0.173	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-75.5	130	167.1	-77.4	160.4	0	0	0	109.5	Y572 K598 M725	L570-Y572 HydrophobicContact CB-CD2 4.38Å; L570-Y572 HydrophobicContact CB-CE1 4.38Å; L570-Y572 HydrophobicContact CB-CE2 3.69Å; L570-Y572 WeakPolarHBondContact CD1-OH 3.25Å; L570-Y572 WeakPolarHBondContact O-CD2 3.43Å; L570-Y572 WeakPolarHBondContact O-CE2 3.41Å; L570-K598 HydrophobicContact CD1-CD 3.79Å; L570-K598 HydrophobicContact CD2-CG 4.39Å; L570-M725 HydrophobicContact CD2-CB 3.82Å; L570-M725 HydrophobicContact CD2-CE 3.86Å; L570-M725 HydrophobicContact CG-CE 3.69Å
571	D	77.8	Confident	69.4	Low	13 Å²	13	70 Å²	70	7%	0.07	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	116.6	170.9	-68.5	-51.8	0	0	0	109.3	R537 L538 G723 L724	R537-D571 WeakPolarHBondContact CB-OD2 3.39Å; R537-D571 IonicContact CZ-OD1 3.71Å; R537-D571 IonicContact NE-OD1 3.8Å; R537-D571 PolarHBondContact NE-OD1 3.45Å; R537-D571 IonicContact NE-OD2 2.76Å; R537-D571 IonicContact NH1-OD1 3.41Å; R537-D571 IonicContact NH2-OD1 3.72Å; R537-D571 PolarHBondContact NH2-OD1 2.94Å; L538-D571 HydrophobicContact CD1-CB 4.02Å; L538-D571 HydrophobicContact CD2-CB 3.7Å; L538-D571 HydrophobicContact CG-CB 3.82Å; D571-G723 CarbonylContact O-C 3.58Å; D571-G723 WeakPolarHBondContact O-CA 3.3Å; D571-L724 PolarHBondContact N-O 3.17Å; D571-L724 PolarHBondContact O-N 2.87Å
572	Y	80.9	Confident	71.4	Confident	30 Å²	30	60.5 Å²	60.5	12%	0.118	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	145.7	-174.7	-65.8	-86.3	0	0	0	111.8	G532 L570 F643 L645 F722	G532-Y572 CarbonylContact C-O 3.53Å; G532-Y572 WeakPolarHBondContact CA-O 3.5Å; L570-Y572 HydrophobicContact CB-CD2 4.38Å; L570-Y572 HydrophobicContact CB-CE1 4.38Å; L570-Y572 HydrophobicContact CB-CE2 3.69Å; L570-Y572 WeakPolarHBondContact CD1-OH 3.25Å; L570-Y572 WeakPolarHBondContact O-CD2 3.43Å; L570-Y572 WeakPolarHBondContact O-CE2 3.41Å; Y572-F643 HydrophobicContact CD1-CD2 4.04Å; Y572-F643 AromaticContact CD1-CE2 3.66Å; Y572-F643 HydrophobicContact CD1-CE2 3.66Å; Y572-F643 HydrophobicContact CD1-CZ 4.06Å; Y572-F643 AromaticContact CE1-CD2 3.8Å; Y572-F643 HydrophobicContact CE1-CD2 3.8Å; Y572-F643 AromaticContact CE1-CE2 3.78Å; Y572-F643 HydrophobicContact CE1-CE2 3.78Å; Y572-F643 HydrophobicContact CG-CE2 4.14Å; Y572-F643 HydrophobicContact CG-CZ 4.39Å; Y572-L645 HydrophobicContact CE1-CD1 4.06Å; Y572-F722 CarbonylContact C-O 2.94Å; Y572-F722 VanDerWaalsContact CA-O 3.28Å; Y572-F722 WeakPolarHBondContact CA-O 3.36Å
573	I	86	Confident	73.5	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	144.4	170.8	-169	165.7	0	0	0	109.6	F527 F533 L538 L540 V547 F722 L724	F527-I573 HydrophobicContact CB-CD1 3.78Å; F527-I573 HydrophobicContact CB-CG1 4.36Å; F527-I573 HydrophobicContact CD1-CD1 4.22Å; F527-I573 HydrophobicContact CD1-CG1 4.27Å; F527-I573 HydrophobicContact CD1-CG2 4.2Å; F527-I573 HydrophobicContact CE1-CG2 4.43Å; F527-I573 HydrophobicContact CG-CD1 4.21Å; F533-I573 HydrophobicContact CD2-CD1 4.2Å; L538-I573 HydrophobicContact CD1-CB 4.04Å; L538-I573 HydrophobicContact CD1-CD1 4.5Å; L540-I573 HydrophobicContact CD1-CD1 4.31Å; L540-I573 HydrophobicContact CD2-CD1 3.69Å; L540-I573 HydrophobicContact CG-CD1 4.28Å; V547-I573 HydrophobicContact CB-CD1 4.31Å; V547-I573 HydrophobicContact CG1-CG2 4.1Å; V547-I573 HydrophobicContact CG2-CD1 3.85Å; V547-I573 HydrophobicContact CG2-CG2 4.34Å; I573-F722 HydrophobicContact CG2-CB 3.9Å; I573-F722 PolarHBondContact N-O 3.19Å; I573-F722 PolarHBondContact O-N 3.38Å; I573-L724 HydrophobicContact CG2-CD1 3.86Å
574	I	89.6	Confident	75.8	Confident	8 Å²	8	52.3 Å²	52.3	4%	0.041	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	164.6	-179.3	64.7	170.1	0	0	0	111.5	S528 C531 L607 F643 F719 P720 A721	S528-I574 WeakPolarHBondContact CB-O 3.22Å; S528-I574 PolarHBondContact N-O 3.48Å; C531-I574 HydrophobicContact CB-CD1 3.72Å; C531-I574 HydrophobicContact CB-CG1 4.09Å; I574-L607 HydrophobicContact CD1-CD1 3.85Å; I574-L607 HydrophobicContact CG2-CD1 4.33Å; I574-L607 HydrophobicContact CG2-CD2 4.4Å; I574-F643 HydrophobicContact CG2-CE1 4.44Å; I574-F719 HydrophobicContact CB-CB 4.3Å; I574-F719 HydrophobicContact CD1-CB 4.48Å; I574-F719 HydrophobicContact CD1-CD1 4.44Å; I574-F719 HydrophobicContact CD1-CG 4.33Å; I574-P720 CarbonylContact C-O 3.53Å; I574-P720 VanDerWaalsContact CA-O 3.22Å; I574-P720 WeakPolarHBondContact CA-O 3.49Å; I574-A721 HydrophobicContact CG2-CB 4.1Å
575	G	90	Very high	78.4	Confident	1 Å²	1	48 Å²	48	1%	0.01	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-65.2	151.8	167.2	0	0	0	0	0	112.6	F525 L526 T577 F719 P720	F525-G575 VanDerWaalsContact CD2-CA 3.48Å; L526-G575 CarbonylContact O-C 3.51Å; L526-G575 WeakPolarHBondContact O-CA 2.89Å; G575-T577 PolarHBondContact O-N 3.28Å; G575-F719 WeakPolarHBondContact O-CD1 3.27Å; G575-P720 PolarHBondContact N-O 3.47Å
576	D	89	Confident	80.9	Confident	56 Å²	56	44.9 Å²	44.9	30%	0.299	24%	0.243	S	C	.	.	S	Bend	trans	-76.7	-10.5	176.5	72.9	-16.3	0	0	0	113.7	L526 K740	L526-D576 PolarHBondContact N-OD1 2.98Å; L526-D576 WeakPolarHBondContact O-CB 3.42Å; L526-D576 PolarHBondContact O-N 3.21Å; D576-K740 IonicContact OD1-NZ 2.99Å; D576-K740 PolarHBondContact OD1-NZ 3.15Å; D576-K740 IonicContact OD2-NZ 2.69Å; D576-K740 PolarHBondContact OD2-NZ 3.02Å
577	T	89.7	Confident	83.4	Confident	44 Å²	44	42.3 Å²	42.3	27%	0.27	23%	0.225	S	C	.	.	S	Bend	trans	-128.9	134.8	-174.6	-47.9	0	0	0	0	109.3	F523 G575 F719 K740	F523-T577 HydrophobicContact CE2-CG2 4.23Å; F523-T577 HydrophobicContact CZ-CG2 3.78Å; G575-T577 PolarHBondContact O-N 3.28Å; T577-F719 WeakPolarHBondContact O-CD1 3.49Å; T577-K740 PolarHBondContact OG1-NZ 2.74Å
578	G	90.1	Very high	85.7	Confident	24 Å²	24	33.5 Å²	33.5	25%	0.247	19%	0.19	C	C	.	.			trans	-105.2	161.6	-178.1	0	0	0	0	0	113.6	M718 F719	G578-M718 CarbonylContact C-O 3.56Å; G578-M718 VanDerWaalsContact CA-O 3.28Å; G578-M718 WeakPolarHBondContact CA-O 3.41Å; G578-F719 VanDerWaalsContact N-CE1 3.31Å
579	I	92.1	Very high	87.5	Confident	3 Å²	3	31.7 Å²	31.7	2%	0.015	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-115.6	122.8	-178.7	-61.5	164.8	0	0	0	108	F523 H584 W586 L689 Y691 M718	F523-I579 HydrophobicContact CD1-CD1 3.96Å; F523-I579 HydrophobicContact CD1-CG1 4.22Å; F523-I579 HydrophobicContact CD2-CD1 4.28Å; F523-I579 HydrophobicContact CD2-CG1 3.93Å; F523-I579 HydrophobicContact CE1-CD1 3.94Å; F523-I579 HydrophobicContact CE1-CG1 3.84Å; F523-I579 HydrophobicContact CE2-CD1 4.27Å; F523-I579 HydrophobicContact CE2-CG1 3.52Å; F523-I579 HydrophobicContact CG-CD1 4.14Å; F523-I579 HydrophobicContact CG-CG1 4.27Å; F523-I579 HydrophobicContact CZ-CD1 4.1Å; F523-I579 HydrophobicContact CZ-CG1 3.47Å; F523-I579 VanDerWaalsContact CZ-CG1 3.47Å; I579-H584 HydrophobicContact CD1-CB 3.86Å; I579-H584 HydrophobicContact CG1-CB 4.47Å; I579-H584 WeakPolarHBondContact CG2-CD2 3.38Å; I579-W586 HydrophobicContact CD1-CH2 4.31Å; I579-W586 HydrophobicContact CD1-CZ3 3.74Å; I579-L689 HydrophobicContact CB-CD2 4.2Å; I579-L689 HydrophobicContact CD1-CD2 3.9Å; I579-L689 HydrophobicContact CG2-CD2 4.07Å; I579-Y691 HydrophobicContact CG2-CD2 4.44Å; I579-M718 HydrophobicContact CB-CB 4.43Å; I579-M718 PolarHBondContact N-O 3.4Å; I579-M718 PolarHBondContact O-N 3.48Å
580	S	91.5	Very high	88.9	Confident	70 Å²	70	30.5 Å²	30.5	49%	0.49	16%	0.164	S	C	.	.			trans	-118.9	-7.3	-178.9	58.1	0	0	0	0	114.6	Y691	S580-Y691 WeakPolarHBondContact O-CE1 3.36Å; S580-Y691 VanDerWaalsContact O-CZ 3.24Å
581	Q	91.6	Very high	89.6	Confident	141 Å²	141	30.6 Å²	30.6	66%	0.659	16%	0.163	S	C	*	.	S	Bend	trans	-165.7	158.8	179	60.9	-176.8	6.7	0	0	111.2	H584	Q581-H584 PolarHBondContact O-CD2 3.35Å; Q581-H584 PolarHBondContact O-NE2 3.04Å
582	G	91.5	Very high	89.6	Confident	19 Å²	19	34.3 Å²	34.3	20%	0.196	19%	0.188	C	C	.	.	S	Bend	trans	78.7	-172.7	172.8	0	0	0	0	0	114.6	Y691 D692	G582-Y691 VanDerWaalsContact O-CB 3.25Å; G582-Y691 WeakPolarHBondContact O-CB 3.34Å; G582-Y691 PolarHBondContact O-N 3.33Å; G582-D692 VanDerWaalsContact CA-OD2 3.26Å; G582-D692 WeakPolarHBondContact CA-OD2 3.45Å; G582-D692 PolarHBondContact N-OD1 2.95Å; G582-D692 PolarHBondContact N-OD2 3.32Å
583	R	92.4	Very high	89.6	Confident	71 Å²	71	38.4 Å²	38.4	27%	0.268	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.1	-179.2	-157.3	-176.7	-170	-164.9	8.5	110.7	P519 A520 C688 L689 D690	P519-R583 PolarHBondContact O-NH1 2.97Å; A520-R583 HydrophobicContact CB-CB 3.95Å; A520-R583 HydrophobicContact CB-CG 3.63Å; R583-C688 PolarHBondContact NE-SG 2.8Å; R583-L689 CarbonylContact C-O 3.56Å; R583-L689 WeakPolarHBondContact CA-O 3.13Å; R583-D690 HydrophobicContact CG-CB 3.94Å; R583-D690 IonicContact NE-OD2 3.61Å
584	H	92.3	Very high	89.4	Confident	46 Å²	46	38.6 Å²	38.6	21%	0.213	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	134.9	-169.9	-70.4	-78.4	0	0	0	111.3	F523 I579 Q581 C688 L689	F523-H584 HydrophobicContact CB-CB 3.87Å; F523-H584 HydrophobicContact CD2-CB 4.41Å; F523-H584 AromaticContact CD2-ND1 3.59Å; F523-H584 HydrophobicContact CG-CB 4.26Å; I579-H584 HydrophobicContact CD1-CB 3.86Å; I579-H584 HydrophobicContact CG1-CB 4.47Å; I579-H584 WeakPolarHBondContact CG2-CD2 3.38Å; Q581-H584 PolarHBondContact O-CD2 3.35Å; Q581-H584 PolarHBondContact O-NE2 3.04Å; H584-C688 CarbonylContact O-C 3.51Å; H584-C688 VanDerWaalsContact O-CA 3.27Å; H584-C688 WeakPolarHBondContact O-CA 3.44Å; H584-L689 PolarHBondContact N-O 3.28Å; H584-L689 PolarHBondContact O-N 3.4Å
585	Y	92.8	Very high	89	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	140	179.4	177.1	-88.9	0	0	0	112	Y428 P518 P519 A520 P521 V522 F523 A587 G686 V687 C688 Y699 A701 M704	Y428-Y585 HydrophobicContact CD1-CE1 4.49Å; Y428-Y585 HydrophobicContact CE1-CE1 4.39Å; P518-Y585 HydrophobicContact CB-CD1 3.68Å; P518-Y585 HydrophobicContact CB-CD2 4.24Å; P518-Y585 HydrophobicContact CB-CE1 4.02Å; P518-Y585 HydrophobicContact CB-CG 3.79Å; P518-Y585 HydrophobicContact CG-CD1 4.07Å; P518-Y585 HydrophobicContact CG-CE1 4.13Å; P519-Y585 HydrophobicContact CG-CD2 4.11Å; A520-Y585 WeakPolarHBondContact O-CB 3.37Å; P521-Y585 PolarHBondContact O-N 3.18Å; V522-Y585 CarbonylContact C-O 3.44Å; V522-Y585 VanDerWaalsContact CA-O 3.25Å; V522-Y585 WeakPolarHBondContact CA-O 3.48Å; V522-Y585 HydrophobicContact CG2-CD1 4.36Å; F523-Y585 PolarHBondContact N-O 3.36Å; Y585-A587 HydrophobicContact CE1-CB 4.06Å; Y585-G686 WeakPolarHBondContact OH-CA 3.28Å; Y585-V687 CarbonylContact C-O 3.48Å; Y585-V687 VanDerWaalsContact CA-O 3.3Å; Y585-V687 WeakPolarHBondContact CA-O 3.5Å; Y585-C688 HydrophobicContact CD2-CB 4.13Å; Y585-Y699 HydrophobicContact CE2-CD2 4.3Å; Y585-A701 WeakPolarHBondContact OH-CB 3.31Å; Y585-M704 HydrophobicContact CE1-CE 4.41Å; Y585-M704 HydrophobicContact CE2-SD 4.27Å
586	W	93.2	Very high	88.6	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	157.5	167.7	62.4	95.2	0	0	0	110.8	F523 F525 I579 V601 G686 V687 L689 P720 I736	F523-W586 HydrophobicContact CB-CE3 4.42Å; F523-W586 HydrophobicContact CD1-CE3 4.37Å; F525-W586 HydrophobicContact CE1-CB 3.86Å; F525-W586 AromaticContact CE1-CD1 3.65Å; F525-W586 HydrophobicContact CE1-CD2 4.23Å; F525-W586 AromaticContact CE1-CG 3.64Å; F525-W586 HydrophobicContact CE1-CG 3.64Å; F525-W586 AromaticContact CZ-CD1 3.9Å; F525-W586 HydrophobicContact CZ-CG 4.34Å; I579-W586 HydrophobicContact CD1-CH2 4.31Å; I579-W586 HydrophobicContact CD1-CZ3 3.74Å; W586-V601 HydrophobicContact CH2-CG1 3.6Å; W586-V601 HydrophobicContact CZ2-CG1 3.82Å; W586-G686 CarbonylContact O-C 3.5Å; W586-G686 WeakPolarHBondContact O-CA 3.43Å; W586-V687 HydrophobicContact CD2-CB 4.09Å; W586-V687 HydrophobicContact CH2-CB 4.29Å; W586-V687 HydrophobicContact CH2-CG1 3.77Å; W586-V687 HydrophobicContact CZ2-CB 3.67Å; W586-V687 HydrophobicContact CZ2-CG1 3.4Å; W586-V687 HydrophobicContact CZ2-CG2 4.41Å; W586-V687 PolarHBondContact N-O 3.27Å; W586-V687 PolarHBondContact O-N 2.93Å; W586-L689 HydrophobicContact CH2-CB 3.92Å; W586-L689 HydrophobicContact CZ3-CB 3.89Å; W586-P720 HydrophobicContact CD2-CG 4.29Å; W586-P720 HydrophobicContact CH2-CG 4.21Å; W586-P720 HydrophobicContact CZ2-CB 3.82Å; W586-P720 HydrophobicContact CZ2-CG 3.87Å; W586-I736 HydrophobicContact CB-CD1 3.96Å
