A0A096NXS5_PAPAN Loading...

Ephrin type-A receptor 1

Receptor tyrosine kinase which binds promiscuously membrane-bound ephrin-A family ligands residing on adjacent cells, leading to contact-dependent bidirectional signaling into neighboring cells. The signaling pathway downstream of the receptor is referred to as forward signaling while the signaling pathway downstream of the ephrin ligand is referred to as reverse signaling. Binds with a low affinity EFNA3 and EFNA4 and with a high affinity to EFNA1 which most probably constitutes its cognate/functional ligand. Upon activation by EFNA1 induces cell attachment to the extracellular matrix inhibiting cell spreading and motility through regulation of ILK and downstream RHOA and RAC. Also plays a role in angiogenesis and regulates cell proliferation. May play a role in apoptosis.

AlphaFold DB , UniProt , Accession A0A096NXS5, Species PAPAN (Papio anubis, Olive baboon), Gene EPHA1, Length 976 aa.

						>A0A096NXS5_PAPAN|A0A096NXS5|EPHA1
MERRWPLGLGLVLLLCTPLPPGARTKEVTLMDTSKAQGELGWLLDPPKDGWSERQQILNGTPLYMYQDCPVQGRRDTDHWLRSNWIYRGEEASRVHVELQFTLRDCKSFPGGAGPLGCKETFNLLYMESDQDVGIQLRRPLFQKVTTVAADQSFTIRDLASGSMKLNVERCSLGHLTRRGLYLAFHNPGACVALVSVRVFYQRCPETLNGLAQFPDTLPGPAGLVEVAGTCLPHAQASPRPSGAPRMHCSPDGEWLVPVGRCHCEPGYEEGGSGKGCVACPSGSYRMDMDTPHCLTCPQHSTAESEGATICTCESGHYRAPGEGPQVACTRPPSAPQNLSSSASGTQLSLRWEPPADMGGRQDVRYSVRCSQCQGTVQDGGPCQPCGVGVHFSPGARGLTTSAVHVSGLEPYANYTFNVEAQNGVSGLGSSGHASTSVSISMGHAEPLSGLSLRLVKKEPRQLELTWAGSRPRSPGGNLSYELHVLNQDEERYQMVLEPRVLLTELQPDTTYIVRVRMLTPLGPGPFSPDHEFRTSPPVSRGLSGGEIVAVIFGLLLGAALLLGILVFRSRRTQRQRQQRQRDRATDVDREDKLWLKPYVDLQAYEDPAQGALDFTRELDPAWLMVDTVIGEGEFGEVYRGTLRLPSQDCKTVAIKTLKDTSPGGQWWNFLREATIMGQFSHPHILHLEGVVTKRKPIMIITEFMENGALDAFLREREDQLVPGQLVAMLQGIASGMNYLSNHNYVHRDLAARNILVNQDLCCKVSDFGLTRLLDDFDGTYETQGGKIPIRWTAPEAIAHRIFTTASDVWSFGIVMWEVLSFGDKPYGEMSNQEVMKSIEDGYRLPPPVDCPAPLYELMKNCWAYDRARRPHFQKLQAHLEQVLANPHSLRTIANFDPRVTLRLPSLSGSDGIPYRSVSEWLESIRMKRYILHFHSAGLDTMECVLELTAEDLTQMGITLPGHQKRILCSIQGFKD
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.7	Very low	34.5	Very low	244 Å²	244	177.8 Å²	177.8	100%	1.202	90%	0.896	S	S	*	*				0	87.9	0	-85.8	-177.3	175.5	0	0	107.9
2	E	32.8	Very low	34.6	Very low	196 Å²	196	174.8 Å²	174.8	92%	0.916	89%	0.893	S	S	*	*			trans	-71.8	133.6	173.3	-64	171.2	146.9	0	0	108.7
3	R	31.7	Very low	34.7	Very low	239 Å²	239	174.8 Å²	174.8	90%	0.902	90%	0.895	S	S	*	*			trans	-118.6	112.6	174	-87.1	-170.8	177.5	-162.3	0.6	111.1
4	R	36	Very low	34.6	Very low	236 Å²	236	174.5 Å²	174.5	89%	0.891	90%	0.895	S	S	*	*			trans	-53.1	148.2	164.9	-64.6	169.4	170.6	-178.9	-4.7	112.8
5	W	28.1	Very low	34.6	Very low	245 Å²	245	174.1 Å²	174.1	93%	0.928	89%	0.894	S	S	*	*			trans	-134.9	155.9	144.5	-85.8	81.4	0	0	0	109.3
6	P	37.1	Very low	34.5	Very low	110 Å²	110	171 Å²	171	71%	0.714	89%	0.891	S	S	*	*			trans	-104.7	171.1	-136.8	39	-35.1	0	0	0	116.3
7	L	40.3	Very low	34.1	Very low	185 Å²	185	168.3 Å²	168.3	97%	0.969	88%	0.883	S	S	*	*			trans	-47.7	130	179.9	-71.1	136.8	0	0	0	116.2
8	G	36.8	Very low	33.9	Very low	67 Å²	67	165.8 Å²	165.8	69%	0.691	88%	0.879	S	S	*	*			trans	174.7	116.6	158.4	0	0	0	0	0	110.4
9	L	33.3	Very low	33.9	Very low	191 Å²	191	164.2 Å²	164.2	100%	1	87%	0.87	S	S	*	*			trans	81.6	64	-175.9	-66	125.8	0	0	0	116.7
10	G	33.7	Very low	34	Very low	74 Å²	74	161 Å²	161	76%	0.763	86%	0.859	S	S	*	*			trans	-133.2	56.6	165.7	0	0	0	0	0	111.5
11	L	36.6	Very low	34.2	Very low	169 Å²	169	159.2 Å²	159.2	89%	0.885	86%	0.856	S	S	*	*	S	Bend	trans	-154.6	54.6	173.3	-146.3	94	0	0	0	113.6
12	V	36.3	Very low	34.7	Very low	141 Å²	141	150.1 Å²	150.1	86%	0.855	83%	0.825	S	S	*	*	S	Bend	trans	-142	-12.3	161.1	-178.7	0	0	0	0	113.9
13	L	36.1	Very low	35.6	Very low	175 Å²	175	142.7 Å²	142.7	92%	0.916	80%	0.797	S	S	*	*	S	Bend	trans	-104.6	36.1	-169.5	-94.2	157.2	0	0	0	116
14	L	33.6	Very low	36.8	Very low	171 Å²	171	142 Å²	142	90%	0.895	80%	0.795	S	S	*	*	S	Bend	trans	-128.5	23.8	180	-98.9	157.8	0	0	0	115.3
15	L	34.5	Very low	38.6	Very low	169 Å²	169	132.8 Å²	132.8	89%	0.885	77%	0.765	S	S	*	*			trans	-132.4	53.7	169.1	-81.6	163.8	0	0	0	111.6
16	C	32.5	Very low	41.1	Very low	124 Å²	124	125.7 Å²	125.7	84%	0.838	74%	0.74	S	S	*	*			trans	-135.1	78.5	156.9	-74	0	0	0	0	107.9
17	T	28	Very low	43.5	Very low	125 Å²	125	123.5 Å²	123.5	77%	0.767	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-54.9	132.1	152.9	45.6	0	0	0	0	107.2	L19	T17-L19 PolarHBondContact O-N 3.39Å; T17-L19 VanDerWaalsContact O-N 3.09Å
18	P	30.1	Very low	45.7	Very low	124 Å²	124	116.6 Å²	116.6	81%	0.805	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-59.5	122.3	175.2	26	-30.5	0	0	0	107.1
19	L	34.6	Very low	48.1	Very low	134 Å²	134	116 Å²	116	70%	0.702	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-52.9	145.6	165.3	-89	120.1	0	0	0	107.9	T17	T17-L19 PolarHBondContact O-N 3.39Å; T17-L19 VanDerWaalsContact O-N 3.09Å
20	P	35.4	Very low	50.6	Low	101 Å²	101	109.1 Å²	109.1	66%	0.656	63%	0.633	S	S	*	*	S	Bend	trans	-51.7	149.5	165.2	3.1	3.9	0	0	0	108	G22	P20-G22 PolarHBondContact O-N 3.22Å
21	P	38	Very low	53.1	Low	123 Å²	123	107 Å²	107	80%	0.799	60%	0.604	S	S	*	*			trans	-49.5	110.3	-174.7	20.7	-31.4	0	0	0	108.4	A23	P21-A23 PolarHBondContact O-N 3.31Å
22	G	44.2	Very low	55.4	Low	54 Å²	54	100.1 Å²	100.1	56%	0.557	57%	0.568	S	S	*	*			trans	-50.5	141.6	177.1	0	0	0	0	0	107.8	P20 R24	P20-G22 PolarHBondContact O-N 3.22Å; G22-R24 PolarHBondContact O-N 3.11Å
23	A	50.8	Low	57.6	Low	40 Å²	40	93.7 Å²	93.7	33%	0.331	53%	0.529	S	S	.	.			trans	-44.5	113.1	177	0	0	0	0	0	108.2	P21 T25 P205	P21-A23 PolarHBondContact O-N 3.31Å; A23-T25 PolarHBondContact O-N 2.94Å; A23-P205 HydrophobicContact CB-CG 3.83Å
24	R	57.5	Low	59.5	Low	225 Å²	225	88.2 Å²	88.2	85%	0.849	51%	0.505	S	S	*	.			trans	-54.6	139.3	-172.1	-76.4	-177.9	175.4	-179.2	-1.7	108.9	G22 K26	G22-R24 PolarHBondContact O-N 3.11Å; R24-K26 PolarHBondContact O-N 3.19Å
25	T	72.6	Confident	61.3	Low	42 Å²	42	87 Å²	87	26%	0.258	49%	0.493	S	S	.	.			trans	-43.6	131.5	174.1	53.7	0	0	0	0	110.3	A23 D252 E254	A23-T25 PolarHBondContact O-N 2.94Å; T25-D252 WeakPolarHBondContact CG2-O 3.32Å; T25-E254 HydrophobicContact CG2-CB 4.42Å; T25-E254 HydrophobicContact CG2-CG 3.29Å
26	K	81.8	Confident	62.5	Low	95 Å²	95	80.4 Å²	80.4	41%	0.413	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	107.8	178.7	-175.7	177.3	172.5	-170.2	0	108.5	R24 R203 P205 D216	R24-K26 PolarHBondContact O-N 3.19Å; K26-R203 PolarHBondContact N-O 2.65Å; K26-R203 VanDerWaalsContact N-O 3.14Å; K26-R203 PolarHBondContact O-N 2.85Å; K26-P205 HydrophobicContact CB-CB 4.02Å; K26-P205 HydrophobicContact CD-CB 4.27Å; K26-D216 IonicContact NZ-OD2 3.16Å; K26-D216 PolarHBondContact NZ-OD2 2.99Å
27	E	87.9	Confident	63.1	Low	64 Å²	64	81.3 Å²	81.3	30%	0.299	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	116.5	175.9	-64.5	-179.6	170.4	0	0	110.3	R198 F200 Q202	E27-R198 IonicContact OE2-CZ 2.78Å; E27-R198 IonicContact OE2-NH1 3.74Å; E27-R198 PolarHBondContact OE2-NH1 2.98Å; E27-R198 IonicContact OE2-NH2 3.8Å; E27-R198 PolarHBondContact OE2-NH2 3.31Å; E27-F200 HydrophobicContact CB-CD2 3.81Å; E27-F200 HydrophobicContact CB-CE2 4.31Å; E27-F200 HydrophobicContact CB-CG 4.46Å; E27-F200 VanDerWaalsContact CD-CE2 3.48Å; E27-F200 HydrophobicContact CG-CD2 3.72Å; E27-F200 HydrophobicContact CG-CE2 3.71Å; E27-F200 WeakPolarHBondContact OE1-CE2 3.46Å; E27-Q202 HydrophobicContact CG-CG 4.18Å
28	V	86.1	Confident	64.1	Low	41 Å²	41	76.2 Å²	76.2	25%	0.248	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	113.7	174	-176.4	0	0	0	0	108.5	F200 Y201 R203	V28-F200 CarbonylContact O-C 3.58Å; V28-F200 WeakPolarHBondContact O-CA 3.42Å; V28-F200 VanDerWaalsContact O-CB 3.26Å; V28-F200 WeakPolarHBondContact O-CB 3.42Å; V28-Y201 HydrophobicContact CB-CD1 3.95Å; V28-Y201 HydrophobicContact CB-CD2 4.42Å; V28-Y201 HydrophobicContact CB-CE1 3.47Å; V28-Y201 VanDerWaalsContact CB-CE1 3.47Å; V28-Y201 HydrophobicContact CB-CE2 3.99Å; V28-Y201 HydrophobicContact CB-CG 4.41Å; V28-Y201 VanDerWaalsContact CB-CZ 3.48Å; V28-Y201 HydrophobicContact CG1-CD1 4.28Å; V28-Y201 HydrophobicContact CG1-CE1 3.43Å; V28-Y201 VanDerWaalsContact CG1-CE1 3.43Å; V28-Y201 HydrophobicContact CG2-CE1 4.36Å; V28-Y201 HydrophobicContact CG2-CE2 4.09Å; V28-Y201 PolarHBondContact N-O 2.76Å; V28-Y201 PolarHBondContact O-N 3.31Å; V28-R203 HydrophobicContact CG2-CG 4.3Å
29	T	87	Confident	65	Low	55 Å²	55	78.1 Å²	78.1	34%	0.337	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	124.7	-174.3	-58.3	0	0	0	0	110.4	M31 D32 R198	T29-M31 WeakPolarHBondContact CG2-O 3.23Å; T29-D32 HydrophobicContact CG2-CB 3.71Å; T29-R198 HydrophobicContact CG2-CG 4.29Å; T29-R198 PolarHBondContact OG1-NE 3.19Å; T29-R198 PolarHBondContact OG1-NH2 3.29Å
30	L	84.8	Confident	66.1	Low	45 Å²	45	72.7 Å²	72.7	24%	0.236	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-35.6	174.3	-58.9	-179.8	0	0	0	111.5	I86 V95 V199 Y201	L30-I86 HydrophobicContact CB-CG2 3.77Å; L30-I86 HydrophobicContact CD1-CG2 4.35Å; L30-V95 HydrophobicContact CD1-CG1 4.04Å; L30-V95 HydrophobicContact CD1-CG2 3.79Å; L30-V199 WeakPolarHBondContact CA-O 3.42Å; L30-V199 HydrophobicContact CB-CB 4.41Å; L30-V199 HydrophobicContact CB-CG1 4.2Å; L30-V199 HydrophobicContact CD1-CG1 4.21Å; L30-V199 PolarHBondContact N-O 2.85Å; L30-Y201 HydrophobicContact CD1-CD1 4.27Å; L30-Y201 HydrophobicContact CD2-CD1 3.74Å; L30-Y201 HydrophobicContact CD2-CE1 3.76Å; L30-Y201 HydrophobicContact CG-CD1 4.01Å; L30-Y201 HydrophobicContact CG-CE1 4.5Å
31	M	86.8	Confident	67.6	Low	31 Å²	31	70.4 Å²	70.4	15%	0.153	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	141.7	176.9	-174.2	-178.3	72.5	0	0	109.5	T29 T33 W42 I86 L183 V197 R198 V199	T29-M31 WeakPolarHBondContact CG2-O 3.23Å; M31-T33 HydrophobicContact CE-CG2 4.46Å; M31-W42 HydrophobicContact CE-CH2 3.89Å; M31-W42 HydrophobicContact CE-CZ2 3.44Å; M31-W42 VanDerWaalsContact CE-CZ2 3.44Å; M31-W42 HydrophobicContact SD-CZ2 3.71Å; M31-I86 HydrophobicContact CB-CG1 4.42Å; M31-I86 HydrophobicContact CE-CD1 3.92Å; M31-I86 HydrophobicContact SD-CD1 3.95Å; M31-I86 HydrophobicContact SD-CG1 3.99Å; M31-L183 HydrophobicContact CE-CD1 4.39Å; M31-V197 HydrophobicContact CE-CB 4.29Å; M31-V197 HydrophobicContact CE-CG1 3.72Å; M31-R198 CarbonylContact O-C 3.55Å; M31-R198 WeakPolarHBondContact O-CA 3.44Å; M31-V199 HydrophobicContact CB-CB 4.08Å; M31-V199 HydrophobicContact CB-CG2 4.24Å; M31-V199 HydrophobicContact CE-CG2 3.67Å; M31-V199 PolarHBondContact N-O 3.07Å; M31-V199 VanDerWaalsContact N-O 3.09Å; M31-V199 PolarHBondContact O-N 3.37Å
32	D	84.7	Confident	69.7	Low	24 Å²	24	65.3 Å²	65.3	13%	0.128	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	106.6	173.8	-177.1	-8.1	0	0	0	109.4	T29 S34 K35 V197 R198	T29-D32 HydrophobicContact CG2-CB 3.71Å; D32-S34 VanDerWaalsContact C-N 3.28Å; D32-S34 PolarHBondContact O-N 3.45Å; D32-S34 WeakPolarHBondContact OD1-CB 3.35Å; D32-S34 PolarHBondContact OD1-N 3.28Å; D32-S34 PolarHBondContact OD1-OG 3.48Å; D32-K35 HydrophobicContact CB-CD 4.49Å; D32-K35 PolarHBondContact O-N 3.13Å; D32-K35 WeakPolarHBondContact OD2-CD 3.4Å; D32-K35 WeakPolarHBondContact OD2-CE 3.37Å; D32-K35 IonicContact OD2-NZ 3.18Å; D32-V197 WeakPolarHBondContact CA-O 3.23Å; D32-R198 HydrophobicContact CB-CG 4.17Å
33	T	82.2	Confident	71.3	Confident	6 Å²	6	64.6 Å²	64.6	4%	0.037	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-73.2	-20.7	-176.7	67.2	0	0	0	0	112.6	M31 K35 A36 L40 W42 S196 V197	M31-T33 HydrophobicContact CE-CG2 4.46Å; T33-K35 PolarHBondContact O-N 3.43Å; T33-A36 VanDerWaalsContact O-CB 3.25Å; T33-A36 WeakPolarHBondContact O-CB 3.45Å; T33-A36 PolarHBondContact O-N 3.34Å; T33-L40 HydrophobicContact CG2-CD1 4.12Å; T33-L40 HydrophobicContact CG2-CD2 3.68Å; T33-W42 HydrophobicContact CG2-CH2 3.87Å; T33-W42 HydrophobicContact CG2-CZ2 3.46Å; T33-W42 VanDerWaalsContact CG2-CZ2 3.46Å; T33-S196 WeakPolarHBondContact OG1-CA 3.32Å; T33-V197 HydrophobicContact CG2-CB 4.07Å; T33-V197 PolarHBondContact N-O 2.96Å; T33-V197 PolarHBondContact OG1-N 3.24Å
34	S	77.1	Confident	72.9	Confident	59 Å²	59	64.6 Å²	64.6	41%	0.413	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-69.2	-22.6	177.3	69.7	0	0	0	0	113.2	D32 S196	D32-S34 VanDerWaalsContact C-N 3.28Å; D32-S34 PolarHBondContact O-N 3.45Å; D32-S34 WeakPolarHBondContact OD1-CB 3.35Å; D32-S34 PolarHBondContact OD1-N 3.28Å; D32-S34 PolarHBondContact OD1-OG 3.48Å; S34-S196 WeakPolarHBondContact CB-OG 3.37Å
35	K	71.8	Confident	74.1	Confident	146 Å²	146	56 Å²	56	64%	0.635	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-96.4	1	176.4	-63	179.3	-174.3	169.8	0	112.6	D32 T33 Q37	D32-K35 HydrophobicContact CB-CD 4.49Å; D32-K35 PolarHBondContact O-N 3.13Å; D32-K35 WeakPolarHBondContact OD2-CD 3.4Å; D32-K35 WeakPolarHBondContact OD2-CE 3.37Å; D32-K35 IonicContact OD2-NZ 3.18Å; T33-K35 PolarHBondContact O-N 3.43Å; K35-Q37 PolarHBondContact O-N 2.81Å
36	A	57.8	Low	74.4	Confident	30 Å²	30	56.2 Å²	56.2	25%	0.248	31%	0.307	C	S	.	.			trans	-66.4	123.4	175.6	0	0	0	0	0	109.1	T33 G38 L40	T33-A36 VanDerWaalsContact O-CB 3.25Å; T33-A36 WeakPolarHBondContact O-CB 3.45Å; T33-A36 PolarHBondContact O-N 3.34Å; A36-G38 VanDerWaalsContact C-N 3.31Å; A36-L40 HydrophobicContact CB-CD2 3.43Å; A36-L40 VanDerWaalsContact CB-CD2 3.43Å; A36-L40 HydrophobicContact CB-CG 4.44Å
37	Q	45.5	Very low	74	Confident	143 Å²	143	56.5 Å²	56.5	67%	0.668	32%	0.318	S	S	*	.	S	Bend	trans	-89.9	4.2	-178.1	-65.4	-174.9	-15.3	0	0	112.9	K35 Q833	K35-Q37 PolarHBondContact O-N 2.81Å; Q37-Q833 VanDerWaalsContact O-CD 3.3Å; Q37-Q833 PolarHBondContact O-NE2 3.08Å; Q37-Q833 PolarHBondContact O-OE1 3.19Å
38	G	48.9	Very low	73.2	Confident	19 Å²	19	63.5 Å²	63.5	20%	0.196	35%	0.348	C	S	.	.	S	Bend	trans	-157.7	-169	-176.8	0	0	0	0	0	112.8	A36 Y64	A36-G38 VanDerWaalsContact C-N 3.31Å; G38-Y64 WeakPolarHBondContact O-CD2 3.46Å
39	E	49.7	Very low	72.7	Confident	164 Å²	164	67 Å²	67	77%	0.766	37%	0.365	S	S	*	.			trans	-57.7	135.9	179.7	-68	179.8	-179	0	0	111.8	G41 E53	E39-G41 VanDerWaalsContact C-N 3.34Å; E39-E53 VanDerWaalsContact CA-OE1 3.3Å; E39-E53 WeakPolarHBondContact CA-OE1 3.37Å
40	L	57.9	Low	72.6	Confident	20 Å²	20	65.2 Å²	65.2	11%	0.105	36%	0.357	C	S	.	.			trans	-76.4	-24.2	-175.8	-69.9	168.9	0	0	0	112.5	T33 A36 W42 E53 Y66 N84	T33-L40 HydrophobicContact CG2-CD1 4.12Å; T33-L40 HydrophobicContact CG2-CD2 3.68Å; A36-L40 HydrophobicContact CB-CD2 3.43Å; A36-L40 VanDerWaalsContact CB-CD2 3.43Å; A36-L40 HydrophobicContact CB-CG 4.44Å; L40-W42 VanDerWaalsContact C-N 3.29Å; L40-W42 PolarHBondContact O-N 2.97Å; L40-E53 PolarHBondContact N-OE1 2.84Å; L40-Y66 HydrophobicContact CB-CE2 3.69Å; L40-Y66 WeakPolarHBondContact CB-OH 3.33Å; L40-Y66 HydrophobicContact CD1-CD2 4.01Å; L40-Y66 HydrophobicContact CD1-CE2 3.54Å; L40-Y66 HydrophobicContact CG-CE2 4.26Å; L40-N84 PolarHBondContact O-ND2 2.91Å
41	G	65.8	Low	72.8	Confident	52 Å²	52	63.4 Å²	63.4	54%	0.536	35%	0.347	S	S	.	.			trans	65.7	24.5	171.8	0	0	0	0	0	115.1	E39 Y66 N84	E39-G41 VanDerWaalsContact C-N 3.34Å; G41-Y66 PolarHBondContact N-OH 2.65Å; G41-N84 PolarHBondContact O-OD1 3.01Å