587	A	91.8	Very high	88.5	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	152.4	177.9	0	0	0	0	0	111.7	Y585 L685 A701 E733 F735	Y585-A587 HydrophobicContact CE1-CB 4.06Å; A587-L685 VanDerWaalsContact CA-O 3.25Å; A587-L685 WeakPolarHBondContact CA-O 3.27Å; A587-A701 HydrophobicContact CB-CB 4.09Å; A587-E733 HydrophobicContact CB-CG 4.37Å; A587-E733 PolarHBondContact O-N 3.16Å; A587-F735 HydrophobicContact CB-CZ 4.19Å
588	F	92.4	Very high	88.4	Confident	1 Å²	1	42.9 Å²	42.9	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	162.5	-179.4	64.7	-86.3	0	0	0	110.6	V590 V599 L648 L685 V687 F722 V730 Q731 L732	F588-V590 HydrophobicContact CD2-CG2 4.07Å; F588-V590 HydrophobicContact CE2-CG2 3.75Å; F588-V599 HydrophobicContact CE1-CG1 3.52Å; F588-V599 HydrophobicContact CE1-CG2 4.48Å; F588-V599 HydrophobicContact CE2-CG1 4.38Å; F588-V599 HydrophobicContact CE2-CG2 3.83Å; F588-V599 HydrophobicContact CZ-CB 3.96Å; F588-V599 HydrophobicContact CZ-CG1 3.39Å; F588-V599 HydrophobicContact CZ-CG2 3.55Å; F588-L648 HydrophobicContact CE2-CD1 3.91Å; F588-L648 HydrophobicContact CZ-CD1 4.11Å; F588-L685 HydrophobicContact CE1-CB 4.1Å; F588-L685 HydrophobicContact CE1-CD2 4.14Å; F588-L685 HydrophobicContact CE2-CB 4.22Å; F588-L685 HydrophobicContact CZ-CB 3.75Å; F588-L685 HydrophobicContact CZ-CD2 3.64Å; F588-L685 HydrophobicContact CZ-CG 4.27Å; F588-L685 PolarHBondContact N-O 2.79Å; F588-L685 PolarHBondContact O-N 3.37Å; F588-V687 HydrophobicContact CE1-CG2 3.87Å; F588-F722 AromaticContact CD1-CE1 3.89Å; F588-F722 HydrophobicContact CD1-CE1 3.89Å; F588-F722 HydrophobicContact CD1-CZ 4.16Å; F588-F722 HydrophobicContact CD2-CE1 4.11Å; F588-F722 AromaticContact CE1-CE1 3.98Å; F588-F722 HydrophobicContact CE1-CE1 3.98Å; F588-F722 HydrophobicContact CE1-CZ 4.49Å; F588-F722 HydrophobicContact CE2-CE1 4.17Å; F588-F722 AromaticContact CG-CE1 3.98Å; F588-F722 HydrophobicContact CG-CE1 3.98Å; F588-F722 HydrophobicContact CG-CZ 4.43Å; F588-F722 HydrophobicContact CZ-CE1 4.14Å; F588-V730 HydrophobicContact CB-CG1 4.18Å; F588-V730 HydrophobicContact CD2-CG1 3.7Å; F588-V730 HydrophobicContact CE2-CG1 4.5Å; F588-V730 HydrophobicContact CG-CG1 4.15Å; F588-Q731 CarbonylContact C-O 3.5Å; F588-Q731 WeakPolarHBondContact CA-O 3.38Å; F588-Q731 WeakPolarHBondContact CB-O 3.43Å; F588-L732 HydrophobicContact CB-CD2 4.11Å
589	K	91.1	Very high	88.4	Confident	69 Å²	69	41.7 Å²	41.7	30%	0.3	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	144	175.1	-177.4	-178.1	176.3	-137	0	110.1	E591 Q731	K589-E591 IonicContact NZ-OE1 2.84Å; K589-E591 PolarHBondContact NZ-OE1 3.48Å; K589-E591 IonicContact NZ-OE2 2.99Å; K589-Q731 PolarHBondContact N-O 3.44Å; K589-Q731 PolarHBondContact O-N 3.44Å
590	V	88.9	Confident	88.3	Confident	11 Å²	11	41.6 Å²	41.6	7%	0.067	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.3	168.9	172.8	0	0	0	0	108.6	F588 I597 L648 M681	F588-V590 HydrophobicContact CD2-CG2 4.07Å; F588-V590 HydrophobicContact CE2-CG2 3.75Å; V590-I597 HydrophobicContact CB-CD1 4.31Å; V590-I597 HydrophobicContact CG1-CD1 3.48Å; V590-I597 VanDerWaalsContact CG1-CD1 3.48Å; V590-I597 HydrophobicContact CG1-CG1 4.29Å; V590-I597 HydrophobicContact CG2-CD1 4Å; V590-L648 HydrophobicContact CG2-CD1 3.76Å; V590-M681 HydrophobicContact CG1-SD 4.38Å
591	E	86.1	Confident	88.3	Confident	35 Å²	35	38.3 Å²	38.3	16%	0.164	18%	0.18	C	C	.	.			trans	-68.5	140.4	178.2	-75.7	-56.5	139.3	0	0	111.6	K589 Y593 S594 K729	K589-E591 IonicContact NZ-OE1 2.84Å; K589-E591 PolarHBondContact NZ-OE1 3.48Å; K589-E591 IonicContact NZ-OE2 2.99Å; E591-Y593 HydrophobicContact CB-CD1 3.96Å; E591-Y593 HydrophobicContact CB-CE1 3.49Å; E591-Y593 VanDerWaalsContact CB-CE1 3.49Å; E591-Y593 HydrophobicContact CB-CE2 4.12Å; E591-Y593 HydrophobicContact CB-CG 4.46Å; E591-Y593 HydrophobicContact CG-CE1 3.85Å; E591-Y593 PolarHBondContact O-N 2.97Å; E591-Y593 VanDerWaalsContact O-N 3.11Å; E591-S594 WeakPolarHBondContact O-CB 3.45Å; E591-S594 PolarHBondContact O-N 3.48Å; E591-S594 PolarHBondContact O-OG 3.17Å; E591-K729 HydrophobicContact CB-CB 4.14Å; E591-K729 HydrophobicContact CG-CB 4.08Å; E591-K729 HydrophobicContact CG-CD 3.86Å; E591-K729 HydrophobicContact CG-CG 4.14Å; E591-K729 PolarHBondContact N-O 3.32Å; E591-K729 VanDerWaalsContact N-O 3.16Å
592	P	79.2	Confident	88.1	Confident	91 Å²	91	31.6 Å²	31.6	59%	0.591	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-26.6	-173.5	-26	34.8	0	0	0	115.4	S594	P592-S594 PolarHBondContact O-N 3.42Å
593	Y	79.9	Confident	87.9	Confident	116 Å²	116	30.8 Å²	30.8	46%	0.455	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-2.4	177.3	58.7	-100.2	0	0	0	113.5	E591 Y595 K729	E591-Y593 HydrophobicContact CB-CD1 3.96Å; E591-Y593 HydrophobicContact CB-CE1 3.49Å; E591-Y593 VanDerWaalsContact CB-CE1 3.49Å; E591-Y593 HydrophobicContact CB-CE2 4.12Å; E591-Y593 HydrophobicContact CB-CG 4.46Å; E591-Y593 HydrophobicContact CG-CE1 3.85Å; E591-Y593 PolarHBondContact O-N 2.97Å; E591-Y593 VanDerWaalsContact O-N 3.11Å; Y593-Y595 PolarHBondContact O-N 3.33Å; Y593-K729 HydrophobicContact CE2-CB 4.32Å; Y593-K729 WeakPolarHBondContact OH-CD 3.48Å
594	S	82.6	Confident	87.5	Confident	4 Å²	4	30 Å²	30	3%	0.028	14%	0.142	C	C	.	.			trans	-63.9	123.8	-179.8	-60.7	0	0	0	0	110.6	E591 P592 M650 K729	E591-S594 WeakPolarHBondContact O-CB 3.45Å; E591-S594 PolarHBondContact O-N 3.48Å; E591-S594 PolarHBondContact O-OG 3.17Å; P592-S594 PolarHBondContact O-N 3.42Å; S594-M650 PolarHBondContact O-N 3.49Å; S594-K729 PolarHBondContact OG-N 2.82Å; S594-K729 PolarHBondContact OG-O 3Å
595	Y	79.9	Confident	86.8	Confident	122 Å²	122	30.7 Å²	30.7	48%	0.478	15%	0.149	S	C	.	.	S	Bend	trans	-65.9	-61.3	-179.3	179.5	-109.6	0	0	0	111.2	Y593 G649 M650 M725	Y593-Y595 PolarHBondContact O-N 3.33Å; Y595-G649 WeakPolarHBondContact O-CA 3.31Å; Y595-M650 HydrophobicContact CE2-SD 4.48Å; Y595-M650 PolarHBondContact O-N 3.16Å; Y595-M725 HydrophobicContact CE1-SD 4.48Å
596	M	82.8	Confident	86	Confident	46 Å²	46	33.7 Å²	33.7	23%	0.227	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	134	176.1	-177.2	171.7	53	0	0	111.8	T647 L648 M725	M596-T647 HydrophobicContact CG-CG2 3.54Å; M596-T647 HydrophobicContact SD-CG2 3.7Å; M596-L648 CarbonylContact C-O 3.58Å; M596-L648 WeakPolarHBondContact CA-O 3.13Å; M596-M725 HydrophobicContact CB-CB 4.36Å; M596-M725 HydrophobicContact CE-CB 3.9Å; M596-M725 HydrophobicContact CE-CE 3.48Å; M596-M725 VanDerWaalsContact CE-CE 3.48Å; M596-M725 HydrophobicContact CE-CG 4.08Å; M596-M725 HydrophobicContact CE-SD 3.17Å; M596-M725 WeakPolarHBondContact CE-SD 3.46Å; M596-M725 PolarHBondContact N-O 3.15Å; M596-M725 PolarHBondContact O-N 3.41Å
597	I	86.8	Confident	85.2	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	127.6	178.9	-54.6	-169.5	0	0	0	108.6	V590 V599 T647 L648 G723 K729 V730	V590-I597 HydrophobicContact CB-CD1 4.31Å; V590-I597 HydrophobicContact CG1-CD1 3.48Å; V590-I597 VanDerWaalsContact CG1-CD1 3.48Å; V590-I597 HydrophobicContact CG1-CG1 4.29Å; V590-I597 HydrophobicContact CG2-CD1 4Å; I597-V599 HydrophobicContact CG2-CG2 3.99Å; I597-T647 CarbonylContact O-C 3.51Å; I597-L648 HydrophobicContact CB-CB 4.45Å; I597-L648 PolarHBondContact N-O 3.26Å; I597-L648 PolarHBondContact O-N 2.97Å; I597-G723 CarbonylContact C-O 3.49Å; I597-G723 WeakPolarHBondContact CA-O 3.38Å; I597-K729 WeakPolarHBondContact CD1-O 3.43Å; I597-V730 HydrophobicContact CD1-CG2 3.54Å; I597-V730 HydrophobicContact CG2-CG2 3.64Å
598	K	88.1	Confident	84.2	Confident	31 Å²	31	36.2 Å²	36.2	14%	0.135	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	138.6	171.4	-69.1	-160.7	177.3	-174.5	0	110.4	L570 L645 I646 T647 F722 G723	L570-K598 HydrophobicContact CD1-CD 3.79Å; L570-K598 HydrophobicContact CD2-CG 4.39Å; K598-L645 HydrophobicContact CB-CB 4.04Å; K598-L645 HydrophobicContact CB-CD1 3.87Å; K598-L645 HydrophobicContact CB-CD2 4.18Å; K598-L645 HydrophobicContact CB-CG 4.23Å; K598-L645 HydrophobicContact CD-CB 4.29Å; K598-L645 HydrophobicContact CD-CD1 3.9Å; K598-I646 CarbonylContact C-O 3.48Å; K598-I646 WeakPolarHBondContact CA-O 3.18Å; K598-T647 HydrophobicContact CG-CG2 4.33Å; K598-F722 CarbonylContact O-C 3.48Å; K598-F722 VanDerWaalsContact O-CA 3.26Å; K598-F722 WeakPolarHBondContact O-CA 2.99Å; K598-G723 PolarHBondContact N-O 3.07Å; K598-G723 PolarHBondContact O-N 3.16Å
599	V	90.1	Very high	83.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	133.6	-174.5	-178.3	0	0	0	0	110.9	F588 I597 L645 I646 L648 V687 F698 F722	F588-V599 HydrophobicContact CE1-CG1 3.52Å; F588-V599 HydrophobicContact CE1-CG2 4.48Å; F588-V599 HydrophobicContact CE2-CG1 4.38Å; F588-V599 HydrophobicContact CE2-CG2 3.83Å; F588-V599 HydrophobicContact CZ-CB 3.96Å; F588-V599 HydrophobicContact CZ-CG1 3.39Å; F588-V599 HydrophobicContact CZ-CG2 3.55Å; I597-V599 HydrophobicContact CG2-CG2 3.99Å; V599-L645 VanDerWaalsContact C-CD2 3.47Å; V599-L645 CarbonylContact O-C 3.59Å; V599-L645 WeakPolarHBondContact O-CA 3.32Å; V599-I646 HydrophobicContact CB-CG1 4.15Å; V599-I646 PolarHBondContact N-O 2.95Å; V599-I646 WeakPolarHBondContact O-CG1 3.32Å; V599-I646 PolarHBondContact O-N 3.48Å; V599-L648 HydrophobicContact CG2-CD1 3.64Å; V599-V687 HydrophobicContact CG1-CG2 4.21Å; V599-F698 HydrophobicContact CG1-CE1 4.38Å; V599-F722 HydrophobicContact CB-CD1 4.45Å; V599-F722 HydrophobicContact CG1-CD1 4.14Å; V599-F722 HydrophobicContact CG1-CE1 3.82Å; V599-F722 HydrophobicContact CG2-CD1 3.93Å; V599-F722 HydrophobicContact CG2-CE1 4.21Å
600	G	90.1	Very high	81.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.5	-153.9	-178.9	0	0	0	0	0	115.2	T644 A721	G600-T644 WeakPolarHBondContact CA-O 3.43Å; G600-A721 PolarHBondContact N-O 2.78Å; G600-A721 PolarHBondContact O-N 3.34Å
601	V	90.4	Very high	80.8	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	148.4	177.2	-66.4	0	0	0	0	110.5	W586 F643 T644 L689 V696 V712 M718 F719	W586-V601 HydrophobicContact CH2-CG1 3.6Å; W586-V601 HydrophobicContact CZ2-CG1 3.82Å; V601-F643 WeakPolarHBondContact O-CA 3.37Å; V601-T644 PolarHBondContact O-N 2.94Å; V601-L689 HydrophobicContact CG1-CD2 4.4Å; V601-L689 HydrophobicContact CG2-CD1 4.37Å; V601-V696 HydrophobicContact CG1-CG2 4.33Å; V601-V696 HydrophobicContact CG2-CB 4.47Å; V601-V696 HydrophobicContact CG2-CG2 4.39Å; V601-V712 HydrophobicContact CG2-CG1 3.93Å; V601-V712 HydrophobicContact CG2-CG2 4.18Å; V601-M718 HydrophobicContact CB-CE 4.03Å; V601-M718 HydrophobicContact CG2-CE 3.87Å; V601-F719 CarbonylContact C-O 3.52Å; V601-F719 VanDerWaalsContact CA-O 3.28Å; V601-F719 WeakPolarHBondContact CA-O 3.47Å
602	A	87.4	Confident	79.4	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.008	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	145.3	179.2	0	0	0	0	0	111	L607 F643 M718 F719 A721	A602-L607 HydrophobicContact CB-CD1 3.98Å; A602-L607 HydrophobicContact CB-CD2 3.72Å; A602-L607 HydrophobicContact CB-CG 3.73Å; A602-F643 HydrophobicContact CB-CD1 3.19Å; A602-F643 HydrophobicContact CB-CE1 3.26Å; A602-F643 HydrophobicContact CB-CG 4.34Å; A602-F643 HydrophobicContact CB-CZ 4.45Å; A602-M718 CarbonylContact O-C 3.56Å; A602-M718 VanDerWaalsContact O-CA 3.26Å; A602-M718 WeakPolarHBondContact O-CA 3.2Å; A602-F719 PolarHBondContact N-O 3.34Å; A602-F719 PolarHBondContact O-N 3.22Å; A602-A721 HydrophobicContact CB-CB 4.12Å
603	S	87.3	Confident	77.9	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.007	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	145.9	168.1	63.9	0	0	0	0	111.8	T605 K606 L607 S715 T717 M718	S603-T605 WeakPolarHBondContact CB-OG1 3.45Å; S603-T605 PolarHBondContact O-N 2.67Å; S603-T605 PolarHBondContact OG-OG1 3.15Å; S603-K606 PolarHBondContact O-N 3.44Å; S603-K606 VanDerWaalsContact OG-CB 3.28Å; S603-K606 WeakPolarHBondContact OG-CB 3.42Å; S603-K606 WeakPolarHBondContact OG-CD 3.44Å; S603-K606 WeakPolarHBondContact OG-CG 3.48Å; S603-K606 PolarHBondContact OG-N 3.09Å; S603-L607 WeakPolarHBondContact O-CB 3.27Å; S603-L607 WeakPolarHBondContact O-CG 3.44Å; S603-L607 PolarHBondContact O-N 2.96Å; S603-S715 VanDerWaalsContact CB-O 3.28Å; S603-S715 WeakPolarHBondContact CB-O 3.48Å; S603-T717 CarbonylContact C-O 3.55Å; S603-T717 WeakPolarHBondContact CA-O 3.48Å; S603-M718 WeakPolarHBondContact CB-SD 3.47Å