42	W	82.4	Confident	72.7	Confident	16 Å²	16	63.4 Å²	63.4	6%	0.061	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-73.5	150.6	179.8	-69.5	6.3	0	0	0	112.2	M31 T33 L40 L44 Y66 L81 R82 F185 L194 V197	M31-W42 HydrophobicContact CE-CH2 3.89Å; M31-W42 HydrophobicContact CE-CZ2 3.44Å; M31-W42 VanDerWaalsContact CE-CZ2 3.44Å; M31-W42 HydrophobicContact SD-CZ2 3.71Å; T33-W42 HydrophobicContact CG2-CH2 3.87Å; T33-W42 HydrophobicContact CG2-CZ2 3.46Å; T33-W42 VanDerWaalsContact CG2-CZ2 3.46Å; L40-W42 VanDerWaalsContact C-N 3.29Å; L40-W42 PolarHBondContact O-N 2.97Å; W42-L44 PolarHBondContact O-N 3.32Å; W42-Y66 HydrophobicContact CB-CE2 3.93Å; W42-Y66 WeakPolarHBondContact CB-OH 3.26Å; W42-Y66 HydrophobicContact CD2-CD2 4.41Å; W42-Y66 AromaticContact CD2-CE2 3.74Å; W42-Y66 HydrophobicContact CD2-CE2 3.74Å; W42-Y66 AromaticContact CE3-CD2 3.89Å; W42-Y66 HydrophobicContact CE3-CD2 3.89Å; W42-Y66 AromaticContact CE3-CE2 3.67Å; W42-Y66 HydrophobicContact CE3-CE2 3.67Å; W42-Y66 AromaticContact CG-CE2 3.87Å; W42-Y66 HydrophobicContact CG-CE2 3.87Å; W42-Y66 HydrophobicContact CZ3-CD2 4.33Å; W42-Y66 HydrophobicContact CZ3-CE2 4.42Å; W42-Y66 PolarHBondContact N-OH 3.45Å; W42-L81 HydrophobicContact CB-CD1 3.68Å; W42-L81 HydrophobicContact CE3-CD1 3.89Å; W42-L81 HydrophobicContact CE3-CD2 3.84Å; W42-L81 HydrophobicContact CE3-CG 3.77Å; W42-L81 HydrophobicContact CZ3-CD2 4.14Å; W42-L81 HydrophobicContact CZ3-CG 4.44Å; W42-R82 CarbonylContact C-O 3.56Å; W42-R82 VanDerWaalsContact CB-O 3.27Å; W42-R82 WeakPolarHBondContact CB-O 3.41Å; W42-F185 HydrophobicContact CE3-CE2 4.25Å; W42-F185 AromaticContact CH2-CE2 3.95Å; W42-F185 HydrophobicContact CH2-CE2 3.95Å; W42-F185 HydrophobicContact CH2-CZ 4.44Å; W42-F185 HydrophobicContact CZ3-CD2 4.01Å; W42-F185 AromaticContact CZ3-CE2 3.39Å; W42-F185 HydrophobicContact CZ3-CE2 3.39Å; W42-F185 HydrophobicContact CZ3-CZ 4.18Å; W42-L194 HydrophobicContact CZ3-CD2 4.23Å; W42-V197 HydrophobicContact CH2-CB 3.74Å; W42-V197 HydrophobicContact CH2-CG1 4.05Å; W42-V197 HydrophobicContact CH2-CG2 3.67Å; W42-V197 HydrophobicContact CZ3-CG2 4.11Å
43	L	78.1	Confident	72.6	Confident	39 Å²	39	64.5 Å²	64.5	20%	0.204	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	122.2	-177.9	179.9	71.1	0	0	0	110.2	L81 R82 I135 L137	L43-L81 CarbonylContact O-C 3.43Å; L43-L81 WeakPolarHBondContact O-CA 3.13Å; L43-R82 HydrophobicContact CB-CB 4.29Å; L43-R82 PolarHBondContact N-O 3.12Å; L43-R82 PolarHBondContact O-N 3.29Å; L43-I135 HydrophobicContact CD1-CB 4.27Å; L43-I135 WeakPolarHBondContact CD2-O 3.36Å; L43-L137 HydrophobicContact CD2-CB 3.95Å
44	L	85.4	Confident	72.7	Confident	41 Å²	41	70.2 Å²	70.2	22%	0.215	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	130	177.6	-50.8	172.7	0	0	0	109.2	W42 W51 Y66 L81	W42-L44 PolarHBondContact O-N 3.32Å; L44-W51 WeakPolarHBondContact CD1-O 3.45Å; L44-W51 HydrophobicContact CD2-CB 3.7Å; L44-Y66 HydrophobicContact CD2-CD1 4.14Å; L44-Y66 HydrophobicContact CD2-CE1 3.92Å; L44-L81 HydrophobicContact CD2-CD1 3.44Å; L44-L81 VanDerWaalsContact CD2-CD1 3.44Å
45	D	82.1	Confident	72.8	Confident	44 Å²	44	73 Å²	73	24%	0.235	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	114.4	176.9	-176.6	47.3	0	0	0	111.1	W80 L137 R139	D45-W80 HydrophobicContact CB-CB 4.27Å; D45-W80 PolarHBondContact N-O 3.41Å; D45-W80 PolarHBondContact O-N 3.39Å; D45-L137 HydrophobicContact CB-CD2 3.67Å; D45-L137 VanDerWaalsContact OD2-CD2 3.32Å; D45-L137 WeakPolarHBondContact OD2-CD2 3.44Å; D45-R139 IonicContact OD2-CZ 2.9Å; D45-R139 IonicContact OD2-NE 3.77Å; D45-R139 PolarHBondContact OD2-NE 3.38Å; D45-R139 IonicContact OD2-NH2 3.98Å; D45-R139 PolarHBondContact OD2-NH2 2.92Å
46	P	78.1	Confident	72.8	Confident	47 Å²	47	70.4 Å²	70.4	31%	0.305	37%	0.372	S	S	.	.	S	Bend	cis	-74	149.3	-1.9	18.5	-14	0	0	0	112.9	K48 D49	P46-K48 VanDerWaalsContact C-N 3.26Å; P46-K48 PolarHBondContact O-N 3.34Å; P46-K48 VanDerWaalsContact O-N 3.12Å; P46-D49 VanDerWaalsContact CD-O 3.27Å; P46-D49 WeakPolarHBondContact CD-O 3.37Å; P46-D49 HydrophobicContact CG-CB 4.27Å; P46-D49 WeakPolarHBondContact CG-O 3.45Å; P46-D49 PolarHBondContact O-N 3.19Å
47	P	73.5	Confident	73.4	Confident	101 Å²	101	75.1 Å²	75.1	66%	0.656	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-20.9	-171.4	-23.9	32.6	0	0	0	116.4
48	K	72.5	Confident	74.3	Confident	211 Å²	211	72.4 Å²	72.4	92%	0.917	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	-14.4	-174.3	-66	-173.3	179.5	-178.1	0	113.8	P46	P46-K48 VanDerWaalsContact C-N 3.26Å; P46-K48 PolarHBondContact O-N 3.34Å; P46-K48 VanDerWaalsContact O-N 3.12Å
49	D	74.4	Confident	75.1	Confident	114 Å²	114	79.3 Å²	79.3	61%	0.61	41%	0.414	S	S	*	.	S	Bend	trans	-137.4	88	-169.9	-167.2	18.5	0	0	0	108.7	P46 H79	P46-D49 VanDerWaalsContact CD-O 3.27Å; P46-D49 WeakPolarHBondContact CD-O 3.37Å; P46-D49 HydrophobicContact CG-CB 4.27Å; P46-D49 WeakPolarHBondContact CG-O 3.45Å; P46-D49 PolarHBondContact O-N 3.19Å; D49-H79 PolarHBondContact O-CD2 3.23Å; D49-H79 PolarHBondContact O-NE2 2.93Å
50	G	84.4	Confident	75.5	Confident	17 Å²	17	74.8 Å²	74.8	18%	0.175	41%	0.411	C	S	.	.	S	Bend	trans	150	-133.3	179.8	0	0	0	0	0	113.6	S52 H79	G50-S52 PolarHBondContact O-N 3.39Å; G50-H79 VanDerWaalsContact CA-CE1 3.48Å; G50-H79 WeakPolarHBondContact CA-CE1 3.35Å; G50-H79 WeakPolarHBondContact CA-ND1 3.28Å
51	W	89.1	Confident	75.5	Confident	7 Å²	7	78.2 Å²	78.2	3%	0.027	43%	0.433	C	S	.	.			trans	-53.3	134	178.8	-68.6	98.5	0	0	0	111.6	L44 D68 H79 L81 F185 N187 V192 L194	L44-W51 WeakPolarHBondContact CD1-O 3.45Å; L44-W51 HydrophobicContact CD2-CB 3.7Å; W51-D68 HydrophobicContact CD2-CB 3.75Å; W51-D68 HydrophobicContact CE3-CB 3.86Å; W51-D68 HydrophobicContact CG-CB 4.04Å; W51-D68 HydrophobicContact CZ3-CB 4.43Å; W51-H79 PolarHBondContact NE1-O 3.45Å; W51-L81 HydrophobicContact CB-CB 4.05Å; W51-L81 HydrophobicContact CB-CD1 4.45Å; W51-L81 HydrophobicContact CD2-CB 3.77Å; W51-L81 HydrophobicContact CD2-CD2 3.91Å; W51-L81 HydrophobicContact CD2-CG 4.43Å; W51-L81 HydrophobicContact CE3-CD2 3.83Å; W51-L81 HydrophobicContact CG-CB 3.54Å; W51-L81 HydrophobicContact CG-CD2 4.35Å; W51-L81 HydrophobicContact CG-CG 4.42Å; W51-L81 HydrophobicContact CZ3-CD2 4.16Å; W51-F185 HydrophobicContact CH2-CB 4.44Å; W51-F185 HydrophobicContact CZ2-CB 3.89Å; W51-F185 PolarHBondContact NE1-O 2.97Å; W51-N187 HydrophobicContact CZ2-CB 3.91Å; W51-V192 HydrophobicContact CH2-CG1 3.53Å; W51-V192 HydrophobicContact CZ2-CG1 4.13Å; W51-V192 HydrophobicContact CZ3-CG1 3.97Å; W51-L194 HydrophobicContact CH2-CB 4.45Å; W51-L194 HydrophobicContact CZ3-CB 4.05Å
52	S	86.1	Confident	75.6	Confident	31 Å²	31	78.7 Å²	78.7	22%	0.217	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	139	-179.6	63.7	0	0	0	0	110.2	G50 R54 Y66 Q67	G50-S52 PolarHBondContact O-N 3.39Å; S52-R54 PolarHBondContact OG-NH1 2.93Å; S52-R54 PolarHBondContact OG-NH2 2.94Å; S52-Y66 WeakPolarHBondContact O-CA 3.31Å; S52-Q67 PolarHBondContact N-O 3.04Å; S52-Q67 PolarHBondContact O-N 2.93Å; S52-Q67 PolarHBondContact OG-O 3.14Å
53	E	82.8	Confident	75.1	Confident	47 Å²	47	79.5 Å²	79.5	22%	0.22	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	140.4	174.8	-168.9	164.4	-156.5	0	0	110.3	E39 L40 Y66	E39-E53 VanDerWaalsContact CA-OE1 3.3Å; E39-E53 WeakPolarHBondContact CA-OE1 3.37Å; L40-E53 PolarHBondContact N-OE1 2.84Å; E53-Y66 HydrophobicContact CB-CD1 4.2Å; E53-Y66 HydrophobicContact CB-CE1 3.77Å; E53-Y66 HydrophobicContact CG-CE1 4.22Å
54	R	82.6	Confident	75.1	Confident	127 Å²	127	78.9 Å²	78.9	48%	0.479	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	135.5	178.4	-66.7	-67.1	-178.3	-100.8	-0	109.2	S52 M65 Q67	S52-R54 PolarHBondContact OG-NH1 2.93Å; S52-R54 PolarHBondContact OG-NH2 2.94Å; R54-M65 HydrophobicContact CB-CG 3.91Å; R54-M65 PolarHBondContact N-O 3.28Å; R54-M65 PolarHBondContact O-N 3.36Å; R54-Q67 HydrophobicContact CG-CB 4.14Å
55	Q	79.3	Confident	75.2	Confident	117 Å²	117	77.6 Å²	77.6	55%	0.547	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	129.5	172.8	-171.2	-175.3	15.1	0	0	109	P62 L63 Y64	Q55-P62 HydrophobicContact CG-CB 4.28Å; Q55-P62 VanDerWaalsContact NE2-CB 3.31Å; Q55-L63 WeakPolarHBondContact CA-O 3.2Å; Q55-Y64 HydrophobicContact CB-CD1 4.2Å; Q55-Y64 HydrophobicContact CB-CE1 4.12Å; Q55-Y64 HydrophobicContact CG-CD1 4.15Å; Q55-Y64 HydrophobicContact CG-CE1 3.81Å; Q55-Y64 PolarHBondContact NE2-OH 3.23Å; Q55-Y64 VanDerWaalsContact NE2-OH 3.13Å
56	Q	73.2	Confident	75.6	Confident	91 Å²	91	75.8 Å²	75.8	43%	0.425	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	139	174.6	-168.9	166.9	14	0	0	110.3	L63 M65	Q56-L63 PolarHBondContact N-O 3.44Å; Q56-L63 WeakPolarHBondContact O-CB 3.15Å; Q56-L63 PolarHBondContact O-N 2.94Å; Q56-M65 HydrophobicContact CB-CE 3.79Å
57	I	70.1	Confident	76.2	Confident	130 Å²	130	76.9 Å²	76.9	67%	0.667	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	119.7	176.5	-59.4	173	0	0	0	108.3
58	L	64.5	Low	77.1	Confident	85 Å²	85	72.4 Å²	72.4	45%	0.445	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	120.7	174.1	-133.3	110.6	0	0	0	108.4	G60 T61 L63	L58-G60 PolarHBondContact O-N 2.69Å; L58-G60 VanDerWaalsContact O-N 3.09Å; L58-T61 PolarHBondContact N-O 2.78Å; L58-T61 PolarHBondContact O-N 2.85Å; L58-T61 PolarHBondContact O-OG1 3.16Å; L58-L63 HydrophobicContact CD1-CD2 4.43Å
59	N	66.1	Low	77.8	Confident	165 Å²	165	64.3 Å²	64.3	88%	0.882	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	32	179.7	-59.8	-21.1	0	0	0	115.1	T61	N59-T61 VanDerWaalsContact C-N 3.35Å
60	G	58	Low	77.9	Confident	68 Å²	68	60.7 Å²	60.7	70%	0.701	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	-2.2	-179.8	0	0	0	0	0	115.3	L58	L58-G60 PolarHBondContact O-N 2.69Å; L58-G60 VanDerWaalsContact O-N 3.09Å
61	T	57.8	Low	76.9	Confident	92 Å²	92	63 Å²	63	56%	0.564	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	134.5	172.5	40.7	0	0	0	0	111.4	L58 N59 L63	L58-T61 PolarHBondContact N-O 2.78Å; L58-T61 PolarHBondContact O-N 2.85Å; L58-T61 PolarHBondContact O-OG1 3.16Å; N59-T61 VanDerWaalsContact C-N 3.35Å; T61-L63 PolarHBondContact O-N 2.95Å
62	P	66.6	Low	75.4	Confident	62 Å²	62	72.2 Å²	72.2	40%	0.403	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	127	173.6	29.1	-31.9	0	0	0	110.3	Q55 Y64	Q55-P62 HydrophobicContact CG-CB 4.28Å; Q55-P62 VanDerWaalsContact NE2-CB 3.31Å; P62-Y64 HydrophobicContact CB-CE2 4.21Å
63	L	71.9	Confident	73.8	Confident	33 Å²	33	73.1 Å²	73.1	17%	0.173	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	122.9	175.2	-177.5	67.4	0	0	0	108.8	Q55 Q56 L58 T61 M65 V195	Q55-L63 WeakPolarHBondContact CA-O 3.2Å; Q56-L63 PolarHBondContact N-O 3.44Å; Q56-L63 WeakPolarHBondContact O-CB 3.15Å; Q56-L63 PolarHBondContact O-N 2.94Å; L58-L63 HydrophobicContact CD1-CD2 4.43Å; T61-L63 PolarHBondContact O-N 2.95Å; L63-M65 HydrophobicContact CD2-CE 4.16Å; L63-V195 HydrophobicContact CD2-CG1 3.72Å; L63-V195 HydrophobicContact CG-CG1 4.42Å
64	Y	79.6	Confident	72.3	Confident	27 Å²	27	83.3 Å²	83.3	11%	0.106	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	128.8	177.2	-63.8	-90.3	0	0	0	109.6	G38 Q55 P62	G38-Y64 WeakPolarHBondContact O-CD2 3.46Å; Q55-Y64 HydrophobicContact CB-CD1 4.2Å; Q55-Y64 HydrophobicContact CB-CE1 4.12Å; Q55-Y64 HydrophobicContact CG-CD1 4.15Å; Q55-Y64 HydrophobicContact CG-CE1 3.81Å; Q55-Y64 PolarHBondContact NE2-OH 3.23Å; Q55-Y64 VanDerWaalsContact NE2-OH 3.13Å; P62-Y64 HydrophobicContact CB-CE2 4.21Å
65	M	86.1	Confident	71	Confident	14 Å²	14	87.8 Å²	87.8	7%	0.069	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	154.5	-178.2	69.1	-178.8	77.4	0	0	111.2	R54 Q56 L63 A193 L194	R54-M65 HydrophobicContact CB-CG 3.91Å; R54-M65 PolarHBondContact N-O 3.28Å; R54-M65 PolarHBondContact O-N 3.36Å; Q56-M65 HydrophobicContact CB-CE 3.79Å; L63-M65 HydrophobicContact CD2-CE 4.16Å; M65-A193 HydrophobicContact SD-CB 4.33Å; M65-L194 WeakPolarHBondContact CA-O 3.5Å; M65-L194 VanDerWaalsContact CB-O 3.28Å; M65-L194 WeakPolarHBondContact CB-O 3.32Å
66	Y	90.4	Very high	70.1	Confident	5 Å²	5	89.1 Å²	89.1	2%	0.02	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126.3	172.8	-77.7	-72.3	0	0	0	110.2	L40 G41 W42 L44 S52 E53 L81 A193 L194	L40-Y66 HydrophobicContact CB-CE2 3.69Å; L40-Y66 WeakPolarHBondContact CB-OH 3.33Å; L40-Y66 HydrophobicContact CD1-CD2 4.01Å; L40-Y66 HydrophobicContact CD1-CE2 3.54Å; L40-Y66 HydrophobicContact CG-CE2 4.26Å; G41-Y66 PolarHBondContact N-OH 2.65Å; W42-Y66 HydrophobicContact CB-CE2 3.93Å; W42-Y66 WeakPolarHBondContact CB-OH 3.26Å; W42-Y66 HydrophobicContact CD2-CD2 4.41Å; W42-Y66 AromaticContact CD2-CE2 3.74Å; W42-Y66 HydrophobicContact CD2-CE2 3.74Å; W42-Y66 AromaticContact CE3-CD2 3.89Å; W42-Y66 HydrophobicContact CE3-CD2 3.89Å; W42-Y66 AromaticContact CE3-CE2 3.67Å; W42-Y66 HydrophobicContact CE3-CE2 3.67Å; W42-Y66 AromaticContact CG-CE2 3.87Å; W42-Y66 HydrophobicContact CG-CE2 3.87Å; W42-Y66 HydrophobicContact CZ3-CD2 4.33Å; W42-Y66 HydrophobicContact CZ3-CE2 4.42Å; W42-Y66 PolarHBondContact N-OH 3.45Å; L44-Y66 HydrophobicContact CD2-CD1 4.14Å; L44-Y66 HydrophobicContact CD2-CE1 3.92Å; S52-Y66 WeakPolarHBondContact O-CA 3.31Å; E53-Y66 HydrophobicContact CB-CD1 4.2Å; E53-Y66 HydrophobicContact CB-CE1 3.77Å; E53-Y66 HydrophobicContact CG-CE1 4.22Å; Y66-L81 HydrophobicContact CD1-CD1 3.82Å; Y66-L81 HydrophobicContact CD1-CD2 4.27Å; Y66-L81 HydrophobicContact CD2-CD1 4.15Å; Y66-L81 HydrophobicContact CD2-CD2 3.84Å; Y66-L81 HydrophobicContact CE1-CD1 3.9Å; Y66-L81 HydrophobicContact CE2-CD1 4.19Å; Y66-L81 HydrophobicContact CG-CD1 3.96Å; Y66-L81 HydrophobicContact CG-CD2 3.65Å; Y66-L81 HydrophobicContact CG-CG 4.49Å; Y66-A193 CarbonylContact O-C 3.56Å; Y66-A193 WeakPolarHBondContact O-CA 3.43Å; Y66-L194 PolarHBondContact N-O 3.17Å; Y66-L194 PolarHBondContact O-N 3.39Å
67	Q	91.7	Very high	70.1	Confident	71 Å²	71	86 Å²	86	33%	0.332	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136	179.9	-174.4	-179.5	3.9	0	0	110.9	S52 R54 V192 A193	S52-Q67 PolarHBondContact N-O 3.04Å; S52-Q67 PolarHBondContact O-N 2.93Å; S52-Q67 PolarHBondContact OG-O 3.14Å; R54-Q67 HydrophobicContact CG-CB 4.14Å; Q67-V192 WeakPolarHBondContact CA-O 3.48Å; Q67-A193 HydrophobicContact CB-CB 4.22Å; Q67-A193 HydrophobicContact CG-CB 4.1Å
68	D	91.4	Very high	70.7	Confident	7 Å²	7	83.1 Å²	83.1	4%	0.037	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	131.2	169.5	-171.9	10	0	0	0	109.7	W51 H79 N187 C191 V192	W51-D68 HydrophobicContact CD2-CB 3.75Å; W51-D68 HydrophobicContact CE3-CB 3.86Å; W51-D68 HydrophobicContact CG-CB 4.04Å; W51-D68 HydrophobicContact CZ3-CB 4.43Å; D68-H79 IonicContact OD1-ND1 3.27Å; D68-H79 PolarHBondContact OD1-ND1 3.42Å; D68-H79 WeakPolarHBondContact OD2-CB 3.5Å; D68-H79 IonicContact OD2-CG 3.64Å; D68-H79 IonicContact OD2-ND1 2.62Å; D68-H79 PolarHBondContact OD2-ND1 2.98Å; D68-N187 VanDerWaalsContact CG-ND2 3.29Å; D68-N187 PolarHBondContact OD2-ND2 3.25Å; D68-C191 CarbonylContact O-C 3.42Å; D68-C191 WeakPolarHBondContact O-CA 3.22Å; D68-V192 PolarHBondContact N-O 2.73Å; D68-V192 PolarHBondContact O-N 3.27Å; D68-V192 VanDerWaalsContact O-O 3.11Å
69	C	87.8	Confident	72	Confident	40 Å²	40	79.5 Å²	79.5	27%	0.27	42%	0.42	S	S	.	.			trans	-153.7	83.9	-178.6	-168.1	0	0	0	0	109.2	V71 C191	C69-V71 VanDerWaalsContact C-N 3.34Å; C69-V71 HydrophobicContact CB-CG2 4.28Å; C69-V71 WeakPolarHBondContact O-CG2 3.4Å; C69-V71 PolarHBondContact O-N 3.31Å; C69-V71 WeakPolarHBondContact SG-CG2 3.35Å; C69-C191 HydrophobicContact CB-CB 3.93Å; C69-C191 WeakPolarHBondContact CB-SG 3.4Å; C69-C191 WeakPolarHBondContact SG-CB 3.3Å; C69-C191 CovalentContact SG-SG 2.04Å; C69-C191 PolarHBondContact SG-SG 2.87Å
70	P	77.4	Confident	73.3	Confident	38 Å²	38	72.6 Å²	72.6	25%	0.247	38%	0.381	C	S	.	.			trans	-79.1	77.9	-176.4	30.3	-32.8	0	0	0	110.9	Q72 T77 A190	P70-Q72 VanDerWaalsContact C-N 3.35Å; P70-Q72 PolarHBondContact O-N 3.37Å; P70-T77 HydrophobicContact CB-CG2 3.78Å; P70-T77 HydrophobicContact CG-CG2 3.91Å; P70-A190 WeakPolarHBondContact CD-O 3.4Å
71	V	61.8	Low	75	Confident	67 Å²	67	69.3 Å²	69.3	41%	0.406	35%	0.348	S	S	.	.			trans	-86.2	-0.6	-173.5	-159.7	0	0	0	0	113.4	C69 F109 P115	C69-V71 VanDerWaalsContact C-N 3.34Å; C69-V71 HydrophobicContact CB-CG2 4.28Å; C69-V71 WeakPolarHBondContact O-CG2 3.4Å; C69-V71 PolarHBondContact O-N 3.31Å; C69-V71 WeakPolarHBondContact SG-CG2 3.35Å; V71-F109 HydrophobicContact CB-CE1 4.23Å; V71-F109 HydrophobicContact CG1-CD1 3.53Å; V71-F109 HydrophobicContact CG1-CE1 3.43Å; V71-F109 VanDerWaalsContact CG1-CE1 3.43Å; V71-F109 HydrophobicContact CG1-CZ 4.36Å; V71-F109 HydrophobicContact CG2-CE1 3.61Å; V71-F109 HydrophobicContact CG2-CZ 4.1Å; V71-P115 HydrophobicContact CG1-CG 4.31Å
72	Q	57.8	Low	76.6	Confident	200 Å²	200	65.4 Å²	65.4	94%	0.935	32%	0.323	S	S	*	.	S	Bend	trans	-133.2	5.6	-170.6	-102.6	162.2	9.6	0	0	116.5	P70	P70-Q72 VanDerWaalsContact C-N 3.35Å; P70-Q72 PolarHBondContact O-N 3.37Å