604	D	83.9	Confident	76.3	Confident	55 Å²	55	53.1 Å²	53.1	29%	0.294	27%	0.266	S	S	.	.	H	α-helix	trans	-52.3	-41.3	171.8	52	5.2	0	0	0	113.2	L607 A608 T717 F719	D604-L607 PolarHBondContact O-N 3.21Å; D604-A608 VanDerWaalsContact O-CB 3.32Å; D604-A608 WeakPolarHBondContact O-CB 3.4Å; D604-A608 PolarHBondContact O-N 2.95Å; D604-T717 PolarHBondContact N-O 3.11Å; D604-T717 PolarHBondContact OD1-N 3.18Å; D604-T717 WeakPolarHBondContact OD2-CB 3.38Å; D604-T717 PolarHBondContact OD2-N 2.96Å; D604-T717 PolarHBondContact OD2-OG1 3.15Å; D604-T717 VanDerWaalsContact OD2-OG1 3.05Å; D604-F719 HydrophobicContact CB-CE2 4.1Å
605	T	77.8	Confident	74.5	Confident	60 Å²	60	61.7 Å²	61.7	37%	0.368	30%	0.297	S	S	.	.	H	α-helix	trans	-57.4	-50.5	175.9	44.4	0	0	0	0	111.6	S603 A608 E609 S715	S603-T605 WeakPolarHBondContact CB-OG1 3.45Å; S603-T605 PolarHBondContact O-N 2.67Å; S603-T605 PolarHBondContact OG-OG1 3.15Å; T605-A608 PolarHBondContact O-N 3.19Å; T605-E609 WeakPolarHBondContact O-CG 3.45Å; T605-E609 PolarHBondContact O-N 3.35Å; T605-E609 VanDerWaalsContact O-N 3.12Å; T605-S715 PolarHBondContact OG1-O 3.22Å; T605-S715 PolarHBondContact OG1-OG 2.79Å
606	K	76.3	Confident	72.4	Confident	63 Å²	63	62.5 Å²	62.5	27%	0.274	31%	0.31	S	S	.	.	H	α-helix	trans	-74.9	-30.8	179.7	-66.9	177.5	-178.8	164.8	0	112.6	S603 W610 P642 D713	S603-K606 PolarHBondContact O-N 3.44Å; S603-K606 VanDerWaalsContact OG-CB 3.28Å; S603-K606 WeakPolarHBondContact OG-CB 3.42Å; S603-K606 WeakPolarHBondContact OG-CD 3.44Å; S603-K606 WeakPolarHBondContact OG-CG 3.48Å; S603-K606 PolarHBondContact OG-N 3.09Å; K606-W610 WeakPolarHBondContact O-CB 3.27Å; K606-W610 PolarHBondContact O-N 3Å; K606-P642 HydrophobicContact CB-CB 3.52Å; K606-D713 IonicContact NZ-OD2 3.44Å; K606-D713 PolarHBondContact NZ-OD2 3.39Å
607	L	76.8	Confident	70.4	Confident	7 Å²	7	65.9 Å²	65.9	4%	0.037	33%	0.333	C	S	.	.	H	α-helix	trans	-63.2	-45.5	171.1	-74.9	177.2	0	0	0	111	I574 A602 S603 D604 W610 F611 F643 F719	I574-L607 HydrophobicContact CD1-CD1 3.85Å; I574-L607 HydrophobicContact CG2-CD1 4.33Å; I574-L607 HydrophobicContact CG2-CD2 4.4Å; A602-L607 HydrophobicContact CB-CD1 3.98Å; A602-L607 HydrophobicContact CB-CD2 3.72Å; A602-L607 HydrophobicContact CB-CG 3.73Å; S603-L607 WeakPolarHBondContact O-CB 3.27Å; S603-L607 WeakPolarHBondContact O-CG 3.44Å; S603-L607 PolarHBondContact O-N 2.96Å; D604-L607 PolarHBondContact O-N 3.21Å; L607-W610 PolarHBondContact O-N 2.72Å; L607-F611 HydrophobicContact CB-CD2 4.31Å; L607-F611 HydrophobicContact CB-CE2 4.27Å; L607-F611 HydrophobicContact CD2-CE2 3.8Å; L607-F611 HydrophobicContact CD2-CZ 4.47Å; L607-F611 WeakPolarHBondContact O-CB 3.38Å; L607-F611 WeakPolarHBondContact O-CD2 3.37Å; L607-F611 PolarHBondContact O-N 3.21Å; L607-F643 HydrophobicContact CD2-CD1 4.45Å; L607-F643 HydrophobicContact CD2-CE1 3.33Å; L607-F643 HydrophobicContact CD2-CZ 3.38Å; L607-F719 HydrophobicContact CD1-CD2 4.18Å
608	A	70.6	Confident	67.7	Low	46 Å²	46	70.3 Å²	70.3	38%	0.38	36%	0.364	S	S	.	.	H	α-helix	trans	-62.5	-46.8	178.4	0	0	0	0	0	111.2	D604 T605 W610 F611 H612	D604-A608 VanDerWaalsContact O-CB 3.32Å; D604-A608 WeakPolarHBondContact O-CB 3.4Å; D604-A608 PolarHBondContact O-N 2.95Å; T605-A608 PolarHBondContact O-N 3.19Å; A608-W610 VanDerWaalsContact C-N 3.33Å; A608-W610 PolarHBondContact O-N 3.24Å; A608-F611 PolarHBondContact O-N 2.84Å; A608-H612 VanDerWaalsContact O-CB 3.23Å; A608-H612 WeakPolarHBondContact O-CB 3.42Å; A608-H612 PolarHBondContact O-N 2.94Å; A608-H612 PolarHBondContact O-ND1 3.14Å
609	E	68.3	Low	65.2	Low	136 Å²	136	72.4 Å²	72.4	64%	0.636	38%	0.383	S	S	*	.	H	α-helix	trans	-58.9	-42.7	174.9	-72.8	177.3	176.8	0	0	112.4	T605 N613	T605-E609 WeakPolarHBondContact O-CG 3.45Å; T605-E609 PolarHBondContact O-N 3.35Å; T605-E609 VanDerWaalsContact O-N 3.12Å; E609-N613 WeakPolarHBondContact O-CB 3.35Å; E609-N613 PolarHBondContact O-N 3.15Å
610	W	67	Low	62.6	Low	81 Å²	81	77.9 Å²	77.9	31%	0.307	42%	0.418	S	S	.	.	H	α-helix	trans	-70	-41	-178.9	-174.2	-97.2	0	0	0	113.5	K606 L607 A608 S640 P642	K606-W610 WeakPolarHBondContact O-CB 3.27Å; K606-W610 PolarHBondContact O-N 3Å; L607-W610 PolarHBondContact O-N 2.72Å; A608-W610 VanDerWaalsContact C-N 3.33Å; A608-W610 PolarHBondContact O-N 3.24Å; W610-S640 WeakPolarHBondContact CZ3-O 3.03Å; W610-P642 HydrophobicContact CB-CB 4.42Å; W610-P642 HydrophobicContact CB-CG 3.83Å; W610-P642 HydrophobicContact CD2-CG 3.76Å; W610-P642 HydrophobicContact CE3-CG 3.97Å; W610-P642 HydrophobicContact CG-CG 3.71Å
611	F	66.1	Low	60	Low	84 Å²	84	89 Å²	89	37%	0.368	46%	0.46	S	S	.	.	H	α-helix	trans	-80	-26.7	179.2	-68.8	-58	0	0	0	113.4	C531 G532 L607 A608	C531-F611 WeakPolarHBondContact SG-CE2 3.41Å; G532-F611 VanDerWaalsContact CA-CZ 3.48Å; L607-F611 HydrophobicContact CB-CD2 4.31Å; L607-F611 HydrophobicContact CB-CE2 4.27Å; L607-F611 HydrophobicContact CD2-CE2 3.8Å; L607-F611 HydrophobicContact CD2-CZ 4.47Å; L607-F611 WeakPolarHBondContact O-CB 3.38Å; L607-F611 WeakPolarHBondContact O-CD2 3.37Å; L607-F611 PolarHBondContact O-N 3.21Å; A608-F611 PolarHBondContact O-N 2.84Å
612	H	57.2	Low	57.4	Low	160 Å²	160	98.9 Å²	98.9	74%	0.741	50%	0.499	S	S	*	.	H	α-helix	trans	-89.8	-16.9	178.8	-69.9	66.5	0	0	0	113.6	A608 P614	A608-H612 VanDerWaalsContact O-CB 3.23Å; A608-H612 WeakPolarHBondContact O-CB 3.42Å; A608-H612 PolarHBondContact O-N 2.94Å; A608-H612 PolarHBondContact O-ND1 3.14Å; H612-P614 VanDerWaalsContact C-CD 3.47Å; H612-P614 VanDerWaalsContact O-CD 3.27Å; H612-P614 WeakPolarHBondContact O-CD 3.5Å
613	N	47.4	Very low	54.8	Low	115 Å²	115	106.2 Å²	106.2	62%	0.615	54%	0.538	S	S	*	.	S	Bend	trans	-114	78.2	173.6	-155	1.9	0	0	0	108.9	E609 R615	E609-N613 WeakPolarHBondContact O-CB 3.35Å; E609-N613 PolarHBondContact O-N 3.15Å; N613-R615 VanDerWaalsContact C-N 3.28Å; N613-R615 PolarHBondContact O-N 3.41Å
614	P	46.2	Very low	52.6	Low	103 Å²	103	114.1 Å²	114.1	67%	0.669	58%	0.575	S	S	*	*			trans	-63.5	101.1	169.8	28.5	-30	0	0	0	105.1	H612 D616	H612-P614 VanDerWaalsContact C-CD 3.47Å; H612-P614 VanDerWaalsContact O-CD 3.27Å; H612-P614 WeakPolarHBondContact O-CD 3.5Å; P614-D616 VanDerWaalsContact C-N 3.31Å; P614-D616 PolarHBondContact O-N 2.87Å
615	R	43.8	Very low	50.6	Low	184 Å²	184	118.8 Å²	118.8	69%	0.694	60%	0.599	S	S	*	*			trans	-55.4	110.1	163.4	-84.8	-175.4	167.1	-176.1	-3.5	105.1	N613 T617	N613-R615 VanDerWaalsContact C-N 3.28Å; N613-R615 PolarHBondContact O-N 3.41Å; R615-T617 PolarHBondContact O-N 3.35Å
616	D	35.4	Very low	48.9	Very low	138 Å²	138	121.4 Å²	121.4	74%	0.738	62%	0.62	S	S	*	*			trans	-40.5	117.3	157.6	-92.1	-38.3	0	0	0	105.8	P614 S618	P614-D616 VanDerWaalsContact C-N 3.31Å; P614-D616 PolarHBondContact O-N 2.87Å; D616-S618 PolarHBondContact O-N 2.85Å
617	T	40.8	Very low	47.7	Very low	118 Å²	118	122 Å²	122	72%	0.724	64%	0.644	S	S	*	*			trans	-69.5	42.3	161.6	34.6	0	0	0	0	109.2	R615 S619	R615-T617 PolarHBondContact O-N 3.35Å; T617-S619 VanDerWaalsContact C-N 3.25Å; T617-S619 PolarHBondContact O-N 2.93Å; T617-S619 VanDerWaalsContact O-N 3.08Å
618	S	30.2	Very low	45.9	Very low	93 Å²	93	129.9 Å²	129.9	65%	0.65	68%	0.68	S	S	*	*			trans	-76.8	88.6	159.5	62.2	0	0	0	0	106.5	D616	D616-S618 PolarHBondContact O-N 2.85Å
619	S	36.7	Very low	44.9	Very low	74 Å²	74	134.8 Å²	134.8	52%	0.517	70%	0.7	S	S	.	*			trans	-49	138.4	159.4	-173.4	0	0	0	0	108.5	T617 R621	T617-S619 VanDerWaalsContact C-N 3.25Å; T617-S619 PolarHBondContact O-N 2.93Å; T617-S619 VanDerWaalsContact O-N 3.08Å; S619-R621 PolarHBondContact O-N 3.24Å
620	P	34.9	Very low	43.7	Very low	116 Å²	116	131.9 Å²	131.9	75%	0.753	70%	0.695	S	S	*	*			trans	-55.2	133.4	168	-10.5	23.6	0	0	0	107.4	Y622	P620-Y622 PolarHBondContact O-N 3.43Å
621	R	34.6	Very low	42.6	Very low	233 Å²	233	131.7 Å²	131.7	88%	0.879	72%	0.718	S	S	*	*			trans	-40.4	130	-176.6	-64.8	-178.8	-175.5	176.2	1.3	111.6	S619 D623	S619-R621 PolarHBondContact O-N 3.24Å; R621-D623 VanDerWaalsContact C-N 3.32Å; R621-D623 PolarHBondContact O-N 2.86Å
622	Y	36.9	Very low	41.3	Very low	209 Å²	209	131.5 Å²	131.5	82%	0.82	73%	0.727	S	S	*	*			trans	-65.3	87.9	173.3	-147.4	-93.2	0	0	0	108.6	P620	P620-Y622 PolarHBondContact O-N 3.43Å
623	D	31.9	Very low	40.4	Very low	154 Å²	154	131 Å²	131	82%	0.824	73%	0.725	S	S	*	*			trans	-74.2	129	161.8	-89.3	-32.5	0	0	0	108.1	R621	R621-D623 VanDerWaalsContact C-N 3.32Å; R621-D623 PolarHBondContact O-N 2.86Å
624	H	42	Very low	39.9	Very low	168 Å²	168	132 Å²	132	78%	0.778	73%	0.731	S	S	*	*			trans	-59	142.1	-177.9	-91.4	-1.2	0	0	0	112.5
625	D	41	Very low	39.4	Very low	152 Å²	152	129.9 Å²	129.9	81%	0.813	72%	0.722	S	S	*	*			trans	73.9	97.4	152	-156.2	17.3	0	0	0	116.7
626	S	43.1	Very low	39	Very low	115 Å²	115	125.2 Å²	125.2	80%	0.804	72%	0.716	S	S	*	*			trans	-164.9	101.4	141.9	-78.2	0	0	0	0	108.4	H628	S626-H628 PolarHBondContact O-N 3.45Å
627	G	51.5	Low	39.3	Very low	75 Å²	75	125.8 Å²	125.8	77%	0.773	71%	0.709	S	S	*	*			trans	-58.6	105	166.1	0	0	0	0	0	109.9
628	H	37.8	Very low	39.4	Very low	173 Å²	173	124.4 Å²	124.4	80%	0.801	70%	0.695	S	S	*	*			trans	-152.3	120.2	161.9	-117.7	-82.3	0	0	0	109.8	S626 S630	S626-H628 PolarHBondContact O-N 3.45Å; H628-S630 PolarHBondContact O-N 2.79Å
629	D	49.1	Very low	39.9	Very low	150 Å²	150	126.3 Å²	126.3	80%	0.802	70%	0.697	S	S	*	*			trans	-48.4	118.1	162.2	161.6	11	0	0	0	109.7
630	S	44.4	Very low	40.3	Very low	74 Å²	74	124.5 Å²	124.5	52%	0.517	68%	0.684	S	S	.	*			trans	-150.1	91.5	160.4	-74.2	0	0	0	0	109.4	H628 S632	H628-S630 PolarHBondContact O-N 2.79Å; S630-S632 PolarHBondContact O-N 2.92Å
631	G	43.2	Very low	41.3	Very low	78 Å²	78	121.1 Å²	121.1	80%	0.804	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	56.2	167.4	0	0	0	0	0	113.7
632	S	39.4	Very low	42.5	Very low	80 Å²	80	110.9 Å²	110.9	56%	0.559	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.9	-4.3	177.6	56.4	0	0	0	0	113.9	S630	S630-S632 PolarHBondContact O-N 2.92Å
633	E	37.8	Very low	44.2	Very low	149 Å²	149	101.4 Å²	101.4	70%	0.696	59%	0.585	S	S	*	*	H	α-helix	trans	-80.3	-28.2	-177.8	46.2	-159.7	138.6	0	0	113.9	A635 C636	E633-A635 VanDerWaalsContact C-N 3.34Å; E633-A635 PolarHBondContact O-N 3.25Å; E633-C636 PolarHBondContact O-N 3.16Å
634	D	37.3	Very low	46.1	Very low	136 Å²	136	95 Å²	95	73%	0.727	55%	0.552	S	S	*	*	H	α-helix	trans	-68.9	-30.2	174.1	-77	-28.6	0	0	0	113.2	C636 Y637 E638	D634-C636 VanDerWaalsContact C-N 3.32Å; D634-C636 PolarHBondContact O-N 3.15Å; D634-Y637 PolarHBondContact O-N 3.2Å; D634-E638 PolarHBondContact O-N 3.29Å
635	A	36.5	Very low	47.7	Very low	59 Å²	59	87.7 Å²	87.7	49%	0.488	52%	0.518	S	S	.	.	H	α-helix	trans	-70	-29.3	179.9	0	0	0	0	0	112.6	E633 L639	E633-A635 VanDerWaalsContact C-N 3.34Å; E633-A635 PolarHBondContact O-N 3.25Å; A635-L639 WeakPolarHBondContact O-CD1 3.36Å
636	C	34.8	Very low	49.9	Very low	85 Å²	85	80.5 Å²	80.5	57%	0.574	48%	0.479	S	S	*	.	H	α-helix	trans	-77.2	-31.2	179.6	-168.6	0	0	0	0	112.3	E633 D634	E633-C636 PolarHBondContact O-N 3.16Å; D634-C636 VanDerWaalsContact C-N 3.32Å; D634-C636 PolarHBondContact O-N 3.15Å
637	Y	42.1	Very low	52	Low	150 Å²	150	76.1 Å²	76.1	59%	0.588	45%	0.448	S	S	*	.	H	α-helix	trans	-73.7	-36.7	176.3	-103.8	-87.8	0	0	0	112.9	D634 L639 S640	D634-Y637 PolarHBondContact O-N 3.2Å; Y637-L639 VanDerWaalsContact C-N 3.33Å; Y637-L639 PolarHBondContact O-N 2.94Å; Y637-S640 PolarHBondContact O-N 3.48Å; Y637-S640 PolarHBondContact O-OG 3.03Å; Y637-S640 VanDerWaalsContact O-OG 3.06Å
638	E	42.5	Very low	53.7	Low	89 Å²	89	72.6 Å²	72.6	42%	0.416	41%	0.412	S	S	.	.	H	α-helix	trans	-65.6	-32	174.8	-80.5	-165.7	156.2	0	0	113.2	D634 S640	D634-E638 PolarHBondContact O-N 3.29Å; E638-S640 PolarHBondContact O-N 3.43Å; E638-S640 VanDerWaalsContact O-N 3.12Å
639	L	39.9	Very low	55.6	Low	134 Å²	134	64.6 Å²	64.6	70%	0.702	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-10.1	177.8	-86.4	157.7	0	0	0	114.1	A635 Y637	A635-L639 WeakPolarHBondContact O-CD1 3.36Å; Y637-L639 VanDerWaalsContact C-N 3.33Å; Y637-L639 PolarHBondContact O-N 2.94Å