73	G	53.6	Low	77.5	Confident	49 Å²	49	62.4 Å²	62.4	51%	0.505	30%	0.303	S	S	.	.			trans	-94.2	132.5	-179.5	0	0	0	0	0	113.9	R75	G73-R75 PolarHBondContact O-N 3.49Å
74	R	50.5	Low	78	Confident	261 Å²	261	64.4 Å²	64.4	99%	0.985	31%	0.314	S	S	*	.	S	Bend	trans	-80.7	21.5	172.3	-106.7	-175.8	179.4	-176.9	-0	113.6
75	R	56.2	Low	78.1	Confident	222 Å²	222	66.1 Å²	66.1	84%	0.838	32%	0.32	S	S	*	.	S	Bend	trans	-136.6	155.2	-170.7	-74.1	-172.7	179.9	-169.5	0.4	112.8	G73 T77	G73-R75 PolarHBondContact O-N 3.49Å; R75-T77 PolarHBondContact O-N 3.36Å
76	D	59.6	Low	78	Confident	145 Å²	145	65.8 Å²	65.8	78%	0.775	32%	0.319	S	S	*	.			trans	-54.2	119.6	164.5	-137.2	-1.2	0	0	0	108	K119	D76-K119 IonicContact OD1-NZ 2.93Å
77	T	72.4	Confident	77.6	Confident	24 Å²	24	71 Å²	71	15%	0.147	34%	0.339	C	S	.	.			trans	-92.2	131.6	-177.6	56	0	0	0	0	109.3	P70 R75 P188 G189	P70-T77 HydrophobicContact CB-CG2 3.78Å; P70-T77 HydrophobicContact CG-CG2 3.91Å; R75-T77 PolarHBondContact O-N 3.36Å; T77-P188 CarbonylContact O-C 3.57Å; T77-P188 VanDerWaalsContact O-CA 3.31Å; T77-P188 WeakPolarHBondContact O-CA 3.31Å; T77-P188 PolarHBondContact OG1-O 3.43Å; T77-G189 WeakPolarHBondContact OG1-CA 3.46Å; T77-G189 PolarHBondContact OG1-N 3.31Å
78	D	84.2	Confident	77.1	Confident	70 Å²	70	68.6 Å²	68.6	37%	0.374	33%	0.327	S	S	.	.			trans	-125.2	64.2	-177	-177.4	28.5	0	0	0	108.8	W80 R139 H186	D78-W80 PolarHBondContact OD1-NE1 3.01Å; D78-R139 IonicContact OD1-NH1 3.59Å; D78-R139 IonicContact OD2-CZ 2.88Å; D78-R139 IonicContact OD2-NH1 3.37Å; D78-R139 PolarHBondContact OD2-NH1 3.37Å; D78-R139 IonicContact OD2-NH2 2.77Å; D78-H186 IonicContact OD1-CD2 3.59Å; D78-H186 IonicContact OD1-NE2 3.91Å; D78-H186 PolarHBondContact OD1-NE2 3.42Å
79	H	91.4	Very high	76	Confident	10 Å²	10	69.1 Å²	69.1	5%	0.046	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	126.2	-174.7	-58.2	165.8	0	0	0	110.8	D49 G50 W51 D68 H186 N187	D49-H79 PolarHBondContact O-CD2 3.23Å; D49-H79 PolarHBondContact O-NE2 2.93Å; G50-H79 VanDerWaalsContact CA-CE1 3.48Å; G50-H79 WeakPolarHBondContact CA-CE1 3.35Å; G50-H79 WeakPolarHBondContact CA-ND1 3.28Å; W51-H79 PolarHBondContact NE1-O 3.45Å; D68-H79 IonicContact OD1-ND1 3.27Å; D68-H79 PolarHBondContact OD1-ND1 3.42Å; D68-H79 WeakPolarHBondContact OD2-CB 3.5Å; D68-H79 IonicContact OD2-CG 3.64Å; D68-H79 IonicContact OD2-ND1 2.62Å; D68-H79 PolarHBondContact OD2-ND1 2.98Å; H79-H186 WeakPolarHBondContact O-CA 3.45Å; H79-N187 HydrophobicContact CB-CB 4.41Å; H79-N187 PolarHBondContact N-O 3.3Å; H79-N187 PolarHBondContact O-N 2.85Å
80	W	93.1	Very high	74.9	Confident	19 Å²	19	74.3 Å²	74.3	7%	0.072	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	136.8	-179.1	-68.9	69.6	0	0	0	110.3	D45 D78 L125 L137 R139 F142 A184 F185 H186	D45-W80 HydrophobicContact CB-CB 4.27Å; D45-W80 PolarHBondContact N-O 3.41Å; D45-W80 PolarHBondContact O-N 3.39Å; D78-W80 PolarHBondContact OD1-NE1 3.01Å; W80-L125 HydrophobicContact CH2-CD1 4.42Å; W80-L125 HydrophobicContact CH2-CD2 4.07Å; W80-L125 HydrophobicContact CZ3-CD1 4.21Å; W80-L125 HydrophobicContact CZ3-CD2 4.28Å; W80-L137 HydrophobicContact CB-CD2 3.56Å; W80-L137 HydrophobicContact CD2-CD2 4.21Å; W80-L137 HydrophobicContact CE3-CD2 4.38Å; W80-L137 HydrophobicContact CG-CD2 3.88Å; W80-R139 HydrophobicContact CD2-CG 4.47Å; W80-R139 HydrophobicContact CH2-CB 4.39Å; W80-R139 HydrophobicContact CZ2-CB 4.43Å; W80-R139 HydrophobicContact CZ2-CG 4.45Å; W80-F142 HydrophobicContact CZ3-CB 4.28Å; W80-F142 HydrophobicContact CZ3-CG 4.36Å; W80-A184 HydrophobicContact CE3-CB 4.04Å; W80-A184 HydrophobicContact CZ3-CB 4.19Å; W80-F185 WeakPolarHBondContact CA-O 3.49Å; W80-H186 AromaticContact CD1-CD2 3.96Å; W80-H186 HydrophobicContact CD2-CB 4.12Å; W80-H186 AromaticContact CE2-CD2 3.78Å; W80-H186 AromaticContact CE2-CG 3.88Å; W80-H186 HydrophobicContact CE3-CB 4.32Å; W80-H186 HydrophobicContact CH2-CB 4.35Å; W80-H186 HydrophobicContact CZ2-CB 4.14Å; W80-H186 AromaticContact CZ2-CG 3.97Å; W80-H186 HydrophobicContact CZ3-CB 4.43Å; W80-H186 AromaticContact NE1-CD2 3.45Å; W80-H186 PolarHBondContact NE1-CD2 3.03Å
81	L	92.8	Very high	74.3	Confident	0 Å²	0	78 Å²	78	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	123.6	168.6	166.8	72.3	0	0	0	107.1	W42 L43 L44 W51 Y66 A184 F185 L194	W42-L81 HydrophobicContact CB-CD1 3.68Å; W42-L81 HydrophobicContact CE3-CD1 3.89Å; W42-L81 HydrophobicContact CE3-CD2 3.84Å; W42-L81 HydrophobicContact CE3-CG 3.77Å; W42-L81 HydrophobicContact CZ3-CD2 4.14Å; W42-L81 HydrophobicContact CZ3-CG 4.44Å; L43-L81 CarbonylContact O-C 3.43Å; L43-L81 WeakPolarHBondContact O-CA 3.13Å; L44-L81 HydrophobicContact CD2-CD1 3.44Å; L44-L81 VanDerWaalsContact CD2-CD1 3.44Å; W51-L81 HydrophobicContact CB-CB 4.05Å; W51-L81 HydrophobicContact CB-CD1 4.45Å; W51-L81 HydrophobicContact CD2-CB 3.77Å; W51-L81 HydrophobicContact CD2-CD2 3.91Å; W51-L81 HydrophobicContact CD2-CG 4.43Å; W51-L81 HydrophobicContact CE3-CD2 3.83Å; W51-L81 HydrophobicContact CG-CB 3.54Å; W51-L81 HydrophobicContact CG-CD2 4.35Å; W51-L81 HydrophobicContact CG-CG 4.42Å; W51-L81 HydrophobicContact CZ3-CD2 4.16Å; Y66-L81 HydrophobicContact CD1-CD1 3.82Å; Y66-L81 HydrophobicContact CD1-CD2 4.27Å; Y66-L81 HydrophobicContact CD2-CD1 4.15Å; Y66-L81 HydrophobicContact CD2-CD2 3.84Å; Y66-L81 HydrophobicContact CE1-CD1 3.9Å; Y66-L81 HydrophobicContact CE2-CD1 4.19Å; Y66-L81 HydrophobicContact CG-CD1 3.96Å; Y66-L81 HydrophobicContact CG-CD2 3.65Å; Y66-L81 HydrophobicContact CG-CG 4.49Å; L81-A184 CarbonylContact O-C 3.5Å; L81-A184 VanDerWaalsContact O-CA 3.23Å; L81-A184 WeakPolarHBondContact O-CA 3.48Å; L81-F185 HydrophobicContact CB-CB 4.21Å; L81-F185 HydrophobicContact CB-CD2 4.48Å; L81-F185 HydrophobicContact CD2-CB 4.44Å; L81-F185 HydrophobicContact CD2-CD2 3.98Å; L81-F185 HydrophobicContact CD2-CG 4.43Å; L81-F185 HydrophobicContact CG-CD2 4.12Å; L81-F185 PolarHBondContact N-O 2.91Å; L81-F185 PolarHBondContact O-N 3.04Å; L81-L194 HydrophobicContact CD2-CD2 4.05Å
82	R	91.8	Very high	74.6	Confident	9 Å²	9	75 Å²	75	3%	0.034	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	130.3	-178.9	-174.4	-147	70.9	-178.6	2.7	110.5	W42 L43 G134 Q136 L137 F142 Y182 L183 A184	W42-R82 CarbonylContact C-O 3.56Å; W42-R82 VanDerWaalsContact CB-O 3.27Å; W42-R82 WeakPolarHBondContact CB-O 3.41Å; L43-R82 HydrophobicContact CB-CB 4.29Å; L43-R82 PolarHBondContact N-O 3.12Å; L43-R82 PolarHBondContact O-N 3.29Å; R82-G134 PolarHBondContact NH1-O 3.06Å; R82-G134 PolarHBondContact NH2-O 3.01Å; R82-Q136 PolarHBondContact NH1-O 3.4Å; R82-L137 HydrophobicContact CB-CD1 3.76Å; R82-L137 HydrophobicContact CG-CD1 4.04Å; R82-F142 HydrophobicContact CG-CE1 4.33Å; R82-F142 HydrophobicContact CG-CZ 3.8Å; R82-Y182 HydrophobicContact CG-CD1 4.27Å; R82-L183 CarbonylContact C-O 3.48Å; R82-L183 WeakPolarHBondContact CA-O 3.39Å; R82-L183 WeakPolarHBondContact CG-O 3.47Å; R82-A184 HydrophobicContact CB-CB 4.44Å; R82-A184 HydrophobicContact CG-CB 4.44Å
83	S	85.6	Confident	75.5	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-60.3	172.1	175.1	75.1	0	0	0	0	112.6	Y182 L183	S83-Y182 WeakPolarHBondContact O-CD1 3.45Å; S83-L183 PolarHBondContact N-O 3.28Å; S83-L183 PolarHBondContact OG-N 3.48Å; S83-L183 PolarHBondContact OG-O 3.26Å
84	N	82.4	Confident	76.9	Confident	74 Å²	74	69 Å²	69	40%	0.396	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-70.7	170.7	161.7	-62.3	-20.5	0	0	0	110.4	L40 G41 I86	L40-N84 PolarHBondContact O-ND2 2.91Å; G41-N84 PolarHBondContact O-OD1 3.01Å; N84-I86 PolarHBondContact O-N 3.12Å