640	S	45.3	Very low	56.9	Low	35 Å²	35	64.2 Å²	64.2	25%	0.245	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-1.1	-174.4	66.9	0	0	0	0	114.9	W610 Y637 E638	W610-S640 WeakPolarHBondContact CZ3-O 3.03Å; Y637-S640 PolarHBondContact O-N 3.48Å; Y637-S640 PolarHBondContact O-OG 3.03Å; Y637-S640 VanDerWaalsContact O-OG 3.06Å; E638-S640 PolarHBondContact O-N 3.43Å; E638-S640 VanDerWaalsContact O-N 3.12Å
641	Q	56.1	Low	58.5	Low	45 Å²	45	62.6 Å²	62.6	21%	0.21	37%	0.365	C	S	.	.			trans	-79.2	125.7	-178.2	-72.8	176.3	16	0	0	110.8	F643	Q641-F643 PolarHBondContact O-N 3.48Å
642	P	60.1	Low	60.4	Low	18 Å²	18	64 Å²	64	12%	0.117	35%	0.35	C	S	.	.	S	Bend	trans	-73.7	5.6	-178	33.1	-38.2	0	0	0	112.9	K606 W610	K606-P642 HydrophobicContact CB-CB 3.52Å; W610-P642 HydrophobicContact CB-CB 4.42Å; W610-P642 HydrophobicContact CB-CG 3.83Å; W610-P642 HydrophobicContact CD2-CG 3.76Å; W610-P642 HydrophobicContact CE3-CG 3.97Å; W610-P642 HydrophobicContact CG-CG 3.71Å
643	F	72.4	Confident	62.7	Low	11 Å²	11	60.3 Å²	60.3	5%	0.048	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-122.8	132.6	-169.1	-56.2	-77.9	0	0	0	110.7	Y572 I574 V601 A602 L607 Q641 L645 A721	Y572-F643 HydrophobicContact CD1-CD2 4.04Å; Y572-F643 AromaticContact CD1-CE2 3.66Å; Y572-F643 HydrophobicContact CD1-CE2 3.66Å; Y572-F643 HydrophobicContact CD1-CZ 4.06Å; Y572-F643 AromaticContact CE1-CD2 3.8Å; Y572-F643 HydrophobicContact CE1-CD2 3.8Å; Y572-F643 AromaticContact CE1-CE2 3.78Å; Y572-F643 HydrophobicContact CE1-CE2 3.78Å; Y572-F643 HydrophobicContact CG-CE2 4.14Å; Y572-F643 HydrophobicContact CG-CZ 4.39Å; I574-F643 HydrophobicContact CG2-CE1 4.44Å; V601-F643 WeakPolarHBondContact O-CA 3.37Å; A602-F643 HydrophobicContact CB-CD1 3.19Å; A602-F643 HydrophobicContact CB-CE1 3.26Å; A602-F643 HydrophobicContact CB-CG 4.34Å; A602-F643 HydrophobicContact CB-CZ 4.45Å; L607-F643 HydrophobicContact CD2-CD1 4.45Å; L607-F643 HydrophobicContact CD2-CE1 3.33Å; L607-F643 HydrophobicContact CD2-CZ 3.38Å; Q641-F643 PolarHBondContact O-N 3.48Å; F643-L645 HydrophobicContact CB-CD1 3.63Å; F643-L645 HydrophobicContact CB-CD2 3.78Å; F643-L645 HydrophobicContact CB-CG 3.46Å; F643-L645 VanDerWaalsContact CB-CG 3.46Å; F643-L645 HydrophobicContact CD2-CD1 4.4Å; F643-L645 HydrophobicContact CG-CD1 4.28Å; F643-L645 HydrophobicContact CG-CG 4.46Å; F643-L645 PolarHBondContact O-N 3.23Å; F643-L645 VanDerWaalsContact O-N 3.15Å; F643-A721 HydrophobicContact CD1-CB 3.46Å; F643-A721 VanDerWaalsContact CD1-CB 3.46Å; F643-A721 HydrophobicContact CE1-CB 3.69Å
644	T	72.3	Confident	64.9	Low	20 Å²	20	57 Å²	57	12%	0.123	31%	0.307	C	S	.	.			trans	-84.3	86.7	171	-58	0	0	0	0	109.9	G600 V601 V696 R710 V712	G600-T644 WeakPolarHBondContact CA-O 3.43Å; V601-T644 PolarHBondContact O-N 2.94Å; T644-V696 HydrophobicContact CG2-CG1 3.9Å; T644-R710 HydrophobicContact CG2-CB 4.33Å; T644-R710 HydrophobicContact CG2-CG 4.13Å; T644-V712 HydrophobicContact CG2-CG2 3.9Å; T644-V712 WeakPolarHBondContact OG1-CG2 3.29Å
645	L	76	Confident	67	Low	13 Å²	13	51.4 Å²	51.4	7%	0.068	28%	0.277	C	S	.	.			trans	-102.7	139.2	-170.7	-59.3	167.9	0	0	0	113.6	Y572 K598 V599 F643 P656	Y572-L645 HydrophobicContact CE1-CD1 4.06Å; K598-L645 HydrophobicContact CB-CB 4.04Å; K598-L645 HydrophobicContact CB-CD1 3.87Å; K598-L645 HydrophobicContact CB-CD2 4.18Å; K598-L645 HydrophobicContact CB-CG 4.23Å; K598-L645 HydrophobicContact CD-CB 4.29Å; K598-L645 HydrophobicContact CD-CD1 3.9Å; V599-L645 VanDerWaalsContact C-CD2 3.47Å; V599-L645 CarbonylContact O-C 3.59Å; V599-L645 WeakPolarHBondContact O-CA 3.32Å; F643-L645 HydrophobicContact CB-CD1 3.63Å; F643-L645 HydrophobicContact CB-CD2 3.78Å; F643-L645 HydrophobicContact CB-CG 3.46Å; F643-L645 VanDerWaalsContact CB-CG 3.46Å; F643-L645 HydrophobicContact CD2-CD1 4.4Å; F643-L645 HydrophobicContact CG-CD1 4.28Å; F643-L645 HydrophobicContact CG-CG 4.46Å; F643-L645 PolarHBondContact O-N 3.23Å; F643-L645 VanDerWaalsContact O-N 3.15Å; L645-P656 WeakPolarHBondContact O-CG 3.36Å
646	I	86.8	Confident	68.6	Low	1 Å²	1	49.5 Å²	49.5	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	162	156.8	55.1	165.5	0	0	0	109.6	K598 V599 L653 L685 F698 F708	K598-I646 CarbonylContact C-O 3.48Å; K598-I646 WeakPolarHBondContact CA-O 3.18Å; V599-I646 HydrophobicContact CB-CG1 4.15Å; V599-I646 PolarHBondContact N-O 2.95Å; V599-I646 WeakPolarHBondContact O-CG1 3.32Å; V599-I646 PolarHBondContact O-N 3.48Å; I646-L653 HydrophobicContact CB-CD1 4.31Å; I646-L653 HydrophobicContact CD1-CD1 3.72Å; I646-L653 HydrophobicContact CG1-CD1 4.42Å; I646-L685 HydrophobicContact CD1-CD2 3.4Å; I646-F698 HydrophobicContact CD1-CB 4.35Å; I646-F698 HydrophobicContact CD1-CD1 3.27Å; I646-F698 HydrophobicContact CD1-CD2 4.49Å; I646-F698 HydrophobicContact CD1-CE1 3.52Å; I646-F698 HydrophobicContact CD1-CG 3.8Å; I646-F698 HydrophobicContact CD1-CZ 4.23Å; I646-F698 HydrophobicContact CG1-CD1 3.9Å; I646-F698 HydrophobicContact CG1-CE1 3.6Å; I646-F698 HydrophobicContact CG1-CG 4.48Å; I646-F698 HydrophobicContact CG1-CZ 3.95Å; I646-F698 HydrophobicContact CG2-CD2 4.07Å; I646-F698 HydrophobicContact CG2-CE1 4.4Å; I646-F698 HydrophobicContact CG2-CE2 3.85Å; I646-F698 HydrophobicContact CG2-CG 4.42Å; I646-F698 HydrophobicContact CG2-CZ 4.01Å; I646-F708 HydrophobicContact CG2-CD1 3.58Å; I646-F708 HydrophobicContact CG2-CE1 3.93Å
647	T	86.4	Confident	70.1	Confident	23 Å²	23	51.5 Å²	51.5	14%	0.141	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	129.6	-177.6	-53.9	0	0	0	0	111.7	M596 I597 K598 F654	M596-T647 HydrophobicContact CG-CG2 3.54Å; M596-T647 HydrophobicContact SD-CG2 3.7Å; I597-T647 CarbonylContact O-C 3.51Å; K598-T647 HydrophobicContact CG-CG2 4.33Å; T647-F654 PolarHBondContact N-O 3.14Å; T647-F654 VanDerWaalsContact N-O 3.13Å; T647-F654 PolarHBondContact O-N 3.39Å
648	L	86.4	Confident	70.7	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	137	177.1	-63.4	161.2	0	0	0	108.3	F588 V590 M596 I597 V599 K652 L653 M681 L685	F588-L648 HydrophobicContact CE2-CD1 3.91Å; F588-L648 HydrophobicContact CZ-CD1 4.11Å; V590-L648 HydrophobicContact CG2-CD1 3.76Å; M596-L648 CarbonylContact C-O 3.58Å; M596-L648 WeakPolarHBondContact CA-O 3.13Å; I597-L648 HydrophobicContact CB-CB 4.45Å; I597-L648 PolarHBondContact N-O 3.26Å; I597-L648 PolarHBondContact O-N 2.97Å; V599-L648 HydrophobicContact CG2-CD1 3.64Å; L648-K652 WeakPolarHBondContact CA-O 3.35Å; L648-L653 HydrophobicContact CD2-CB 4.02Å; L648-L653 HydrophobicContact CD2-CD1 3.55Å; L648-L653 HydrophobicContact CD2-CG 4.3Å; L648-L653 HydrophobicContact CG-CD1 4.22Å; L648-M681 HydrophobicContact CD2-CG 4.21Å; L648-L685 HydrophobicContact CD1-CD2 4.29Å
649	G	79.1	Confident	70.8	Confident	4 Å²	4	47.1 Å²	47.1	4%	0.041	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.2	152.5	177.4	0	0	0	0	0	112.6	Y595 G651 K652	Y595-G649 WeakPolarHBondContact O-CA 3.31Å; G649-G651 PolarHBondContact O-N 3.32Å; G649-G651 VanDerWaalsContact O-N 3.12Å; G649-K652 PolarHBondContact N-O 3.35Å; G649-K652 PolarHBondContact O-N 3.39Å
650	M	76.1	Confident	70.7	Confident	142 Å²	142	46.7 Å²	46.7	70%	0.7	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	36.1	178.5	-52.5	174.8	68	0	0	113.1	S594 Y595 K652	S594-M650 PolarHBondContact O-N 3.49Å; Y595-M650 HydrophobicContact CE2-SD 4.48Å; Y595-M650 PolarHBondContact O-N 3.16Å; M650-K652 VanDerWaalsContact C-N 3.29Å; M650-K652 PolarHBondContact O-N 2.94Å
651	G	77.7	Confident	70.3	Confident	40 Å²	40	49.7 Å²	49.7	41%	0.412	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	13.5	-178.3	0	0	0	0	0	115.5	G649 M681	G649-G651 PolarHBondContact O-N 3.32Å; G649-G651 VanDerWaalsContact O-N 3.12Å; G651-M681 VanDerWaalsContact C-CB 3.43Å; G651-M681 WeakPolarHBondContact O-CB 3.48Å; G651-M681 PolarHBondContact O-N 3.47Å; G651-M681 VanDerWaalsContact O-N 3.12Å
652	K	84.1	Confident	69.2	Low	108 Å²	108	52 Å²	52	47%	0.47	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	148.7	-178.2	-67	174.3	178.2	-179.5	0	112	L648 G649 M650 F654 V678	L648-K652 WeakPolarHBondContact CA-O 3.35Å; G649-K652 PolarHBondContact N-O 3.35Å; G649-K652 PolarHBondContact O-N 3.39Å; M650-K652 VanDerWaalsContact C-N 3.29Å; M650-K652 PolarHBondContact O-N 2.94Å; K652-F654 HydrophobicContact CB-CD2 4.3Å; K652-F654 HydrophobicContact CB-CE2 3.62Å; K652-F654 HydrophobicContact CB-CZ 3.88Å; K652-F654 HydrophobicContact CD-CZ 3.98Å; K652-V678 HydrophobicContact CB-CG1 3.98Å; K652-V678 HydrophobicContact CD-CG1 3.9Å; K652-V678 HydrophobicContact CG-CG1 4.12Å
653	L	86.1	Confident	68.1	Low	2 Å²	2	57.2 Å²	57.2	1%	0.01	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	122.9	168.6	167.7	63.5	0	0	0	108.8	I646 L648 V678 L679 L685 L707	I646-L653 HydrophobicContact CB-CD1 4.31Å; I646-L653 HydrophobicContact CD1-CD1 3.72Å; I646-L653 HydrophobicContact CG1-CD1 4.42Å; L648-L653 HydrophobicContact CD2-CB 4.02Å; L648-L653 HydrophobicContact CD2-CD1 3.55Å; L648-L653 HydrophobicContact CD2-CG 4.3Å; L648-L653 HydrophobicContact CG-CD1 4.22Å; L653-V678 CarbonylContact O-C 3.58Å; L653-V678 WeakPolarHBondContact O-CA 3.25Å; L653-L679 HydrophobicContact CB-CB 4.27Å; L653-L679 HydrophobicContact CD2-CB 4.36Å; L653-L679 HydrophobicContact CD2-CD1 4.26Å; L653-L679 PolarHBondContact N-O 3.4Å; L653-L679 PolarHBondContact O-N 3.07Å; L653-L685 HydrophobicContact CD2-CD1 4.42Å; L653-L707 HydrophobicContact CD2-CD1 3.84Å
654	F	84.1	Confident	66	Low	80 Å²	80	63 Å²	63	35%	0.351	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	120.9	178.2	-60.9	-92.4	0	0	0	109.9	T647 K652 V678	T647-F654 PolarHBondContact N-O 3.14Å; T647-F654 VanDerWaalsContact N-O 3.13Å; T647-F654 PolarHBondContact O-N 3.39Å; K652-F654 HydrophobicContact CB-CD2 4.3Å; K652-F654 HydrophobicContact CB-CE2 3.62Å; K652-F654 HydrophobicContact CB-CZ 3.88Å; K652-F654 HydrophobicContact CD-CZ 3.98Å; F654-V678 HydrophobicContact CD1-CG1 4.22Å; F654-V678 HydrophobicContact CD1-CG2 3.65Å; F654-V678 HydrophobicContact CE1-CG1 3.98Å; F654-V678 HydrophobicContact CE1-CG2 3.74Å; F654-V678 HydrophobicContact CZ-CG1 4.4Å
655	I	83.1	Confident	64.3	Low	18 Å²	18	67.2 Å²	67.2	9%	0.092	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	119.5	177.1	-63.1	170.2	0	0	0	108.9	R677 L679 F708	I655-R677 HydrophobicContact CB-CB 4.44Å; I655-R677 HydrophobicContact CD1-CB 4.47Å; I655-R677 PolarHBondContact N-O 2.7Å; I655-R677 VanDerWaalsContact N-O 3.12Å; I655-L679 HydrophobicContact CD1-CD1 3.77Å; I655-L679 HydrophobicContact CD1-CG 4.37Å; I655-F708 HydrophobicContact CD1-CB 4.01Å; I655-F708 HydrophobicContact CD1-CG 4.45Å; I655-F708 HydrophobicContact CG1-CB 4.27Å; I655-F708 HydrophobicContact CG1-CG 4.4Å; I655-F708 HydrophobicContact CG2-CB 4.37Å; I655-F708 HydrophobicContact CG2-CD1 4.08Å; I655-F708 HydrophobicContact CG2-CD2 3.29Å; I655-F708 HydrophobicContact CG2-CE1 4.16Å; I655-F708 HydrophobicContact CG2-CE2 3.39Å; I655-F708 HydrophobicContact CG2-CG 3.66Å; I655-F708 HydrophobicContact CG2-CZ 3.83Å
656	P	70.1	Confident	62	Low	19 Å²	19	74.4 Å²	74.4	12%	0.123	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-65	155.3	179.2	-17.7	29	0	0	0	113.2	L645	L645-P656 WeakPolarHBondContact O-CG 3.36Å
657	K	64.8	Low	59.4	Low	127 Å²	127	78.5 Å²	78.5	55%	0.552	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-69.8	138.7	176.9	-160.2	172.5	-177.4	173.7	0	110.4	S659 P674	K657-S659 PolarHBondContact O-N 2.93Å; K657-P674 VanDerWaalsContact CE-O 3.3Å; K657-P674 WeakPolarHBondContact CE-O 3.5Å
658	A	55.1	Low	56.8	Low	85 Å²	85	85.1 Å²	85.1	70%	0.702	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-68.6	116.5	173.8	0	0	0	0	0	109.8	S660	A658-S660 PolarHBondContact O-N 2.97Å
659	S	45.3	Very low	54.2	Low	62 Å²	62	92.7 Å²	92.7	43%	0.434	57%	0.565	S	S	.	*			trans	-65.2	114.4	171.5	-35.4	0	0	0	0	108.4	K657 S661	K657-S659 PolarHBondContact O-N 2.93Å; S659-S661 VanDerWaalsContact C-N 3.35Å; S659-S661 PolarHBondContact O-N 3.26Å
660	S	38.2	Very low	52	Low	125 Å²	125	97.8 Å²	97.8	87%	0.874	60%	0.6	S	S	*	*			trans	-71.3	86.2	178	55.1	0	0	0	0	110.5	A658	A658-S660 PolarHBondContact O-N 2.97Å
661	S	37	Very low	50	Low	98 Å²	98	97.1 Å²	97.1	69%	0.685	61%	0.609	S	S	*	*			trans	-149	63.6	170.3	65.8	0	0	0	0	112.3	S659	S659-S661 VanDerWaalsContact C-N 3.35Å; S659-S661 PolarHBondContact O-N 3.26Å