85	W	82.4	Confident	78.7	Confident	63 Å²	63	56.6 Å²	56.6	24%	0.239	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-68.4	121.6	176.5	-172.6	68.1	0	0	0	110.1	Y87 S129 D132 R179 Y182	W85-Y87 AromaticContact CH2-CD2 3.5Å; W85-Y87 HydrophobicContact CH2-CD2 3.5Å; W85-Y87 HydrophobicContact CH2-CE2 4.34Å; W85-Y87 HydrophobicContact CH2-CG 4.25Å; W85-Y87 HydrophobicContact CZ2-CD2 4.31Å; W85-Y87 AromaticContact CZ3-CD2 3.93Å; W85-Y87 HydrophobicContact CZ3-CD2 3.93Å; W85-Y87 HydrophobicContact CZ3-CG 4.23Å; W85-S129 PolarHBondContact NE1-O 3.38Å; W85-D132 HydrophobicContact CB-CB 3.92Å; W85-D132 HydrophobicContact CD2-CB 4.28Å; W85-D132 HydrophobicContact CG-CB 4.06Å; W85-R179 HydrophobicContact CZ2-CB 4.23Å; W85-Y182 VanDerWaalsContact CA-CE1 3.5Å; W85-Y182 HydrophobicContact CB-CE1 3.71Å; W85-Y182 HydrophobicContact CB-CE2 4.33Å; W85-Y182 AromaticContact CD1-CE2 3.45Å; W85-Y182 VanDerWaalsContact CD1-CE2 3.45Å; W85-Y182 AromaticContact CD1-CZ 3.62Å; W85-Y182 HydrophobicContact CG-CE1 4.47Å; W85-Y182 HydrophobicContact CG-CE2 4.25Å; W85-Y182 AromaticContact CG-CZ 3.97Å; W85-Y182 VanDerWaalsContact N-CE1 3.33Å
86	I	84.7	Confident	80.4	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.036	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	109.7	179.2	-59.8	159.2	0	0	0	107.3	L30 M31 N84 R88 G180 L181 L183 V199	L30-I86 HydrophobicContact CB-CG2 3.77Å; L30-I86 HydrophobicContact CD1-CG2 4.35Å; M31-I86 HydrophobicContact CB-CG1 4.42Å; M31-I86 HydrophobicContact CE-CD1 3.92Å; M31-I86 HydrophobicContact SD-CD1 3.95Å; M31-I86 HydrophobicContact SD-CG1 3.99Å; N84-I86 PolarHBondContact O-N 3.12Å; I86-R88 PolarHBondContact O-N 3.12Å; I86-G180 CarbonylContact O-C 3.43Å; I86-G180 WeakPolarHBondContact O-CA 3.35Å; I86-L181 HydrophobicContact CB-CD2 4.19Å; I86-L181 HydrophobicContact CB-CG 4.28Å; I86-L181 HydrophobicContact CG2-CD2 4.23Å; I86-L181 PolarHBondContact N-O 3.5Å; I86-L181 PolarHBondContact O-N 3.37Å; I86-L183 HydrophobicContact CD1-CD1 4.14Å; I86-L183 HydrophobicContact CD1-CG 3.97Å; I86-V199 HydrophobicContact CD1-CG2 4.06Å; I86-V199 HydrophobicContact CG2-CG1 4.46Å
87	Y	81.9	Confident	82.1	Confident	116 Å²	116	40.5 Å²	40.5	46%	0.455	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	122.7	171.5	-177.5	-124.7	0	0	0	109.6	W85 R179	W85-Y87 AromaticContact CH2-CD2 3.5Å; W85-Y87 HydrophobicContact CH2-CD2 3.5Å; W85-Y87 HydrophobicContact CH2-CE2 4.34Å; W85-Y87 HydrophobicContact CH2-CG 4.25Å; W85-Y87 HydrophobicContact CZ2-CD2 4.31Å; W85-Y87 AromaticContact CZ3-CD2 3.93Å; W85-Y87 HydrophobicContact CZ3-CD2 3.93Å; W85-Y87 HydrophobicContact CZ3-CG 4.23Å; Y87-R179 VanDerWaalsContact CD2-O 3.23Å; Y87-R179 WeakPolarHBondContact CD2-O 3.13Å; Y87-R179 HydrophobicContact CE2-CB 4.39Å
88	R	80.9	Confident	83.2	Confident	20 Å²	20	40 Å²	40	8%	0.075	19%	0.186	C	C	.	.			trans	-79.3	-24.2	-179.2	-176.7	-177.9	70.1	67.9	0.4	111.9	I86 E90 A92 V95 L176 R178 R179 L181	I86-R88 PolarHBondContact O-N 3.12Å; R88-E90 PolarHBondContact NH1-O 2.61Å; R88-E90 PolarHBondContact NH2-O 3.47Å; R88-A92 WeakPolarHBondContact CD-O 3.43Å; R88-A92 HydrophobicContact CG-CB 4.08Å; R88-A92 WeakPolarHBondContact CG-O 3.39Å; R88-A92 PolarHBondContact NH1-O 3.18Å; R88-A92 WeakPolarHBondContact O-CB 3.44Å; R88-V95 HydrophobicContact CG-CG2 4.17Å; R88-L176 HydrophobicContact CG-CD1 4.38Å; R88-R178 PolarHBondContact NE-O 3.22Å; R88-R178 PolarHBondContact NH2-O 2.75Å; R88-R179 WeakPolarHBondContact CB-O 3.26Å; R88-R179 PolarHBondContact N-O 3.47Å; R88-L181 HydrophobicContact CB-CD2 4.5Å
89	G	68.8	Low	83.7	Confident	18 Å²	18	36.7 Å²	36.7	19%	0.186	17%	0.169	C	C	.	.			trans	81.1	166.9	-160.6	0	0	0	0	0	111.4	E91	G89-E91 VanDerWaalsContact C-N 3.31Å
90	E	63.8	Low	83.8	Confident	149 Å²	149	38.8 Å²	38.8	70%	0.696	18%	0.178	S	C	*	.	S	Bend	trans	-71.4	-30.6	179.7	-61.9	-171.2	159.2	0	0	111.4	R88	R88-E90 PolarHBondContact NH1-O 2.61Å; R88-E90 PolarHBondContact NH2-O 3.47Å
91	E	65.1	Low	83.8	Confident	116 Å²	116	37.9 Å²	37.9	54%	0.542	18%	0.175	S	C	.	.	S	Bend	trans	-99.1	-24	-163.1	-38.4	-174.9	144.2	0	0	115.6	G89 S93 R203 L218	G89-E91 VanDerWaalsContact C-N 3.31Å; E91-S93 PolarHBondContact O-N 3.16Å; E91-S93 VanDerWaalsContact O-N 3.11Å; E91-R203 IonicContact OE2-CZ 3.9Å; E91-R203 IonicContact OE2-NH1 3.62Å; E91-R203 PolarHBondContact OE2-NH1 3.2Å; E91-R203 IonicContact OE2-NH2 3.89Å; E91-R203 PolarHBondContact OE2-NH2 3.06Å; E91-L218 HydrophobicContact CB-CD1 3.21Å; E91-L218 HydrophobicContact CG-CD1 4.23Å; E91-L218 WeakPolarHBondContact OE2-CD1 3.44Å
92	A	68.6	Low	83.8	Confident	2 Å²	2	38.8 Å²	38.8	2%	0.017	18%	0.181	C	C	.	.			trans	-82.1	90.5	-168.9	0	0	0	0	0	114	R88 Y201	R88-A92 WeakPolarHBondContact CD-O 3.43Å; R88-A92 HydrophobicContact CG-CB 4.08Å; R88-A92 WeakPolarHBondContact CG-O 3.39Å; R88-A92 PolarHBondContact NH1-O 3.18Å; R88-A92 WeakPolarHBondContact O-CB 3.44Å; A92-Y201 HydrophobicContact CB-CD1 3.62Å; A92-Y201 HydrophobicContact CB-CD2 3.76Å; A92-Y201 HydrophobicContact CB-CE1 3.95Å; A92-Y201 HydrophobicContact CB-CE2 4.06Å; A92-Y201 HydrophobicContact CB-CG 3.52Å
93	S	75.7	Confident	83.7	Confident	25 Å²	25	38.4 Å²	38.4	18%	0.175	18%	0.179	C	C	.	.			trans	-76.4	-23.1	-172.8	69.1	0	0	0	0	115.7	E91 H175 L176	E91-S93 PolarHBondContact O-N 3.16Å; E91-S93 VanDerWaalsContact O-N 3.11Å; S93-H175 VanDerWaalsContact CB-CE1 3.5Å; S93-H175 WeakPolarHBondContact CB-CE1 3.33Å; S93-L176 PolarHBondContact O-N 3.32Å
94	R	83.7	Confident	83.8	Confident	100 Å²	100	40.3 Å²	40.3	38%	0.377	19%	0.187	S	C	.	.			trans	-125.7	128.9	178.2	179.7	174.3	-86.4	-176.8	-3.8	109.2	Y201	R94-Y201 VanDerWaalsContact O-CB 3.31Å; R94-Y201 WeakPolarHBondContact O-CB 2.8Å
95	V	88.9	Confident	84	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.176	C	C	.	.			trans	-122.7	142.4	-177.5	171.8	0	0	0	0	109	L30 R88 L173 L176 V199	L30-V95 HydrophobicContact CD1-CG1 4.04Å; L30-V95 HydrophobicContact CD1-CG2 3.79Å; R88-V95 HydrophobicContact CG-CG2 4.17Å; V95-L173 HydrophobicContact CB-CD1 4.2Å; V95-L173 HydrophobicContact CG1-CD1 4.07Å; V95-L173 WeakPolarHBondContact O-CB 3.49Å; V95-L173 PolarHBondContact O-N 3.16Å; V95-L176 HydrophobicContact CB-CD1 3.86Å; V95-L176 HydrophobicContact CG2-CD1 3.6Å; V95-V199 HydrophobicContact CG1-CG1 3.29Å
96	H	91.1	Very high	84.1	Confident	27 Å²	27	36.3 Å²	36.3	13%	0.125	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	145.8	178.6	-59.1	-96.6	0	0	0	109.6	C171 V199 F200	H96-C171 CarbonylContact C-O 3.51Å; H96-C171 WeakPolarHBondContact CA-O 3.5Å; H96-V199 VanDerWaalsContact O-CA 3.32Å; H96-V199 WeakPolarHBondContact O-CA 3.47Å; H96-F200 HydrophobicContact CB-CD1 4.34Å; H96-F200 HydrophobicContact CB-CD2 4.3Å; H96-F200 HydrophobicContact CB-CE1 3.97Å; H96-F200 HydrophobicContact CB-CE2 3.92Å; H96-F200 HydrophobicContact CB-CZ 3.75Å; H96-F200 PolarHBondContact N-O 2.86Å; H96-F200 PolarHBondContact O-N 2.95Å
97	V	94.6	Very high	84	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	122.1	176.6	-174.7	0	0	0	0	107.7	L99 L124 R170 C171 L173 L183 V197 R198 V199	V97-L99 HydrophobicContact CG1-CD2 3.65Å; V97-L99 HydrophobicContact CG1-CG 4.26Å; V97-L124 HydrophobicContact CB-CD2 4.34Å; V97-L124 HydrophobicContact CG1-CD2 4.2Å; V97-R170 WeakPolarHBondContact O-CA 3.44Å; V97-C171 PolarHBondContact N-O 3.32Å; V97-C171 PolarHBondContact O-N 3.23Å; V97-L173 HydrophobicContact CG2-CD1 4.02Å; V97-L173 HydrophobicContact CG2-CD2 4.02Å; V97-L173 HydrophobicContact CG2-CG 4.01Å; V97-L183 HydrophobicContact CG1-CD1 3.89Å; V97-L183 HydrophobicContact CG2-CD1 3.96Å; V97-L183 HydrophobicContact CG2-CD2 4.08Å; V97-V197 HydrophobicContact CG1-CG1 4.21Å; V97-R198 CarbonylContact C-O 3.53Å; V97-R198 WeakPolarHBondContact CA-O 3.5Å; V97-V199 HydrophobicContact CG1-CG2 4.47Å; V97-V199 HydrophobicContact CG2-CG2 4.35Å
98	E	95.4	Very high	83.9	Confident	14 Å²	14	39.3 Å²	39.3	7%	0.065	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.5	171.1	179.8	-177.9	107.9	0	0	108.7	V168 E169 R170 V197 R198 F200	E98-V168 HydrophobicContact CG-CG1 3.96Å; E98-E169 CarbonylContact C-O 3.58Å; E98-E169 WeakPolarHBondContact CA-O 3.42Å; E98-R170 HydrophobicContact CB-CG 4.1Å; E98-R170 HydrophobicContact CG-CG 3.95Å; E98-R170 IonicContact OE2-CZ 3.46Å; E98-R170 IonicContact OE2-NE 2.73Å; E98-R170 PolarHBondContact OE2-NE 3.32Å; E98-R170 IonicContact OE2-NH2 2.68Å; E98-R170 PolarHBondContact OE2-NH2 3.27Å; E98-V197 WeakPolarHBondContact O-CA 3.4Å; E98-R198 HydrophobicContact CB-CB 4.33Å; E98-R198 PolarHBondContact N-O 3.29Å; E98-R198 PolarHBondContact O-N 3.08Å; E98-F200 HydrophobicContact CB-CE1 4.18Å
99	L	95.3	Very high	83.8	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133.2	178.2	-53.2	-178.5	0	0	0	109	V97 F101 F122 L124 V148 V168 E169 F185 L194 V197	V97-L99 HydrophobicContact CG1-CD2 3.65Å; V97-L99 HydrophobicContact CG1-CG 4.26Å; L99-F101 HydrophobicContact CB-CD1 4.29Å; L99-F122 HydrophobicContact CD1-CE2 4.2Å; L99-F122 HydrophobicContact CD1-CZ 4.26Å; L99-L124 HydrophobicContact CD1-CD2 4.28Å; L99-V148 HydrophobicContact CD1-CG2 3.95Å; L99-V168 CarbonylContact O-C 3.53Å; L99-V168 VanDerWaalsContact O-CA 3.29Å; L99-V168 WeakPolarHBondContact O-CA 3.47Å; L99-E169 HydrophobicContact CB-CB 4.49Å; L99-E169 PolarHBondContact N-O 3.44Å; L99-E169 PolarHBondContact O-N 3.05Å; L99-F185 HydrophobicContact CD1-CE1 4.12Å; L99-F185 HydrophobicContact CD2-CE1 3.65Å; L99-F185 HydrophobicContact CD2-CZ 3.99Å; L99-L194 HydrophobicContact CB-CD1 4.48Å; L99-L194 HydrophobicContact CD2-CD1 4.45Å; L99-V197 HydrophobicContact CD2-CB 4.3Å; L99-V197 HydrophobicContact CD2-CG1 3.87Å; L99-V197 HydrophobicContact CD2-CG2 3.86Å
100	Q	93.6	Very high	83.7	Confident	54 Å²	54	43.9 Å²	43.9	25%	0.252	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	124	165.5	-53.4	-170.7	3	0	0	108.7	L166 N167 V168 V195 S196	Q100-L166 HydrophobicContact CB-CD1 4.1Å; Q100-L166 HydrophobicContact CB-CG 4.45Å; Q100-N167 VanDerWaalsContact CA-O 3.28Å; Q100-N167 WeakPolarHBondContact CA-O 3.32Å; Q100-V168 HydrophobicContact CG-CG2 4.17Å; Q100-V195 HydrophobicContact CB-CB 4.47Å; Q100-V195 WeakPolarHBondContact O-CA 3.26Å; Q100-V195 WeakPolarHBondContact O-CB 3.18Å; Q100-V195 PolarHBondContact O-N 2.94Å; Q100-S196 PolarHBondContact N-O 2.96Å; Q100-S196 PolarHBondContact O-N 3.28Å
101	F	93.6	Very high	83.7	Confident	1 Å²	1	40.5 Å²	40.5	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	160.5	-173.3	67.6	-80.2	0	0	0	112.8	L99 L103 F122 V148 A150 N167 E169 V192 A193 L194	L99-F101 HydrophobicContact CB-CD1 4.29Å; F101-L103 HydrophobicContact CD2-CB 4.43Å; F101-L103 HydrophobicContact CE2-CB 4.38Å; F101-F122 HydrophobicContact CD1-CE1 4.47Å; F101-F122 HydrophobicContact CD1-CZ 4.31Å; F101-F122 AromaticContact CD2-CE1 3.74Å; F101-F122 HydrophobicContact CD2-CE1 3.74Å; F101-F122 HydrophobicContact CD2-CZ 4.32Å; F101-F122 AromaticContact CE2-CE1 3.84Å; F101-F122 HydrophobicContact CE2-CE1 3.84Å; F101-F122 HydrophobicContact CG-CE1 4.08Å; F101-F122 HydrophobicContact CG-CZ 4.19Å; F101-F122 HydrophobicContact CZ-CE1 4.28Å; F101-V148 HydrophobicContact CD1-CG1 4.36Å; F101-V148 HydrophobicContact CE1-CG1 3.53Å; F101-V148 HydrophobicContact CE2-CG1 4.18Å; F101-V148 HydrophobicContact CZ-CG1 3.42Å; F101-V148 VanDerWaalsContact CZ-CG1 3.42Å; F101-A150 HydrophobicContact CE2-CB 3.98Å; F101-A150 HydrophobicContact CZ-CB 4.47Å; F101-N167 HydrophobicContact CD1-CB 4.24Å; F101-N167 HydrophobicContact CD2-CB 4.42Å; F101-N167 HydrophobicContact CE1-CB 3.83Å; F101-N167 HydrophobicContact CE2-CB 4.04Å; F101-N167 HydrophobicContact CZ-CB 3.71Å; F101-N167 PolarHBondContact N-O 2.96Å; F101-N167 PolarHBondContact O-N 2.99Å; F101-N167 PolarHBondContact O-ND2 3.24Å; F101-E169 HydrophobicContact CE1-CB 4.03Å; F101-V192 HydrophobicContact CB-CG2 4.49Å; F101-V192 HydrophobicContact CD2-CG2 4.34Å; F101-A193 CarbonylContact C-O 3.41Å; F101-A193 WeakPolarHBondContact CA-O 3.18Å; F101-A193 WeakPolarHBondContact CB-O 3.24Å; F101-L194 HydrophobicContact CB-CD1 4.19Å
102	T	91.2	Very high	83.1	Confident	18 Å²	18	38.5 Å²	38.5	11%	0.11	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	145.6	171	69.7	0	0	0	0	109.2	K165 L166 V192 A193 V195	T102-K165 WeakPolarHBondContact CG2-O 3.4Å; T102-L166 HydrophobicContact CG2-CD1 4.21Å; T102-V192 WeakPolarHBondContact O-CA 3Å; T102-A193 PolarHBondContact N-O 3.02Å; T102-A193 PolarHBondContact O-N 2.99Å; T102-V195 HydrophobicContact CG2-CG2 4.21Å
103	L	91.2	Very high	82.4	Confident	2 Å²	2	43 Å²	43	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	133.6	-178.6	-168.5	142.1	0	0	0	110.1	F101 E120 A150 S153 F154	F101-L103 HydrophobicContact CD2-CB 4.43Å; F101-L103 HydrophobicContact CE2-CB 4.38Å; L103-E120 VanDerWaalsContact CD1-O 3.23Å; L103-E120 WeakPolarHBondContact CD1-O 3.46Å; L103-E120 HydrophobicContact CD2-CB 3.82Å; L103-E120 HydrophobicContact CD2-CG 4.14Å; L103-A150 HydrophobicContact CB-CB 3.77Å; L103-A150 HydrophobicContact CD1-CB 4.41Å; L103-A150 HydrophobicContact CD2-CB 4.35Å; L103-A150 HydrophobicContact CG-CB 4.39Å; L103-S153 VanDerWaalsContact O-CA 3.29Å; L103-S153 WeakPolarHBondContact O-CA 3.24Å; L103-F154 VanDerWaalsContact C-CE1 3.49Å; L103-F154 WeakPolarHBondContact O-CD1 3.34Å; L103-F154 WeakPolarHBondContact O-CE1 3.46Å; L103-F154 PolarHBondContact O-N 2.82Å
104	R	87.9	Confident	81.6	Confident	40 Å²	40	42.8 Å²	42.8	15%	0.151	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-92	134.7	-180	-173.7	174.6	176.5	172.3	0	111.2	C106 S108 F109 F154 C191	R104-C106 PolarHBondContact O-N 3.41Å; R104-S108 VanDerWaalsContact CG-OG 3.27Å; R104-S108 WeakPolarHBondContact CG-OG 3.44Å; R104-S108 PolarHBondContact NE-OG 3.3Å; R104-S108 PolarHBondContact NH2-O 2.91Å; R104-F109 HydrophobicContact CG-CE2 4.39Å; R104-F109 HydrophobicContact CG-CZ 4.44Å; R104-F154 HydrophobicContact CB-CD2 4.45Å; R104-F154 HydrophobicContact CB-CE1 4.02Å; R104-F154 HydrophobicContact CB-CE2 3.82Å; R104-F154 HydrophobicContact CB-CZ 3.58Å; R104-F154 HydrophobicContact CG-CD2 4.28Å; R104-F154 HydrophobicContact CG-CE2 3.79Å; R104-F154 HydrophobicContact CG-CZ 4.1Å; R104-C191 HydrophobicContact CB-CB 4.01Å; R104-C191 PolarHBondContact N-O 3.16Å
105	D	86.3	Confident	80.7	Confident	32 Å²	32	39.9 Å²	39.9	17%	0.171	26%	0.264	C	S	.	.			trans	-63.5	129.3	174.6	179.3	-20.1	0	0	0	110.7	K107 S108 E120 F154 T155	D105-K107 PolarHBondContact O-N 3.49Å; D105-K107 VanDerWaalsContact OD1-CB 3.29Å; D105-K107 WeakPolarHBondContact OD1-CB 3.42Å; D105-K107 PolarHBondContact OD1-N 3.04Å; D105-S108 VanDerWaalsContact O-CB 3.27Å; D105-S108 WeakPolarHBondContact O-CB 3.31Å; D105-S108 PolarHBondContact O-N 2.87Å; D105-S108 PolarHBondContact O-OG 2.86Å; D105-E120 WeakPolarHBondContact CA-OE1 3.37Å; D105-F154 PolarHBondContact N-O 2.94Å; D105-F154 VanDerWaalsContact N-O 3.07Å; D105-T155 HydrophobicContact CB-CG2 4.39Å
106	C	84.6	Confident	79.6	Confident	20 Å²	20	48.5 Å²	48.5	14%	0.135	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-62.8	-26.9	-179.5	-75.8	0	0	0	0	113.5	R104 S108 F109 G114 C118 E120	R104-C106 PolarHBondContact O-N 3.41Å; C106-S108 PolarHBondContact O-N 3.25Å; C106-F109 WeakPolarHBondContact O-CD2 3.31Å; C106-G114 WeakPolarHBondContact O-CA 3.39Å; C106-C118 VanDerWaalsContact CA-SG 3.53Å; C106-C118 HydrophobicContact CB-CB 3.88Å; C106-C118 WeakPolarHBondContact CB-SG 3.19Å; C106-C118 WeakPolarHBondContact SG-CB 3.37Å; C106-C118 CovalentContact SG-SG 2.04Å; C106-C118 PolarHBondContact SG-SG 3.36Å; C106-E120 HydrophobicContact CB-CG 4.33Å; C106-E120 PolarHBondContact N-OE1 2.7Å
107	K	82.2	Confident	78.7	Confident	173 Å²	173	49.8 Å²	49.8	75%	0.752	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-74.5	-13.3	175.8	-62	174	-177.5	167.3	0	112.9	D105 F109	D105-K107 PolarHBondContact O-N 3.49Å; D105-K107 VanDerWaalsContact OD1-CB 3.29Å; D105-K107 WeakPolarHBondContact OD1-CB 3.42Å; D105-K107 PolarHBondContact OD1-N 3.04Å; K107-F109 VanDerWaalsContact C-N 3.3Å; K107-F109 PolarHBondContact O-N 3.12Å
108	S	79.3	Confident	78.2	Confident	13 Å²	13	51.3 Å²	51.3	9%	0.091	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-83.2	-1.3	-178	78.6	0	0	0	0	114.5	R104 D105 C106	R104-S108 VanDerWaalsContact CG-OG 3.27Å; R104-S108 WeakPolarHBondContact CG-OG 3.44Å; R104-S108 PolarHBondContact NE-OG 3.3Å; R104-S108 PolarHBondContact NH2-O 2.91Å; D105-S108 VanDerWaalsContact O-CB 3.27Å; D105-S108 WeakPolarHBondContact O-CB 3.31Å; D105-S108 PolarHBondContact O-N 2.87Å; D105-S108 PolarHBondContact O-OG 2.86Å; C106-S108 PolarHBondContact O-N 3.25Å