662	S	31.2	Very low	47.8	Very low	95 Å²	95	98.5 Å²	98.5	66%	0.664	62%	0.624	S	S	*	*			trans	-163.6	103	152	45.1	0	0	0	0	109.1	V664	S662-V664 PolarHBondContact O-N 3.46Å
663	S	37.5	Very low	45.4	Very low	127 Å²	127	100.7 Å²	100.7	89%	0.888	64%	0.64	S	S	*	*			trans	-70.3	93.6	173.5	51.6	0	0	0	0	110
664	V	29.6	Very low	43.3	Very low	133 Å²	133	105.2 Å²	105.2	81%	0.806	67%	0.67	S	S	*	*			trans	-137.4	112.5	156.4	-172.2	0	0	0	0	108.5	S662 N666	S662-V664 PolarHBondContact O-N 3.46Å; V664-N666 PolarHBondContact O-N 3.25Å
665	S	35.7	Very low	41.4	Very low	107 Å²	107	103.5 Å²	103.5	75%	0.748	68%	0.675	S	S	*	*			trans	-68	115	177.6	48.9	0	0	0	0	111.3
666	N	28.1	Very low	40.1	Very low	164 Å²	164	108.5 Å²	108.5	88%	0.877	70%	0.702	S	S	*	*			trans	-172	150.3	137.8	-101.3	-18	0	0	0	113.6	V664	V664-N666 PolarHBondContact O-N 3.25Å
667	A	31.1	Very low	40.3	Very low	88 Å²	88	116.1 Å²	116.1	73%	0.727	73%	0.728	S	S	*	*			trans	99.7	115.8	158.2	0	0	0	0	0	119	L669	A667-L669 PolarHBondContact O-N 2.9Å
668	N	33	Very low	41.1	Very low	162 Å²	162	113.4 Å²	113.4	87%	0.866	72%	0.722	S	S	*	*			trans	-43.7	121	151.3	-74.5	-34.5	0	0	0	111.7
669	L	32.1	Very low	42.5	Very low	161 Å²	161	111.6 Å²	111.6	84%	0.843	70%	0.7	S	S	*	*			trans	-151.5	146.5	150.4	-101.1	131	0	0	0	109.5	A667	A667-L669 PolarHBondContact O-N 2.9Å
670	S	31.4	Very low	44.3	Very low	111 Å²	111	113.9 Å²	113.9	78%	0.776	71%	0.713	S	S	*	*			trans	-56.8	140.6	-167.5	9.9	0	0	0	0	114.5	G672	S670-G672 PolarHBondContact O-N 2.94Å
671	S	35.1	Very low	46.4	Very low	128 Å²	128	110 Å²	110	90%	0.895	68%	0.682	S	S	*	*			trans	-44.9	117.4	-179.8	57.1	0	0	0	0	115.4
672	G	30.8	Very low	48.6	Very low	69 Å²	69	106.5 Å²	106.5	71%	0.711	66%	0.657	S	S	*	*			trans	-150.8	118.5	160	0	0	0	0	0	108.8	S670	S670-G672 PolarHBondContact O-N 2.94Å
673	D	34.6	Very low	51	Low	153 Å²	153	109.1 Å²	109.1	82%	0.818	66%	0.659	S	S	*	*			trans	-45.6	135.9	-178.3	-162.8	25.1	0	0	0	113.9	G675	D673-G675 PolarHBondContact O-N 2.88Å
674	P	41.1	Very low	53.4	Low	97 Å²	97	104.4 Å²	104.4	63%	0.63	62%	0.622	S	S	*	*			trans	-83.9	48.5	-177.2	36	-34.9	0	0	0	112.3	K657	K657-P674 VanDerWaalsContact CE-O 3.3Å; K657-P674 WeakPolarHBondContact CE-O 3.5Å
675	G	45.3	Very low	56.4	Low	44 Å²	44	98.3 Å²	98.3	45%	0.454	58%	0.584	S	S	.	*	S	Bend	trans	-88	158.3	170.9	0	0	0	0	0	112	D673 R677	D673-G675 PolarHBondContact O-N 2.88Å; G675-R677 PolarHBondContact O-N 3.27Å; G675-R677 VanDerWaalsContact O-N 3.1Å
676	N	55.8	Low	59	Low	123 Å²	123	93.2 Å²	93.2	66%	0.658	55%	0.549	S	S	*	.			trans	-50.2	119	173.7	-76.4	-10.6	0	0	0	110.2
677	R	74.8	Confident	62.2	Low	179 Å²	179	85.4 Å²	85.4	68%	0.675	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	113.9	-178.3	-138.1	176.3	-176.3	178.9	2.6	108.8	I655 G675	I655-R677 HydrophobicContact CB-CB 4.44Å; I655-R677 HydrophobicContact CD1-CB 4.47Å; I655-R677 PolarHBondContact N-O 2.7Å; I655-R677 VanDerWaalsContact N-O 3.12Å; G675-R677 PolarHBondContact O-N 3.27Å; G675-R677 VanDerWaalsContact O-N 3.1Å
678	V	81.4	Confident	65.1	Low	71 Å²	71	81.2 Å²	81.2	43%	0.43	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	122	177.2	-173.5	0	0	0	0	108.6	K652 L653 F654	K652-V678 HydrophobicContact CB-CG1 3.98Å; K652-V678 HydrophobicContact CD-CG1 3.9Å; K652-V678 HydrophobicContact CG-CG1 4.12Å; L653-V678 CarbonylContact O-C 3.58Å; L653-V678 WeakPolarHBondContact O-CA 3.25Å; F654-V678 HydrophobicContact CD1-CG1 4.22Å; F654-V678 HydrophobicContact CD1-CG2 3.65Å; F654-V678 HydrophobicContact CE1-CG1 3.98Å; F654-V678 HydrophobicContact CE1-CG2 3.74Å; F654-V678 HydrophobicContact CZ-CG1 4.4Å
679	L	83.8	Confident	68	Low	47 Å²	47	73.5 Å²	73.5	25%	0.246	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	154.6	178.3	-62.4	179.1	0	0	0	110.2	L653 I655 L707	L653-L679 HydrophobicContact CB-CB 4.27Å; L653-L679 HydrophobicContact CD2-CB 4.36Å; L653-L679 HydrophobicContact CD2-CD1 4.26Å; L653-L679 PolarHBondContact N-O 3.4Å; L653-L679 PolarHBondContact O-N 3.07Å; I655-L679 HydrophobicContact CD1-CD1 3.77Å; I655-L679 HydrophobicContact CD1-CG 4.37Å; L679-L707 HydrophobicContact CD1-CB 4.4Å; L679-L707 HydrophobicContact CD1-CD2 4.28Å
680	P	83.2	Confident	70.9	Confident	109 Å²	109	67.1 Å²	67.1	71%	0.708	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.7	140.1	167.3	27	-33.7	0	0	0	109.5	P682	P680-P682 WeakPolarHBondContact O-CD 3.29Å
681	M	81.8	Confident	73.7	Confident	45 Å²	45	63.6 Å²	63.6	22%	0.222	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-66.5	122.4	178.4	-172.7	170.8	84.4	0	0	109.8	V590 L648 G651	V590-M681 HydrophobicContact CG1-SD 4.38Å; L648-M681 HydrophobicContact CD2-CG 4.21Å; G651-M681 VanDerWaalsContact C-CB 3.43Å; G651-M681 WeakPolarHBondContact O-CB 3.48Å; G651-M681 PolarHBondContact O-N 3.47Å; G651-M681 VanDerWaalsContact O-N 3.12Å
682	P	83.3	Confident	76.3	Confident	23 Å²	23	62.5 Å²	62.5	15%	0.149	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-67.5	156.8	174.5	28.8	-32.5	0	0	0	109.9	P680 R684 L685 L707	P680-P682 WeakPolarHBondContact O-CD 3.29Å; P682-R684 PolarHBondContact O-N 2.84Å; P682-L685 HydrophobicContact CG-CB 4.46Å; P682-L685 HydrophobicContact CG-CD1 3.53Å; P682-L707 HydrophobicContact CG-CD1 4.25Å
683	Q	82.7	Confident	79.1	Confident	151 Å²	151	61.4 Å²	61.4	71%	0.706	34%	0.336	S	S	*	.	S	Bend	trans	-62.6	-36.1	175.9	-66.1	-166.3	-9.4	0	0	111
684	R	88.1	Confident	81.7	Confident	28 Å²	28	58 Å²	58	11%	0.106	32%	0.315	C	S	.	.	S	Bend	trans	-139	136.3	179.6	-62.4	-176.8	-67.1	164.6	3.5	109.8	R426 Y428 P682 A701 D702 E733	R426-R684 VanDerWaalsContact NE-NH1 3.12Å; Y428-R684 PolarHBondContact OH-NH1 3.4Å; P682-R684 PolarHBondContact O-N 2.84Å; R684-A701 HydrophobicContact CB-CB 3.83Å; R684-A701 PolarHBondContact O-N 3.36Å; R684-A701 VanDerWaalsContact O-N 3.13Å; R684-D702 IonicContact CZ-OD1 3.62Å; R684-D702 IonicContact NE-OD1 3.94Å; R684-D702 PolarHBondContact NE-OD1 3.43Å; R684-D702 IonicContact NH2-OD1 3.68Å; R684-D702 PolarHBondContact NH2-OD1 3.25Å; R684-E733 VanDerWaalsContact CD-CD 3.42Å; R684-E733 WeakPolarHBondContact CD-OE1 3.5Å; R684-E733 WeakPolarHBondContact CD-OE2 3.26Å; R684-E733 IonicContact CZ-OE2 2.66Å; R684-E733 IonicContact NH1-OE2 3.97Å; R684-E733 PolarHBondContact NH1-OE2 2.97Å
685	L	91.1	Very high	84.1	Confident	5 Å²	5	58 Å²	58	3%	0.026	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.9	178.5	-161.6	84.4	0	0	0	110.1	A587 F588 I646 L648 L653 P682 F698 Y699 L707	A587-L685 VanDerWaalsContact CA-O 3.25Å; A587-L685 WeakPolarHBondContact CA-O 3.27Å; F588-L685 HydrophobicContact CE1-CB 4.1Å; F588-L685 HydrophobicContact CE1-CD2 4.14Å; F588-L685 HydrophobicContact CE2-CB 4.22Å; F588-L685 HydrophobicContact CZ-CB 3.75Å; F588-L685 HydrophobicContact CZ-CD2 3.64Å; F588-L685 HydrophobicContact CZ-CG 4.27Å; F588-L685 PolarHBondContact N-O 2.79Å; F588-L685 PolarHBondContact O-N 3.37Å; I646-L685 HydrophobicContact CD1-CD2 3.4Å; L648-L685 HydrophobicContact CD1-CD2 4.29Å; L653-L685 HydrophobicContact CD2-CD1 4.42Å; P682-L685 HydrophobicContact CG-CB 4.46Å; P682-L685 HydrophobicContact CG-CD1 3.53Å; L685-F698 HydrophobicContact CD2-CD1 3.98Å; L685-Y699 WeakPolarHBondContact CD1-O 3.17Å; L685-L707 HydrophobicContact CD1-CD1 3.72Å
686	G	91.8	Very high	86.3	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	144.5	171.6	0	0	0	0	0	111.5	Y585 W586 F698 Y699	Y585-G686 WeakPolarHBondContact OH-CA 3.28Å; W586-G686 CarbonylContact O-C 3.5Å; W586-G686 WeakPolarHBondContact O-CA 3.43Å; G686-F698 CarbonylContact O-C 3.53Å; G686-F698 WeakPolarHBondContact O-CA 3.41Å; G686-Y699 PolarHBondContact N-O 3.21Å; G686-Y699 PolarHBondContact O-N 3.36Å
687	V	93.4	Very high	88	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129.9	171.7	-173	0	0	0	0	107.8	Y585 W586 F588 V599 V696 Y697 F698	Y585-V687 CarbonylContact C-O 3.48Å; Y585-V687 VanDerWaalsContact CA-O 3.3Å; Y585-V687 WeakPolarHBondContact CA-O 3.5Å; W586-V687 HydrophobicContact CD2-CB 4.09Å; W586-V687 HydrophobicContact CH2-CB 4.29Å; W586-V687 HydrophobicContact CH2-CG1 3.77Å; W586-V687 HydrophobicContact CZ2-CB 3.67Å; W586-V687 HydrophobicContact CZ2-CG1 3.4Å; W586-V687 HydrophobicContact CZ2-CG2 4.41Å; W586-V687 PolarHBondContact N-O 3.27Å; W586-V687 PolarHBondContact O-N 2.93Å; F588-V687 HydrophobicContact CE1-CG2 3.87Å; V599-V687 HydrophobicContact CG1-CG2 4.21Å; V687-V696 HydrophobicContact CG1-CG2 3.66Å; V687-Y697 CarbonylContact C-O 3.51Å; V687-Y697 WeakPolarHBondContact CA-O 3.44Å; V687-F698 HydrophobicContact CG1-CD1 4.4Å; V687-F698 HydrophobicContact CG1-CE1 4.15Å; V687-F698 HydrophobicContact CG2-CD1 3.81Å; V687-F698 HydrophobicContact CG2-CE1 3.85Å
688	C	93.3	Very high	88.8	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	116.7	172.7	-169.9	0	0	0	0	109	P519 R583 H584 Y585 V696 Y697 Y699	P519-C688 HydrophobicContact CG-CB 4.12Å; R583-C688 PolarHBondContact NE-SG 2.8Å; H584-C688 CarbonylContact O-C 3.51Å; H584-C688 VanDerWaalsContact O-CA 3.27Å; H584-C688 WeakPolarHBondContact O-CA 3.44Å; Y585-C688 HydrophobicContact CD2-CB 4.13Å; C688-V696 CarbonylContact O-C 3.57Å; C688-V696 WeakPolarHBondContact O-CA 3.41Å; C688-Y697 HydrophobicContact CB-CD2 4.45Å; C688-Y697 PolarHBondContact N-O 3.4Å; C688-Y697 PolarHBondContact O-N 3.05Å; C688-Y699 HydrophobicContact CB-CD2 4.2Å; C688-Y699 HydrophobicContact CB-CE2 3.63Å
689	L	93.6	Very high	89.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	120.7	170.7	178.8	64.3	0	0	0	108.8	I579 R583 H584 W586 V601 V696 M718	I579-L689 HydrophobicContact CB-CD2 4.2Å; I579-L689 HydrophobicContact CD1-CD2 3.9Å; I579-L689 HydrophobicContact CG2-CD2 4.07Å; R583-L689 CarbonylContact C-O 3.56Å; R583-L689 WeakPolarHBondContact CA-O 3.13Å; H584-L689 PolarHBondContact N-O 3.28Å; H584-L689 PolarHBondContact O-N 3.4Å; W586-L689 HydrophobicContact CH2-CB 3.92Å; W586-L689 HydrophobicContact CZ3-CB 3.89Å; V601-L689 HydrophobicContact CG1-CD2 4.4Å; V601-L689 HydrophobicContact CG2-CD1 4.37Å; L689-V696 HydrophobicContact CD1-CB 4.37Å; L689-M718 HydrophobicContact CD2-CB 3.64Å; L689-M718 HydrophobicContact CD2-CG 4.13Å
690	D	92.4	Very high	89.5	Confident	26 Å²	26	39.8 Å²	39.8	14%	0.139	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	94.5	166.8	-165.9	-28.5	0	0	0	107.9	R583 D692 A693 H694 R695 Y697	R583-D690 HydrophobicContact CG-CB 3.94Å; R583-D690 IonicContact NE-OD2 3.61Å; D690-D692 VanDerWaalsContact C-N 3.29Å; D690-D692 PolarHBondContact O-N 3.26Å; D690-D692 PolarHBondContact OD1-N 2.88Å; D690-A693 HydrophobicContact CB-CB 4.07Å; D690-A693 WeakPolarHBondContact OD1-CB 3.37Å; D690-A693 PolarHBondContact OD1-N 3.29Å; D690-A693 WeakPolarHBondContact OD2-CB 3.3Å; D690-H694 PolarHBondContact O-N 2.84Å; D690-H694 VanDerWaalsContact O-N 3.1Å; D690-R695 PolarHBondContact N-O 3.4Å; D690-R695 PolarHBondContact O-N 3.01Å; D690-Y697 HydrophobicContact CB-CE2 4.1Å
691	Y	90.6	Very high	89.6	Confident	38 Å²	38	34.8 Å²	34.8	15%	0.149	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-42.8	-177.2	-174.5	-81	0	0	0	110.4	I579 S580 G582 H694 C714 G716 M718	I579-Y691 HydrophobicContact CG2-CD2 4.44Å; S580-Y691 WeakPolarHBondContact O-CE1 3.36Å; S580-Y691 VanDerWaalsContact O-CZ 3.24Å; G582-Y691 VanDerWaalsContact O-CB 3.25Å; G582-Y691 WeakPolarHBondContact O-CB 3.34Å; G582-Y691 PolarHBondContact O-N 3.33Å; Y691-H694 PolarHBondContact O-N 3.08Å; Y691-C714 HydrophobicContact CD1-CB 4.41Å; Y691-C714 HydrophobicContact CD2-CB 3.77Å; Y691-C714 HydrophobicContact CE1-CB 4.24Å; Y691-C714 HydrophobicContact CE2-CB 3.6Å; Y691-C714 HydrophobicContact CG-CB 4.18Å; Y691-C714 PolarHBondContact OH-O 2.84Å; Y691-G716 WeakPolarHBondContact CE2-O 3.21Å; Y691-G716 PolarHBondContact OH-O 2.83Å; Y691-G716 VanDerWaalsContact OH-O 3.04Å; Y691-M718 HydrophobicContact CD2-CG 3.86Å; Y691-M718 HydrophobicContact CE2-CG 3.82Å
692	D	90.6	Very high	89.6	Confident	105 Å²	105	36 Å²	36	56%	0.561	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-35.6	-173.7	-54.5	-25.9	0	0	0	111.6	G582 D690 H694	G582-D692 VanDerWaalsContact CA-OD2 3.26Å; G582-D692 WeakPolarHBondContact CA-OD2 3.45Å; G582-D692 PolarHBondContact N-OD1 2.95Å; G582-D692 PolarHBondContact N-OD2 3.32Å; D690-D692 VanDerWaalsContact C-N 3.29Å; D690-D692 PolarHBondContact O-N 3.26Å; D690-D692 PolarHBondContact OD1-N 2.88Å; D692-H694 VanDerWaalsContact C-N 3.33Å
693	A	89.6	Confident	89.6	Confident	46 Å²	46	38.9 Å²	38.9	38%	0.38	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	0.5	174.4	0	0	0	0	0	113.9	D690 R695	D690-A693 HydrophobicContact CB-CB 4.07Å; D690-A693 WeakPolarHBondContact OD1-CB 3.37Å; D690-A693 PolarHBondContact OD1-N 3.29Å; D690-A693 WeakPolarHBondContact OD2-CB 3.3Å; A693-R695 VanDerWaalsContact C-N 3.32Å; A693-R695 PolarHBondContact O-N 3.34Å
694	H	89.1	Confident	89.8	Confident	80 Å²	80	32.6 Å²	32.6	37%	0.37	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	43	-177.5	-65.8	-67.1	0	0	0	113.5	D690 Y691 D692 Q711 V712 C714	D690-H694 PolarHBondContact O-N 2.84Å; D690-H694 VanDerWaalsContact O-N 3.1Å; Y691-H694 PolarHBondContact O-N 3.08Å; D692-H694 VanDerWaalsContact C-N 3.33Å; H694-Q711 WeakPolarHBondContact O-CA 3.39Å; H694-Q711 VanDerWaalsContact O-CG 3.28Å; H694-Q711 WeakPolarHBondContact O-CG 3.27Å; H694-V712 CarbonylContact C-O 3.47Å; H694-V712 WeakPolarHBondContact CB-O 3.31Å; H694-V712 PolarHBondContact O-N 2.82Å; H694-C714 WeakPolarHBondContact ND1-CB 3.49Å
695	R	90.4	Very high	89.7	Confident	97 Å²	97	39.9 Å²	39.9	37%	0.366	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	144.9	-174.8	-76.3	179.4	172.7	-133.2	-3.9	112.4	D690 A693 Y697 E709 R710	D690-R695 PolarHBondContact N-O 3.4Å; D690-R695 PolarHBondContact O-N 3.01Å; A693-R695 VanDerWaalsContact C-N 3.32Å; A693-R695 PolarHBondContact O-N 3.34Å; R695-Y697 HydrophobicContact CB-CE2 3.8Å; R695-Y697 VanDerWaalsContact CD-OH 3.29Å; R695-Y697 WeakPolarHBondContact CD-OH 3.42Å; R695-E709 IonicContact NH1-OE1 3.81Å; R695-E709 PolarHBondContact NH1-OE1 2.92Å; R695-E709 IonicContact NH1-OE2 3.8Å; R695-R710 WeakPolarHBondContact CA-O 3.4Å
696	V	91.8	Very high	89.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	139.7	169.3	73.5	0	0	0	0	110	V601 T644 V687 C688 L689 F698 E709 R710 V712	V601-V696 HydrophobicContact CG1-CG2 4.33Å; V601-V696 HydrophobicContact CG2-CB 4.47Å; V601-V696 HydrophobicContact CG2-CG2 4.39Å; T644-V696 HydrophobicContact CG2-CG1 3.9Å; V687-V696 HydrophobicContact CG1-CG2 3.66Å; C688-V696 CarbonylContact O-C 3.57Å; C688-V696 WeakPolarHBondContact O-CA 3.41Å; L689-V696 HydrophobicContact CD1-CB 4.37Å; V696-F698 HydrophobicContact CG1-CE2 3.9Å; V696-F698 HydrophobicContact CG1-CZ 4.46Å; V696-F698 HydrophobicContact CG2-CE2 4.34Å; V696-F698 HydrophobicContact CG2-CZ 4.41Å; V696-E709 WeakPolarHBondContact O-CA 3.34Å; V696-R710 HydrophobicContact CG1-CB 4.32Å; V696-R710 PolarHBondContact N-O 2.92Å; V696-R710 PolarHBondContact O-N 3.28Å; V696-V712 HydrophobicContact CB-CG2 3.79Å; V696-V712 HydrophobicContact CG1-CG2 3.44Å; V696-V712 VanDerWaalsContact CG1-CG2 3.44Å
697	Y	92	Very high	89.4	Confident	30 Å²	30	44.1 Å²	44.1	12%	0.118	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	140.3	180	-54.4	-95.8	0	0	0	109.2	V687 C688 D690 R695 Y699 F708 E709	V687-Y697 CarbonylContact C-O 3.51Å; V687-Y697 WeakPolarHBondContact CA-O 3.44Å; C688-Y697 HydrophobicContact CB-CD2 4.45Å; C688-Y697 PolarHBondContact N-O 3.4Å; C688-Y697 PolarHBondContact O-N 3.05Å; D690-Y697 HydrophobicContact CB-CE2 4.1Å; R695-Y697 HydrophobicContact CB-CE2 3.8Å; R695-Y697 VanDerWaalsContact CD-OH 3.29Å; R695-Y697 WeakPolarHBondContact CD-OH 3.42Å; Y697-Y699 HydrophobicContact CG-CE2 4.26Å; Y697-F708 CarbonylContact C-O 3.59Å; Y697-F708 WeakPolarHBondContact CA-O 3.33Å; Y697-E709 HydrophobicContact CD1-CB 3.58Å; Y697-E709 HydrophobicContact CE1-CB 3.91Å; Y697-E709 VanDerWaalsContact CE1-OE2 3.28Å; Y697-E709 WeakPolarHBondContact CE1-OE2 3.38Å; Y697-E709 HydrophobicContact CG-CB 4.45Å
698	F	91.3	Very high	89.1	Confident	1 Å²	1	46 Å²	46	0%	0.004	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	129.3	175.3	-63.5	-89.8	0	0	0	108.8	V599 I646 L685 G686 V687 V696 L707 F708	V599-F698 HydrophobicContact CG1-CE1 4.38Å; I646-F698 HydrophobicContact CD1-CB 4.35Å; I646-F698 HydrophobicContact CD1-CD1 3.27Å; I646-F698 HydrophobicContact CD1-CD2 4.49Å; I646-F698 HydrophobicContact CD1-CE1 3.52Å; I646-F698 HydrophobicContact CD1-CG 3.8Å; I646-F698 HydrophobicContact CD1-CZ 4.23Å; I646-F698 HydrophobicContact CG1-CD1 3.9Å; I646-F698 HydrophobicContact CG1-CE1 3.6Å; I646-F698 HydrophobicContact CG1-CG 4.48Å; I646-F698 HydrophobicContact CG1-CZ 3.95Å; I646-F698 HydrophobicContact CG2-CD2 4.07Å; I646-F698 HydrophobicContact CG2-CE1 4.4Å; I646-F698 HydrophobicContact CG2-CE2 3.85Å; I646-F698 HydrophobicContact CG2-CG 4.42Å; I646-F698 HydrophobicContact CG2-CZ 4.01Å; L685-F698 HydrophobicContact CD2-CD1 3.98Å; G686-F698 CarbonylContact O-C 3.53Å; G686-F698 WeakPolarHBondContact O-CA 3.41Å; V687-F698 HydrophobicContact CG1-CD1 4.4Å; V687-F698 HydrophobicContact CG1-CE1 4.15Å; V687-F698 HydrophobicContact CG2-CD1 3.81Å; V687-F698 HydrophobicContact CG2-CE1 3.85Å; V696-F698 HydrophobicContact CG1-CE2 3.9Å; V696-F698 HydrophobicContact CG1-CZ 4.46Å; V696-F698 HydrophobicContact CG2-CE2 4.34Å; V696-F698 HydrophobicContact CG2-CZ 4.41Å; F698-L707 WeakPolarHBondContact O-CB 3.49Å; F698-L707 PolarHBondContact O-N 3.18Å; F698-F708 HydrophobicContact CB-CB 4.3Å; F698-F708 HydrophobicContact CD2-CB 4.25Å; F698-F708 AromaticContact CD2-CD1 3.66Å; F698-F708 HydrophobicContact CD2-CD1 3.66Å; F698-F708 HydrophobicContact CD2-CG 4.4Å; F698-F708 AromaticContact CE2-CD1 3.96Å; F698-F708 HydrophobicContact CE2-CD1 3.96Å; F698-F708 HydrophobicContact CE2-CE1 4.46Å; F698-F708 PolarHBondContact N-O 3.27Å; F698-F708 PolarHBondContact O-N 3.33Å
699	Y	90.2	Very high	88.8	Confident	21 Å²	21	50.5 Å²	50.5	8%	0.082	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	150.3	-174.8	-66.7	-93.1	0	0	0	110.9	P519 Y585 L685 G686 C688 Y697 A701 M704 R705 C706	P519-Y699 HydrophobicContact CG-CD2 4.39Å; P519-Y699 HydrophobicContact CG-CE1 4.36Å; P519-Y699 HydrophobicContact CG-CE2 3.75Å; Y585-Y699 HydrophobicContact CE2-CD2 4.3Å; L685-Y699 WeakPolarHBondContact CD1-O 3.17Å; G686-Y699 PolarHBondContact N-O 3.21Å; G686-Y699 PolarHBondContact O-N 3.36Å; C688-Y699 HydrophobicContact CB-CD2 4.2Å; C688-Y699 HydrophobicContact CB-CE2 3.63Å; Y697-Y699 HydrophobicContact CG-CE2 4.26Å; Y699-A701 PolarHBondContact O-N 3.42Å; Y699-M704 WeakPolarHBondContact CD1-O 3.48Å; Y699-R705 WeakPolarHBondContact CA-O 3.3Å; Y699-C706 HydrophobicContact CD1-CB 3.96Å; Y699-C706 HydrophobicContact CE1-CB 3.63Å
700	D	89.3	Confident	88.4	Confident	30 Å²	30	54.2 Å²	54.2	16%	0.16	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	114.8	154.9	174.9	1.4	0	0	0	107.5	D702 T703 M704 R705 L707	D700-D702 PolarHBondContact O-N 2.86Å; D700-D702 PolarHBondContact OD1-N 2.82Å; D700-D702 VanDerWaalsContact OD1-N 3.09Å; D700-T703 WeakPolarHBondContact CB-OG1 3.44Å; D700-T703 PolarHBondContact O-N 3.26Å; D700-T703 PolarHBondContact OD2-OG1 3.4Å; D700-M704 WeakPolarHBondContact O-CA 3.46Å; D700-M704 PolarHBondContact O-N 2.9Å; D700-R705 PolarHBondContact N-O 3.21Å; D700-L707 HydrophobicContact CB-CD1 4.18Å; D700-L707 HydrophobicContact CB-CD2 4.23Å; D700-L707 HydrophobicContact CB-CG 4.29Å
701	A	86	Confident	88	Confident	5 Å²	5	59.1 Å²	59.1	4%	0.041	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-15.4	-173.1	0	0	0	0	0	113.4	Y585 A587 R684 Y699	Y585-A701 WeakPolarHBondContact OH-CB 3.31Å; A587-A701 HydrophobicContact CB-CB 4.09Å; R684-A701 HydrophobicContact CB-CB 3.83Å; R684-A701 PolarHBondContact O-N 3.36Å; R684-A701 VanDerWaalsContact O-N 3.13Å; Y699-A701 PolarHBondContact O-N 3.42Å
702	D	81.8	Confident	87.7	Confident	70 Å²	70	57.7 Å²	57.7	37%	0.374	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-38	177.6	-61.7	-40.8	0	0	0	111.5	R684 D700	R684-D702 IonicContact CZ-OD1 3.62Å; R684-D702 IonicContact NE-OD1 3.94Å; R684-D702 PolarHBondContact NE-OD1 3.43Å; R684-D702 IonicContact NH2-OD1 3.68Å; R684-D702 PolarHBondContact NH2-OD1 3.25Å; D700-D702 PolarHBondContact O-N 2.86Å; D700-D702 PolarHBondContact OD1-N 2.82Å; D700-D702 VanDerWaalsContact OD1-N 3.09Å
703	T	81.8	Confident	87.3	Confident	83 Å²	83	57 Å²	57	51%	0.509	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-8.3	-175.9	61.8	0	0	0	0	114	D700 R705	D700-T703 WeakPolarHBondContact CB-OG1 3.44Å; D700-T703 PolarHBondContact O-N 3.26Å; D700-T703 PolarHBondContact OD2-OG1 3.4Å; T703-R705 PolarHBondContact O-N 2.75Å; T703-R705 VanDerWaalsContact O-N 3.16Å; T703-R705 WeakPolarHBondContact OG1-CB 3.45Å; T703-R705 PolarHBondContact OG1-N 3.48Å
704	M	87.3	Confident	87	Confident	19 Å²	19	55.2 Å²	55.2	9%	0.094	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	26.5	-168.6	-64.4	-62.7	172.6	0	0	113.7	Y428 H516 P518 Y585 Y699 D700	Y428-M704 HydrophobicContact CE1-CE 4.31Å; H516-M704 HydrophobicContact CB-CB 3.84Å; H516-M704 HydrophobicContact CB-CG 3.81Å; P518-M704 HydrophobicContact CB-CE 4.22Å; P518-M704 HydrophobicContact CG-CE 3.81Å; Y585-M704 HydrophobicContact CE1-CE 4.41Å; Y585-M704 HydrophobicContact CE2-SD 4.27Å; Y699-M704 WeakPolarHBondContact CD1-O 3.48Å; D700-M704 WeakPolarHBondContact O-CA 3.46Å; D700-M704 PolarHBondContact O-N 2.9Å
705	R	86	Confident	86.5	Confident	181 Å²	181	53.2 Å²	53.2	68%	0.683	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	125.7	175.6	-175.8	-178.9	178.2	-176.8	1.6	110.2	Y699 D700 T703 L707	Y699-R705 WeakPolarHBondContact CA-O 3.3Å; D700-R705 PolarHBondContact N-O 3.21Å; T703-R705 PolarHBondContact O-N 2.75Å; T703-R705 VanDerWaalsContact O-N 3.16Å; T703-R705 WeakPolarHBondContact OG1-CB 3.45Å; T703-R705 PolarHBondContact OG1-N 3.48Å; R705-L707 PolarHBondContact O-N 2.92Å
706	C	88.3	Confident	86.3	Confident	56 Å²	56	50.2 Å²	50.2	38%	0.378	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	122.1	173.1	-172.1	0	0	0	0	110.1	Y699	Y699-C706 HydrophobicContact CD1-CB 3.96Å; Y699-C706 HydrophobicContact CE1-CB 3.63Å
707	L	88.4	Confident	86.2	Confident	39 Å²	39	52.3 Å²	52.3	20%	0.204	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-40.1	179.5	-59.4	177.8	0	0	0	111.5	L653 L679 P682 L685 F698 D700 R705	L653-L707 HydrophobicContact CD2-CD1 3.84Å; L679-L707 HydrophobicContact CD1-CB 4.4Å; L679-L707 HydrophobicContact CD1-CD2 4.28Å; P682-L707 HydrophobicContact CG-CD1 4.25Å; L685-L707 HydrophobicContact CD1-CD1 3.72Å; F698-L707 WeakPolarHBondContact O-CB 3.49Å; F698-L707 PolarHBondContact O-N 3.18Å; D700-L707 HydrophobicContact CB-CD1 4.18Å; D700-L707 HydrophobicContact CB-CD2 4.23Å; D700-L707 HydrophobicContact CB-CG 4.29Å; R705-L707 PolarHBondContact O-N 2.92Å
708	F	86.9	Confident	86.2	Confident	38 Å²	38	51 Å²	51	17%	0.167	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	142.7	-177.1	-179.1	-126.8	0	0	0	111.3	I646 I655 Y697 F698 R710	I646-F708 HydrophobicContact CG2-CD1 3.58Å; I646-F708 HydrophobicContact CG2-CE1 3.93Å; I655-F708 HydrophobicContact CD1-CB 4.01Å; I655-F708 HydrophobicContact CD1-CG 4.45Å; I655-F708 HydrophobicContact CG1-CB 4.27Å; I655-F708 HydrophobicContact CG1-CG 4.4Å; I655-F708 HydrophobicContact CG2-CB 4.37Å; I655-F708 HydrophobicContact CG2-CD1 4.08Å; I655-F708 HydrophobicContact CG2-CD2 3.29Å; I655-F708 HydrophobicContact CG2-CE1 4.16Å; I655-F708 HydrophobicContact CG2-CE2 3.39Å; I655-F708 HydrophobicContact CG2-CG 3.66Å; I655-F708 HydrophobicContact CG2-CZ 3.83Å; Y697-F708 CarbonylContact C-O 3.59Å; Y697-F708 WeakPolarHBondContact CA-O 3.33Å; F698-F708 HydrophobicContact CB-CB 4.3Å; F698-F708 HydrophobicContact CD2-CB 4.25Å; F698-F708 AromaticContact CD2-CD1 3.66Å; F698-F708 HydrophobicContact CD2-CD1 3.66Å; F698-F708 HydrophobicContact CD2-CG 4.4Å; F698-F708 AromaticContact CE2-CD1 3.96Å; F698-F708 HydrophobicContact CE2-CD1 3.96Å; F698-F708 HydrophobicContact CE2-CE1 4.46Å; F698-F708 PolarHBondContact N-O 3.27Å; F698-F708 PolarHBondContact O-N 3.33Å; F708-R710 HydrophobicContact CE1-CB 3.9Å; F708-R710 HydrophobicContact CZ-CB 3.92Å; F708-R710 HydrophobicContact CZ-CG 4.45Å
709	E	87.1	Confident	86.1	Confident	96 Å²	96	52.6 Å²	52.6	45%	0.449	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	145.7	171.6	66.8	170.3	-138.7	0	0	110.6	R695 V696 Y697	R695-E709 IonicContact NH1-OE1 3.81Å; R695-E709 PolarHBondContact NH1-OE1 2.92Å; R695-E709 IonicContact NH1-OE2 3.8Å; V696-E709 WeakPolarHBondContact O-CA 3.34Å; Y697-E709 HydrophobicContact CD1-CB 3.58Å; Y697-E709 HydrophobicContact CE1-CB 3.91Å; Y697-E709 VanDerWaalsContact CE1-OE2 3.28Å; Y697-E709 WeakPolarHBondContact CE1-OE2 3.38Å; Y697-E709 HydrophobicContact CG-CB 4.45Å
710	R	85.6	Confident	86.3	Confident	77 Å²	77	51.6 Å²	51.6	29%	0.291	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	145.7	177.8	-173.8	164	173.3	171	4.4	111.3	T644 R695 V696 F708	T644-R710 HydrophobicContact CG2-CB 4.33Å; T644-R710 HydrophobicContact CG2-CG 4.13Å; R695-R710 WeakPolarHBondContact CA-O 3.4Å; V696-R710 HydrophobicContact CG1-CB 4.32Å; V696-R710 PolarHBondContact N-O 2.92Å; V696-R710 PolarHBondContact O-N 3.28Å; F708-R710 HydrophobicContact CE1-CB 3.9Å; F708-R710 HydrophobicContact CZ-CB 3.92Å; F708-R710 HydrophobicContact CZ-CG 4.45Å
711	Q	84.1	Confident	86.3	Confident	130 Å²	130	50.2 Å²	50.2	61%	0.607	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	137	172.1	-164	172.7	7.4	0	0	110.3	H694	H694-Q711 WeakPolarHBondContact O-CA 3.39Å; H694-Q711 VanDerWaalsContact O-CG 3.28Å; H694-Q711 WeakPolarHBondContact O-CG 3.27Å
712	V	85.1	Confident	86.4	Confident	8 Å²	8	50 Å²	50	5%	0.048	26%	0.257	C	S	.	.			trans	-129.8	135.8	179.9	-174.8	0	0	0	0	108.9	V601 T644 H694 V696 C714 M718	V601-V712 HydrophobicContact CG2-CG1 3.93Å; V601-V712 HydrophobicContact CG2-CG2 4.18Å; T644-V712 HydrophobicContact CG2-CG2 3.9Å; T644-V712 WeakPolarHBondContact OG1-CG2 3.29Å; H694-V712 CarbonylContact C-O 3.47Å; H694-V712 WeakPolarHBondContact CB-O 3.31Å; H694-V712 PolarHBondContact O-N 2.82Å; V696-V712 HydrophobicContact CB-CG2 3.79Å; V696-V712 HydrophobicContact CG1-CG2 3.44Å; V696-V712 VanDerWaalsContact CG1-CG2 3.44Å; V712-C714 PolarHBondContact O-N 2.73Å; V712-M718 HydrophobicContact CG1-CE 3.67Å
713	D	82.3	Confident	86.6	Confident	89 Å²	89	46.6 Å²	46.6	48%	0.476	24%	0.239	S	C	.	.			trans	-78.7	106.9	173.1	172.8	30.2	0	0	0	109.6	K606 S715	K606-D713 IonicContact NZ-OD2 3.44Å; K606-D713 PolarHBondContact NZ-OD2 3.39Å; D713-S715 PolarHBondContact O-N 3.14Å
714	C	82.3	Confident	86.8	Confident	9 Å²	9	42.7 Å²	42.7	6%	0.061	22%	0.215	C	C	.	.			trans	-91.2	78.9	-178.5	-54.1	0	0	0	0	109.6	Y691 H694 V712 M718	Y691-C714 HydrophobicContact CD1-CB 4.41Å; Y691-C714 HydrophobicContact CD2-CB 3.77Å; Y691-C714 HydrophobicContact CE1-CB 4.24Å; Y691-C714 HydrophobicContact CE2-CB 3.6Å; Y691-C714 HydrophobicContact CG-CB 4.18Å; Y691-C714 PolarHBondContact OH-O 2.84Å; H694-C714 WeakPolarHBondContact ND1-CB 3.49Å; V712-C714 PolarHBondContact O-N 2.73Å; C714-M718 HydrophobicContact CB-CG 4.33Å; C714-M718 HydrophobicContact CB-SD 4.49Å
715	S	79.1	Confident	86.3	Confident	38 Å²	38	42.9 Å²	42.9	27%	0.266	22%	0.216	S	C	.	.			trans	-103.4	102.7	177.7	62.7	0	0	0	0	110.9	S603 T605 D713	S603-S715 VanDerWaalsContact CB-O 3.28Å; S603-S715 WeakPolarHBondContact CB-O 3.48Å; T605-S715 PolarHBondContact OG1-O 3.22Å; T605-S715 PolarHBondContact OG1-OG 2.79Å; D713-S715 PolarHBondContact O-N 3.14Å
716	G	85.3	Confident	85.6	Confident	34 Å²	34	35.8 Å²	35.8	35%	0.351	20%	0.199	S	C	.	.	S	Bend	trans	84.4	-147.6	-177.7	0	0	0	0	0	112.4	Y691	Y691-G716 WeakPolarHBondContact CE2-O 3.21Å; Y691-G716 PolarHBondContact OH-O 2.83Å; Y691-G716 VanDerWaalsContact OH-O 3.04Å
717	T	90.1	Very high	85.1	Confident	44 Å²	44	36.3 Å²	36.3	27%	0.27	20%	0.204	S	C	.	.			trans	-87	125.6	-176.3	-44.9	0	0	0	0	111	S603 D604 F719	S603-T717 CarbonylContact C-O 3.55Å; S603-T717 WeakPolarHBondContact CA-O 3.48Å; D604-T717 PolarHBondContact N-O 3.11Å; D604-T717 PolarHBondContact OD1-N 3.18Å; D604-T717 WeakPolarHBondContact OD2-CB 3.38Å; D604-T717 PolarHBondContact OD2-N 2.96Å; D604-T717 PolarHBondContact OD2-OG1 3.15Å; D604-T717 VanDerWaalsContact OD2-OG1 3.05Å; T717-F719 HydrophobicContact CG2-CE2 3.7Å; T717-F719 HydrophobicContact CG2-CZ 3.76Å; T717-F719 WeakPolarHBondContact O-CD2 3.36Å; T717-F719 WeakPolarHBondContact O-CE2 3.37Å
718	M	91.4	Very high	84.8	Confident	3 Å²	3	34.5 Å²	34.5	2%	0.015	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	139.3	178.7	-61.2	-62.1	-67.2	0	0	112	G578 I579 V601 A602 S603 L689 Y691 V712 C714	G578-M718 CarbonylContact C-O 3.56Å; G578-M718 VanDerWaalsContact CA-O 3.28Å; G578-M718 WeakPolarHBondContact CA-O 3.41Å; I579-M718 HydrophobicContact CB-CB 4.43Å; I579-M718 PolarHBondContact N-O 3.4Å; I579-M718 PolarHBondContact O-N 3.48Å; V601-M718 HydrophobicContact CB-CE 4.03Å; V601-M718 HydrophobicContact CG2-CE 3.87Å; A602-M718 CarbonylContact O-C 3.56Å; A602-M718 VanDerWaalsContact O-CA 3.26Å; A602-M718 WeakPolarHBondContact O-CA 3.2Å; S603-M718 WeakPolarHBondContact CB-SD 3.47Å; L689-M718 HydrophobicContact CD2-CB 3.64Å; L689-M718 HydrophobicContact CD2-CG 4.13Å; Y691-M718 HydrophobicContact CD2-CG 3.86Å; Y691-M718 HydrophobicContact CE2-CG 3.82Å; V712-M718 HydrophobicContact CG1-CE 3.67Å; C714-M718 HydrophobicContact CB-CG 4.33Å; C714-M718 HydrophobicContact CB-SD 4.49Å
719	F	90.9	Very high	84.8	Confident	35 Å²	35	35 Å²	35	15%	0.154	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	140.9	179.7	-65.6	-93.6	0	0	0	111	I574 G575 T577 G578 V601 A602 D604 L607 T717 A721	I574-F719 HydrophobicContact CB-CB 4.3Å; I574-F719 HydrophobicContact CD1-CB 4.48Å; I574-F719 HydrophobicContact CD1-CD1 4.44Å; I574-F719 HydrophobicContact CD1-CG 4.33Å; G575-F719 WeakPolarHBondContact O-CD1 3.27Å; T577-F719 WeakPolarHBondContact O-CD1 3.49Å; G578-F719 VanDerWaalsContact N-CE1 3.31Å; V601-F719 CarbonylContact C-O 3.52Å; V601-F719 VanDerWaalsContact CA-O 3.28Å; V601-F719 WeakPolarHBondContact CA-O 3.47Å; A602-F719 PolarHBondContact N-O 3.34Å; A602-F719 PolarHBondContact O-N 3.22Å; D604-F719 HydrophobicContact CB-CE2 4.1Å; L607-F719 HydrophobicContact CD1-CD2 4.18Å; T717-F719 HydrophobicContact CG2-CE2 3.7Å; T717-F719 HydrophobicContact CG2-CZ 3.76Å; T717-F719 WeakPolarHBondContact O-CD2 3.36Å; T717-F719 WeakPolarHBondContact O-CE2 3.37Å; F719-A721 PolarHBondContact O-N 3.29Å
720	P	92.9	Very high	85	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56	132.9	162.5	-22.3	33.7	0	0	0	109.8	F523 F525 I574 G575 W586 F722	F523-P720 HydrophobicContact CD1-CG 4.45Å; F523-P720 HydrophobicContact CE1-CG 4.17Å; F525-P720 HydrophobicContact CD1-CG 3.93Å; F525-P720 HydrophobicContact CD2-CB 4.47Å; F525-P720 HydrophobicContact CD2-CG 4.32Å; F525-P720 HydrophobicContact CE1-CB 4.01Å; F525-P720 HydrophobicContact CE1-CG 3.71Å; F525-P720 HydrophobicContact CE2-CB 3.86Å; F525-P720 HydrophobicContact CE2-CG 4.12Å; F525-P720 HydrophobicContact CG-CG 4.22Å; F525-P720 HydrophobicContact CZ-CB 3.59Å; F525-P720 HydrophobicContact CZ-CG 3.81Å; I574-P720 CarbonylContact C-O 3.53Å; I574-P720 VanDerWaalsContact CA-O 3.22Å; I574-P720 WeakPolarHBondContact CA-O 3.49Å; G575-P720 PolarHBondContact N-O 3.47Å; W586-P720 HydrophobicContact CD2-CG 4.29Å; W586-P720 HydrophobicContact CH2-CG 4.21Å; W586-P720 HydrophobicContact CZ2-CB 3.82Å; W586-P720 HydrophobicContact CZ2-CG 3.87Å; P720-F722 HydrophobicContact CB-CE2 4.1Å
721	A	89.4	Confident	85.3	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	139.4	-174.2	0	0	0	0	0	111.8	I574 G600 A602 F643 F719	I574-A721 HydrophobicContact CG2-CB 4.1Å; G600-A721 PolarHBondContact N-O 2.78Å; G600-A721 PolarHBondContact O-N 3.34Å; A602-A721 HydrophobicContact CB-CB 4.12Å; F643-A721 HydrophobicContact CD1-CB 3.46Å; F643-A721 VanDerWaalsContact CD1-CB 3.46Å; F643-A721 HydrophobicContact CE1-CB 3.69Å; F719-A721 PolarHBondContact O-N 3.29Å
722	F	89.4	Confident	85.6	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	137.7	-176.8	-58.2	-96.8	0	0	0	109.2	F525 F527 Y572 I573 F588 K598 V599 P720 L724 V730	F525-F722 HydrophobicContact CE2-CE2 4.16Å; F525-F722 HydrophobicContact CZ-CE2 4.12Å; F525-F722 HydrophobicContact CZ-CZ 4.32Å; F527-F722 HydrophobicContact CD1-CD2 4.47Å; F527-F722 AromaticContact CE1-CD2 3.66Å; F527-F722 HydrophobicContact CE1-CD2 3.66Å; F527-F722 AromaticContact CE1-CE2 3.76Å; F527-F722 HydrophobicContact CE1-CE2 3.76Å; F527-F722 HydrophobicContact CE1-CG 4.23Å; F527-F722 HydrophobicContact CE1-CZ 4.4Å; F527-F722 HydrophobicContact CZ-CE2 4.49Å; Y572-F722 CarbonylContact C-O 2.94Å; Y572-F722 VanDerWaalsContact CA-O 3.28Å; Y572-F722 WeakPolarHBondContact CA-O 3.36Å; I573-F722 HydrophobicContact CG2-CB 3.9Å; I573-F722 PolarHBondContact N-O 3.19Å; I573-F722 PolarHBondContact O-N 3.38Å; F588-F722 AromaticContact CD1-CE1 3.89Å; F588-F722 HydrophobicContact CD1-CE1 3.89Å; F588-F722 HydrophobicContact CD1-CZ 4.16Å; F588-F722 HydrophobicContact CD2-CE1 4.11Å; F588-F722 AromaticContact CE1-CE1 3.98Å; F588-F722 HydrophobicContact CE1-CE1 3.98Å; F588-F722 HydrophobicContact CE1-CZ 4.49Å; F588-F722 HydrophobicContact CE2-CE1 4.17Å; F588-F722 AromaticContact CG-CE1 3.98Å; F588-F722 HydrophobicContact CG-CE1 3.98Å; F588-F722 HydrophobicContact CG-CZ 4.43Å; F588-F722 HydrophobicContact CZ-CE1 4.14Å; K598-F722 CarbonylContact O-C 3.48Å; K598-F722 VanDerWaalsContact O-CA 3.26Å; K598-F722 WeakPolarHBondContact O-CA 2.99Å; V599-F722 HydrophobicContact CB-CD1 4.45Å; V599-F722 HydrophobicContact CG1-CD1 4.14Å; V599-F722 HydrophobicContact CG1-CE1 3.82Å; V599-F722 HydrophobicContact CG2-CD1 3.93Å; V599-F722 HydrophobicContact CG2-CE1 4.21Å; P720-F722 HydrophobicContact CB-CE2 4.1Å; F722-L724 HydrophobicContact CB-CD1 4.16Å; F722-V730 HydrophobicContact CD1-CG1 3.96Å; F722-V730 HydrophobicContact CD1-CG2 4.21Å; F722-V730 HydrophobicContact CE1-CG1 3.86Å
723	G	85.6	Confident	85.5	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	115.8	173.7	0	0	0	0	0	109.6	D571 I597 K598	D571-G723 CarbonylContact O-C 3.58Å; D571-G723 WeakPolarHBondContact O-CA 3.3Å; I597-G723 CarbonylContact C-O 3.49Å; I597-G723 WeakPolarHBondContact CA-O 3.38Å; K598-G723 PolarHBondContact N-O 3.07Å; K598-G723 PolarHBondContact O-N 3.16Å
724	L	84.6	Confident	85.2	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	139	-176.6	-64.6	86.7	0	0	0	109.8	L538 V547 D571 I573 F722 G728 V730	L538-L724 HydrophobicContact CD2-CB 4.28Å; L538-L724 HydrophobicContact CD2-CD1 4.38Å; V547-L724 HydrophobicContact CG1-CD1 4.21Å; V547-L724 HydrophobicContact CG1-CD2 4.16Å; D571-L724 PolarHBondContact N-O 3.17Å; D571-L724 PolarHBondContact O-N 2.87Å; I573-L724 HydrophobicContact CG2-CD1 3.86Å; F722-L724 HydrophobicContact CB-CD1 4.16Å; L724-G728 WeakPolarHBondContact CD2-O 3.27Å; L724-V730 HydrophobicContact CD2-CG2 4.25Å; L724-V730 HydrophobicContact CG-CG2 4.49Å
725	M	78	Confident	84.6	Confident	24 Å²	24	29.8 Å²	29.8	12%	0.118	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	132.1	173	-173.2	-178.5	-62.8	0	0	110.5	I568 L570 Y595 M596	I568-M725 HydrophobicContact CB-SD 4.11Å; I568-M725 HydrophobicContact CG2-CE 4.3Å; I568-M725 HydrophobicContact CG2-CG 3.52Å; I568-M725 HydrophobicContact CG2-SD 3.52Å; I568-M725 VanDerWaalsContact CG2-SD 3.52Å; I568-M725 WeakPolarHBondContact O-CE 3.1Å; L570-M725 HydrophobicContact CD2-CB 3.82Å; L570-M725 HydrophobicContact CD2-CE 3.86Å; L570-M725 HydrophobicContact CG-CE 3.69Å; Y595-M725 HydrophobicContact CE1-SD 4.48Å; M596-M725 HydrophobicContact CB-CB 4.36Å; M596-M725 HydrophobicContact CE-CB 3.9Å; M596-M725 HydrophobicContact CE-CE 3.48Å; M596-M725 VanDerWaalsContact CE-CE 3.48Å; M596-M725 HydrophobicContact CE-CG 4.08Å; M596-M725 HydrophobicContact CE-SD 3.17Å; M596-M725 WeakPolarHBondContact CE-SD 3.46Å; M596-M725 PolarHBondContact N-O 3.15Å; M596-M725 PolarHBondContact O-N 3.41Å
726	G	70.9	Confident	84	Confident	32 Å²	32	28 Å²	28	33%	0.33	16%	0.157	S	C	.	.	S	Bend	trans	69.3	-160.4	-173.9	0	0	0	0	0	111.4	S549 G728	S549-G726 WeakPolarHBondContact CB-O 3.44Å; S549-G726 PolarHBondContact OG-O 3.21Å; S549-G726 VanDerWaalsContact OG-O 3.06Å; G726-G728 PolarHBondContact O-N 2.92Å
727	S	76.8	Confident	83	Confident	67 Å²	67	26.4 Å²	26.4	47%	0.469	14%	0.141	S	C	.	.	S	Bend	trans	-70.8	52.7	178.5	57.7	0	0	0	0	113.3	S549	S549-S727 WeakPolarHBondContact O-CA 3.21Å
728	G	83.1	Confident	81.5	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.148	C	C	.	.			trans	-83	142	178.1	0	0	0	0	0	111.7	E548 S549 L724 G726	E548-G728 CarbonylContact C-O 3.58Å; E548-G728 WeakPolarHBondContact CA-O 3.44Å; S549-G728 PolarHBondContact N-O 3.4Å; L724-G728 WeakPolarHBondContact CD2-O 3.27Å; G726-G728 PolarHBondContact O-N 2.92Å
729	K	87.3	Confident	79.8	Confident	50 Å²	50	34.2 Å²	34.2	22%	0.217	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	129.9	175.7	-173.7	172.8	-170	153.5	0	112.3	V547 E548 E591 Y593 S594 I597	V547-K729 WeakPolarHBondContact O-CA 3.49Å; E548-K729 HydrophobicContact CB-CB 4.39Å; E548-K729 HydrophobicContact CB-CD 4.37Å; E548-K729 HydrophobicContact CB-CG 4.15Å; E548-K729 HydrophobicContact CG-CB 4.18Å; E548-K729 HydrophobicContact CG-CD 4.32Å; E548-K729 HydrophobicContact CG-CG 4.34Å; E548-K729 WeakPolarHBondContact OE2-CD 3.33Å; E548-K729 WeakPolarHBondContact OE2-CE 3.38Å; E548-K729 IonicContact OE2-NZ 3.86Å; E548-K729 PolarHBondContact OE2-NZ 2.82Å; E591-K729 HydrophobicContact CB-CB 4.14Å; E591-K729 HydrophobicContact CG-CB 4.08Å; E591-K729 HydrophobicContact CG-CD 3.86Å; E591-K729 HydrophobicContact CG-CG 4.14Å; E591-K729 PolarHBondContact N-O 3.32Å; E591-K729 VanDerWaalsContact N-O 3.16Å; Y593-K729 HydrophobicContact CE2-CB 4.32Å; Y593-K729 WeakPolarHBondContact OH-CD 3.48Å; S594-K729 PolarHBondContact OG-N 2.82Å; S594-K729 PolarHBondContact OG-O 3Å; I597-K729 WeakPolarHBondContact CD1-O 3.43Å
730	V	90.4	Very high	78	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.1	174.7	-173.9	0	0	0	0	109.2	F527 A546 V547 F588 I597 F722 L724	F527-V730 HydrophobicContact CZ-CB 4.23Å; F527-V730 HydrophobicContact CZ-CG1 3.91Å; A546-V730 VanDerWaalsContact CA-O 3.29Å; A546-V730 WeakPolarHBondContact CA-O 3.26Å; V547-V730 HydrophobicContact CG1-CB 3.95Å; V547-V730 HydrophobicContact CG1-CG2 4.48Å; V547-V730 PolarHBondContact N-O 3.45Å; V547-V730 PolarHBondContact O-N 2.91Å; F588-V730 HydrophobicContact CB-CG1 4.18Å; F588-V730 HydrophobicContact CD2-CG1 3.7Å; F588-V730 HydrophobicContact CE2-CG1 4.5Å; F588-V730 HydrophobicContact CG-CG1 4.15Å; I597-V730 HydrophobicContact CD1-CG2 3.54Å; I597-V730 HydrophobicContact CG2-CG2 3.64Å; F722-V730 HydrophobicContact CD1-CG1 3.96Å; F722-V730 HydrophobicContact CD1-CG2 4.21Å; F722-V730 HydrophobicContact CE1-CG1 3.86Å; L724-V730 HydrophobicContact CD2-CG2 4.25Å; L724-V730 HydrophobicContact CG-CG2 4.49Å
731	Q	91.6	Very high	75.9	Confident	76 Å²	76	38.1 Å²	38.1	36%	0.355	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	126.8	174.8	-176.9	171.4	12.8	0	0	110.1	A546 F588 K589	A546-Q731 HydrophobicContact CB-CB 4.33Å; A546-Q731 HydrophobicContact CB-CG 4.29Å; F588-Q731 CarbonylContact C-O 3.5Å; F588-Q731 WeakPolarHBondContact CA-O 3.38Å; F588-Q731 WeakPolarHBondContact CB-O 3.43Å; K589-Q731 PolarHBondContact N-O 3.44Å; K589-Q731 PolarHBondContact O-N 3.44Å
732	L	89.9	Confident	73.6	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.021	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	145.5	171.9	-58	179.6	0	0	0	109.7	F525 F527 D545 F588 T737	F525-L732 HydrophobicContact CD2-CD1 4.16Å; F525-L732 HydrophobicContact CE1-CD2 4.39Å; F525-L732 HydrophobicContact CE2-CD1 3.86Å; F525-L732 HydrophobicContact CE2-CD2 3.93Å; F525-L732 HydrophobicContact CZ-CD1 4.19Å; F525-L732 HydrophobicContact CZ-CD2 3.61Å; F525-L732 WeakPolarHBondContact O-CD1 3.21Å; F527-L732 HydrophobicContact CD2-CD1 4.36Å; F527-L732 HydrophobicContact CD2-CG 4.46Å; F527-L732 HydrophobicContact CE1-CD2 4.44Å; F527-L732 HydrophobicContact CE2-CD1 4.1Å; F527-L732 HydrophobicContact CE2-CD2 4.27Å; F527-L732 HydrophobicContact CE2-CG 3.74Å; F527-L732 HydrophobicContact CZ-CD1 4.33Å; F527-L732 HydrophobicContact CZ-CD2 3.84Å; F527-L732 HydrophobicContact CZ-CG 3.84Å; D545-L732 PolarHBondContact O-N 3.37Å; F588-L732 HydrophobicContact CB-CD2 4.11Å; L732-T737 HydrophobicContact CB-CG2 4.12Å; L732-T737 HydrophobicContact CD1-CG2 4.36Å
733	E	83.6	Confident	70.9	Confident	31 Å²	31	55.8 Å²	55.8	15%	0.145	29%	0.287	C	S	.	.			trans	-73.8	148.1	176.6	-66.4	-84.2	122.9	0	0	111.6	A587 R684 F735 I736	A587-E733 HydrophobicContact CB-CG 4.37Å; A587-E733 PolarHBondContact O-N 3.16Å; R684-E733 VanDerWaalsContact CD-CD 3.42Å; R684-E733 WeakPolarHBondContact CD-OE1 3.5Å; R684-E733 WeakPolarHBondContact CD-OE2 3.26Å; R684-E733 IonicContact CZ-OE2 2.66Å; R684-E733 IonicContact NH1-OE2 3.97Å; R684-E733 PolarHBondContact NH1-OE2 2.97Å; E733-F735 VanDerWaalsContact C-N 3.3Å; E733-F735 HydrophobicContact CB-CD1 3.74Å; E733-F735 HydrophobicContact CB-CE1 3.11Å; E733-F735 HydrophobicContact CB-CZ 3.59Å; E733-F735 HydrophobicContact CG-CE1 3.72Å; E733-F735 HydrophobicContact CG-CZ 4.06Å; E733-F735 PolarHBondContact O-N 3.38Å; E733-F735 VanDerWaalsContact O-N 3.16Å; E733-I736 HydrophobicContact CB-CG1 4.19Å; E733-I736 WeakPolarHBondContact O-CB 3.31Å; E733-I736 WeakPolarHBondContact O-CG1 3.27Å; E733-I736 PolarHBondContact O-N 3.23Å
734	E	76.1	Confident	70.2	Confident	140 Å²	140	58.6 Å²	58.6	65%	0.654	30%	0.301	S	S	*	.	H	α-helix	trans	-54.7	-41.4	-171	-173.6	173.5	-164.1	0	0	113.6	I736 T737 A738	E734-I736 PolarHBondContact O-N 3.25Å; E734-T737 CarbonylContact O-C 3.47Å; E734-T737 WeakPolarHBondContact O-CA 3.33Å; E734-T737 PolarHBondContact O-N 3.28Å; E734-T737 PolarHBondContact O-OG1 2.87Å; E734-A738 PolarHBondContact O-N 3.4Å
735	F	69.2	Low	69.4	Low	47 Å²	47	61.6 Å²	61.6	21%	0.206	32%	0.317	C	S	.	.	H	α-helix	trans	-68	-19.1	-179.9	63.3	-88.5	0	0	0	114	Y428 V522 N524 A587 E733 T737	Y428-F735 AromaticContact CD1-CD2 3.97Å; Y428-F735 HydrophobicContact CD1-CD2 3.97Å; Y428-F735 HydrophobicContact CD1-CE1 4.31Å; Y428-F735 AromaticContact CD1-CE2 3.37Å; Y428-F735 HydrophobicContact CD1-CE2 3.37Å; Y428-F735 AromaticContact CD1-CZ 3.61Å; Y428-F735 HydrophobicContact CD1-CZ 3.61Å; Y428-F735 HydrophobicContact CD2-CB 4.42Å; Y428-F735 AromaticContact CD2-CD1 3.62Å; Y428-F735 HydrophobicContact CD2-CD1 3.62Å; Y428-F735 AromaticContact CD2-CD2 3.66Å; Y428-F735 HydrophobicContact CD2-CD2 3.66Å; Y428-F735 AromaticContact CD2-CE1 3.72Å; Y428-F735 HydrophobicContact CD2-CE1 3.72Å; Y428-F735 AromaticContact CD2-CE2 3.77Å; Y428-F735 HydrophobicContact CD2-CE2 3.77Å; Y428-F735 AromaticContact CD2-CG 3.61Å; Y428-F735 HydrophobicContact CD2-CG 3.61Å; Y428-F735 AromaticContact CD2-CZ 3.83Å; Y428-F735 HydrophobicContact CD2-CZ 3.83Å; Y428-F735 HydrophobicContact CE1-CD2 4.33Å; Y428-F735 AromaticContact CE1-CE1 3.76Å; Y428-F735 HydrophobicContact CE1-CE1 3.76Å; Y428-F735 AromaticContact CE1-CE2 3.46Å; Y428-F735 HydrophobicContact CE1-CE2 3.46Å; Y428-F735 VanDerWaalsContact CE1-CE2 3.46Å; Y428-F735 AromaticContact CE1-CZ 3.13Å; Y428-F735 HydrophobicContact CE1-CZ 3.13Å; Y428-F735 AromaticContact CE2-CD1 3.28Å; Y428-F735 HydrophobicContact CE2-CD1 3.28Å; Y428-F735 HydrophobicContact CE2-CD2 4.01Å; Y428-F735 AromaticContact CE2-CE1 3.02Å; Y428-F735 HydrophobicContact CE2-CE1 3.02Å; Y428-F735 AromaticContact CE2-CE2 3.82Å; Y428-F735 HydrophobicContact CE2-CE2 3.82Å; Y428-F735 AromaticContact CE2-CG 3.79Å; Y428-F735 HydrophobicContact CE2-CG 3.79Å; Y428-F735 AromaticContact CE2-CZ 3.36Å; Y428-F735 HydrophobicContact CE2-CZ 3.36Å; Y428-F735 HydrophobicContact CG-CD1 4.4Å; Y428-F735 AromaticContact CG-CD2 3.65Å; Y428-F735 HydrophobicContact CG-CD2 3.65Å; Y428-F735 HydrophobicContact CG-CE1 4.32Å; Y428-F735 AromaticContact CG-CE2 3.57Å; Y428-F735 HydrophobicContact CG-CE2 3.57Å; Y428-F735 HydrophobicContact CG-CG 4.11Å; Y428-F735 AromaticContact CG-CZ 3.96Å; Y428-F735 HydrophobicContact CG-CZ 3.96Å; Y428-F735 AromaticContact CZ-CD1 3.85Å; Y428-F735 AromaticContact CZ-CE1 3.06Å; Y428-F735 AromaticContact CZ-CE2 3.69Å; Y428-F735 AromaticContact CZ-CZ 3Å; Y428-F735 VanDerWaalsContact OH-CE1 3.23Å; Y428-F735 WeakPolarHBondContact OH-CE1 3.37Å; Y428-F735 WeakPolarHBondContact OH-CZ 3.35Å; V522-F735 HydrophobicContact CG1-CD2 3.94Å; V522-F735 HydrophobicContact CG1-CE2 4.1Å; V522-F735 HydrophobicContact CG2-CD2 4.12Å; V522-F735 HydrophobicContact CG2-CE2 4.05Å; N524-F735 PolarHBondContact OD1-O 3.31Å; A587-F735 HydrophobicContact CB-CZ 4.19Å; E733-F735 VanDerWaalsContact C-N 3.3Å; E733-F735 HydrophobicContact CB-CD1 3.74Å; E733-F735 HydrophobicContact CB-CE1 3.11Å; E733-F735 HydrophobicContact CB-CZ 3.59Å; E733-F735 HydrophobicContact CG-CE1 3.72Å; E733-F735 HydrophobicContact CG-CZ 4.06Å; E733-F735 PolarHBondContact O-N 3.38Å; E733-F735 VanDerWaalsContact O-N 3.16Å; F735-T737 VanDerWaalsContact C-N 3.26Å
736	I	67.9	Low	68.9	Low	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-71.1	-26.4	169.7	-54.5	-57.9	0	0	0	110.9	V522 N524 F525 W586 E733 E734	V522-I736 HydrophobicContact CG1-CD1 3.32Å; N524-I736 WeakPolarHBondContact CA-O 3.3Å; N524-I736 WeakPolarHBondContact CB-O 3.39Å; N524-I736 VanDerWaalsContact OD1-C 3.32Å; N524-I736 PolarHBondContact OD1-O 3.16Å; F525-I736 HydrophobicContact CD1-CG2 4.13Å; F525-I736 HydrophobicContact CE1-CG2 4.19Å; W586-I736 HydrophobicContact CB-CD1 3.96Å; E733-I736 HydrophobicContact CB-CG1 4.19Å; E733-I736 WeakPolarHBondContact O-CB 3.31Å; E733-I736 WeakPolarHBondContact O-CG1 3.27Å; E733-I736 PolarHBondContact O-N 3.23Å; E734-I736 PolarHBondContact O-N 3.25Å
737	T	63.9	Low	68.8	Low	1 Å²	1	65.6 Å²	65.6	1%	0.006	33%	0.328	C	S	.	.	H	α-helix	trans	-106.8	-16.2	-172	64.2	0	0	0	0	112.9	L526 D545 L732 E734 F735 K739 K740 L741	L526-T737 HydrophobicContact CD2-CG2 3.64Å; D545-T737 HydrophobicContact CB-CG2 3.77Å; L732-T737 HydrophobicContact CB-CG2 4.12Å; L732-T737 HydrophobicContact CD1-CG2 4.36Å; E734-T737 CarbonylContact O-C 3.47Å; E734-T737 WeakPolarHBondContact O-CA 3.33Å; E734-T737 PolarHBondContact O-N 3.28Å; E734-T737 PolarHBondContact O-OG1 2.87Å; F735-T737 VanDerWaalsContact C-N 3.26Å; T737-K739 VanDerWaalsContact C-N 3.35Å; T737-K739 PolarHBondContact O-N 2.91Å; T737-K740 PolarHBondContact O-N 3.31Å; T737-L741 WeakPolarHBondContact O-CG 3.43Å; T737-L741 PolarHBondContact O-N 3.19Å; T737-L741 WeakPolarHBondContact OG1-CD1 3.44Å
738	A	58.8	Low	68.3	Low	51 Å²	51	65.5 Å²	65.5	42%	0.421	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-38.4	-169.4	0	0	0	0	0	115	E734 K740	E734-A738 PolarHBondContact O-N 3.4Å; A738-K740 VanDerWaalsContact C-N 3.35Å; A738-K740 PolarHBondContact O-N 3.49Å
739	K	56.1	Low	67.3	Low	160 Å²	160	69.9 Å²	69.9	70%	0.696	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-17.3	177.9	-76.2	-171.2	177.8	-178.5	0	114.6	T737 T742	T737-K739 VanDerWaalsContact C-N 3.35Å; T737-K739 PolarHBondContact O-N 2.91Å; K739-T742 PolarHBondContact O-OG1 3.27Å
740	K	52.3	Low	65.9	Low	65 Å²	65	71.3 Å²	71.3	28%	0.283	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-17.2	179.9	-80.5	-169.1	173.8	-174	0	113.5	L526 D576 T577 T737 A738	L526-K740 HydrophobicContact CD1-CB 4.37Å; L526-K740 HydrophobicContact CD1-CD 4.18Å; L526-K740 HydrophobicContact CG-CD 4.1Å; D576-K740 IonicContact OD1-NZ 2.99Å; D576-K740 PolarHBondContact OD1-NZ 3.15Å; D576-K740 IonicContact OD2-NZ 2.69Å; D576-K740 PolarHBondContact OD2-NZ 3.02Å; T577-K740 PolarHBondContact OG1-NZ 2.74Å; T737-K740 PolarHBondContact O-N 3.31Å; A738-K740 VanDerWaalsContact C-N 3.35Å; A738-K740 PolarHBondContact O-N 3.49Å
741	L	49	Very low	64	Low	53 Å²	53	76.8 Å²	76.8	28%	0.277	38%	0.376	S	S	.	.	S	Bend	trans	-87.4	-3.2	-177.8	-70.4	161.6	0	0	0	113.8	R543 T737 F743	R543-L741 HydrophobicContact CB-CD2 4.23Å; R543-L741 HydrophobicContact CG-CD2 4.38Å; R543-L741 VanDerWaalsContact CZ-CD1 3.45Å; R543-L741 VanDerWaalsContact NH2-CD1 3.26Å; T737-L741 WeakPolarHBondContact O-CG 3.43Å; T737-L741 PolarHBondContact O-N 3.19Å; T737-L741 WeakPolarHBondContact OG1-CD1 3.44Å; L741-F743 PolarHBondContact O-N 3.48Å
742	T	40.5	Very low	61.7	Low	113 Å²	113	76.8 Å²	76.8	69%	0.693	38%	0.377	S	S	*	.			trans	-83.9	46.6	174.8	41.9	0	0	0	0	113.1	K739	K739-T742 PolarHBondContact O-OG1 3.27Å
743	F	33	Very low	59.1	Low	257 Å²	257	83.5 Å²	83.5	100%	1.127	41%	0.41	S	S	*	.			trans	-116.2	0	171.5	-84	-77.1	0	0	0	111.6	L741	L741-F743 PolarHBondContact O-N 3.48Å

Retrieved 743 of 743 residues in 199.2 ms (Link to these results)

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