109	F	78.3	Confident	77.8	Confident	13 Å²	13	54.3 Å²	54.3	6%	0.057	35%	0.353	C	S	.	.	S	Bend	trans	-81.8	149.5	175.7	-73	-80.4	0	0	0	111.9	V71 R104 C106 K107 G111 P115 C191	V71-F109 HydrophobicContact CB-CE1 4.23Å; V71-F109 HydrophobicContact CG1-CD1 3.53Å; V71-F109 HydrophobicContact CG1-CE1 3.43Å; V71-F109 VanDerWaalsContact CG1-CE1 3.43Å; V71-F109 HydrophobicContact CG1-CZ 4.36Å; V71-F109 HydrophobicContact CG2-CE1 3.61Å; V71-F109 HydrophobicContact CG2-CZ 4.1Å; R104-F109 HydrophobicContact CG-CE2 4.39Å; R104-F109 HydrophobicContact CG-CZ 4.44Å; C106-F109 WeakPolarHBondContact O-CD2 3.31Å; K107-F109 VanDerWaalsContact C-N 3.3Å; K107-F109 PolarHBondContact O-N 3.12Å; F109-G111 PolarHBondContact O-N 3.24Å; F109-P115 HydrophobicContact CB-CG 4.04Å; F109-P115 HydrophobicContact CD1-CG 4.24Å; F109-P115 HydrophobicContact CD2-CG 3.86Å; F109-P115 HydrophobicContact CE2-CG 4.37Å; F109-P115 HydrophobicContact CG-CG 3.78Å; F109-C191 HydrophobicContact CE2-CB 4.43Å; F109-C191 HydrophobicContact CZ-CB 3.9Å
110	P	67.8	Low	77.5	Confident	122 Å²	122	58.3 Å²	58.3	79%	0.792	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	127.1	179	-12	25.2	0	0	0	110.6
111	G	63.3	Low	77.4	Confident	77 Å²	77	57.9 Å²	57.9	79%	0.794	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	125.4	-1.8	177.6	0	0	0	0	0	116.4	F109 A113	F109-G111 PolarHBondContact O-N 3.24Å; G111-A113 PolarHBondContact O-N 2.94Å
112	G	53.1	Low	77.4	Confident	74 Å²	74	57.9 Å²	57.9	76%	0.763	37%	0.373	S	S	*	.	S	Bend	trans	73.7	-23.6	167.6	0	0	0	0	0	116.9
113	A	54.2	Low	77.6	Confident	97 Å²	97	57.9 Å²	57.9	80%	0.802	37%	0.373	S	S	*	.	S	Bend	trans	-104.8	-0.2	176.6	0	0	0	0	0	114.2	G111	G111-A113 PolarHBondContact O-N 2.94Å
114	G	58.8	Low	77.9	Confident	21 Å²	21	57.8 Å²	57.8	22%	0.216	37%	0.372	C	S	.	.			trans	68.4	163.7	-170.1	0	0	0	0	0	112.8	C106 L116	C106-G114 WeakPolarHBondContact O-CA 3.39Å; G114-L116 PolarHBondContact O-N 2.68Å
115	P	65.1	Low	78.2	Confident	39 Å²	39	56.6 Å²	56.6	25%	0.253	37%	0.369	S	S	.	.			trans	-63.6	133.7	172.3	-14.4	28.8	0	0	0	109.8	V71 F109 G117 C118	V71-P115 HydrophobicContact CG1-CG 4.31Å; F109-P115 HydrophobicContact CB-CG 4.04Å; F109-P115 HydrophobicContact CD1-CG 4.24Å; F109-P115 HydrophobicContact CD2-CG 3.86Å; F109-P115 HydrophobicContact CE2-CG 4.37Å; F109-P115 HydrophobicContact CG-CG 3.78Å; P115-G117 PolarHBondContact O-N 3.12Å; P115-G117 VanDerWaalsContact O-N 3.09Å; P115-C118 HydrophobicContact CB-CB 4.33Å; P115-C118 HydrophobicContact CG-CB 4.29Å; P115-C118 WeakPolarHBondContact O-CB 3.46Å; P115-C118 PolarHBondContact O-N 3.12Å
116	L	65.2	Low	78.7	Confident	180 Å²	180	56 Å²	56	94%	0.942	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	115.2	170.9	-90.1	143.5	0	0	0	109.2	G114	G114-L116 PolarHBondContact O-N 2.68Å
117	G	71.6	Confident	79	Confident	55 Å²	55	55.5 Å²	55.5	57%	0.567	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.8	-0.8	-178.1	0	0	0	0	0	115.8	P115	P115-G117 PolarHBondContact O-N 3.12Å; P115-G117 VanDerWaalsContact O-N 3.09Å
118	C	83.4	Confident	79.4	Confident	33 Å²	33	48.7 Å²	48.7	22%	0.223	33%	0.331	C	S	.	.			trans	-63.7	133.2	175.3	-173.4	0	0	0	0	111.9	C106 P115 G189	C106-C118 VanDerWaalsContact CA-SG 3.53Å; C106-C118 HydrophobicContact CB-CB 3.88Å; C106-C118 WeakPolarHBondContact CB-SG 3.19Å; C106-C118 WeakPolarHBondContact SG-CB 3.37Å; C106-C118 CovalentContact SG-SG 2.04Å; C106-C118 PolarHBondContact SG-SG 3.36Å; P115-C118 HydrophobicContact CB-CB 4.33Å; P115-C118 HydrophobicContact CG-CB 4.29Å; P115-C118 WeakPolarHBondContact O-CB 3.46Å; P115-C118 PolarHBondContact O-N 3.12Å; C118-G189 WeakPolarHBondContact CA-O 3.48Å
119	K	87.3	Confident	79.5	Confident	77 Å²	77	48.5 Å²	48.5	34%	0.335	33%	0.33	S	S	.	.	B	Isolated β-bridge	trans	-123.6	157.1	175.9	-67.3	177.2	-175.1	156.1	0	110.7	D76 P188 G189 A190	D76-K119 IonicContact OD1-NZ 2.93Å; K119-P188 HydrophobicContact CD-CB 3.98Å; K119-P188 HydrophobicContact CD-CG 3.75Å; K119-P188 WeakPolarHBondContact CD-O 3.33Å; K119-P188 PolarHBondContact NZ-O 2.81Å; K119-P188 VanDerWaalsContact NZ-O 3.14Å; K119-G189 PolarHBondContact N-O 3.09Å; K119-A190 WeakPolarHBondContact O-CA 3.43Å; K119-A190 WeakPolarHBondContact O-CB 3.43Å
120	E	89.1	Confident	79.5	Confident	83 Å²	83	51.8 Å²	51.8	39%	0.388	35%	0.348	S	S	.	.	S	Bend	trans	-111.8	23.5	177.7	-62	-179.8	151.1	0	0	111.9	L103 D105 C106	L103-E120 VanDerWaalsContact CD1-O 3.23Å; L103-E120 WeakPolarHBondContact CD1-O 3.46Å; L103-E120 HydrophobicContact CD2-CB 3.82Å; L103-E120 HydrophobicContact CD2-CG 4.14Å; D105-E120 WeakPolarHBondContact CA-OE1 3.37Å; C106-E120 HydrophobicContact CB-CG 4.33Å; C106-E120 PolarHBondContact N-OE1 2.7Å
121	T	91.6	Very high	79.7	Confident	46 Å²	46	52.7 Å²	52.7	28%	0.282	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	151	-179.3	59.9	0	0	0	0	111.4	T147 V148 A149	T121-T147 HydrophobicContact CG2-CG2 4.03Å; T121-V148 VanDerWaalsContact CA-O 3.24Å; T121-V148 WeakPolarHBondContact CA-O 2.82Å; T121-V148 WeakPolarHBondContact CB-O 3.44Å; T121-A149 HydrophobicContact CG2-CB 3.83Å
122	F	94.3	Very high	80	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	167.8	168.7	66.5	-82.3	0	0	0	109.4	L99 F101 V148 F185 V192	L99-F122 HydrophobicContact CD1-CE2 4.2Å; L99-F122 HydrophobicContact CD1-CZ 4.26Å; F101-F122 HydrophobicContact CD1-CE1 4.47Å; F101-F122 HydrophobicContact CD1-CZ 4.31Å; F101-F122 AromaticContact CD2-CE1 3.74Å; F101-F122 HydrophobicContact CD2-CE1 3.74Å; F101-F122 HydrophobicContact CD2-CZ 4.32Å; F101-F122 AromaticContact CE2-CE1 3.84Å; F101-F122 HydrophobicContact CE2-CE1 3.84Å; F101-F122 HydrophobicContact CG-CE1 4.08Å; F101-F122 HydrophobicContact CG-CZ 4.19Å; F101-F122 HydrophobicContact CZ-CE1 4.28Å; F122-V148 HydrophobicContact CD1-CB 4.16Å; F122-V148 HydrophobicContact CD1-CG1 4.42Å; F122-V148 HydrophobicContact CD2-CB 4.31Å; F122-V148 HydrophobicContact CD2-CG2 4.5Å; F122-V148 HydrophobicContact CE1-CB 3.74Å; F122-V148 HydrophobicContact CE1-CG1 3.57Å; F122-V148 HydrophobicContact CE2-CB 3.89Å; F122-V148 HydrophobicContact CE2-CG1 4.23Å; F122-V148 HydrophobicContact CE2-CG2 3.95Å; F122-V148 HydrophobicContact CG-CB 4.43Å; F122-V148 HydrophobicContact CZ-CB 3.6Å; F122-V148 HydrophobicContact CZ-CG1 3.47Å; F122-V148 VanDerWaalsContact CZ-CG1 3.47Å; F122-V148 HydrophobicContact CZ-CG2 4.04Å; F122-V148 PolarHBondContact N-O 3.37Å; F122-V148 VanDerWaalsContact N-O 3.12Å; F122-V148 PolarHBondContact O-N 3.46Å; F122-F185 HydrophobicContact CD2-CD1 4.36Å; F122-F185 AromaticContact CE2-CD1 3.96Å; F122-F185 HydrophobicContact CE2-CD1 3.96Å; F122-V192 HydrophobicContact CD1-CG2 3.97Å; F122-V192 HydrophobicContact CE1-CG2 3.92Å
123	N	95.6	Very high	80.6	Confident	19 Å²	19	51.2 Å²	51.2	10%	0.102	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	135.8	-177.5	-57.5	-72.5	0	0	0	111.1	L125 K144 T147 F185 H186	N123-L125 HydrophobicContact CB-CD1 3.88Å; N123-K144 WeakPolarHBondContact OD1-CE 3.46Å; N123-K144 PolarHBondContact OD1-NZ 3.3Å; N123-K144 VanDerWaalsContact OD1-NZ 3.15Å; N123-T147 PolarHBondContact OD1-OG1 3.15Å; N123-F185 WeakPolarHBondContact O-CA 3.49Å; N123-H186 HydrophobicContact CB-CB 4.3Å; N123-H186 PolarHBondContact N-O 2.97Å; N123-H186 PolarHBondContact ND2-ND1 3.19Å; N123-H186 PolarHBondContact O-N 3.32Å
124	L	96.6	Very high	80.8	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	127.9	166.6	176	65.3	0	0	0	108.9	V97 L99 V145 T146 V148 C171 F185	V97-L124 HydrophobicContact CB-CD2 4.34Å; V97-L124 HydrophobicContact CG1-CD2 4.2Å; L99-L124 HydrophobicContact CD1-CD2 4.28Å; L124-V145 HydrophobicContact CB-CB 4.37Å; L124-V145 HydrophobicContact CD2-CB 4.1Å; L124-V145 HydrophobicContact CD2-CG1 4.07Å; L124-V145 HydrophobicContact CD2-CG2 4.36Å; L124-V145 HydrophobicContact CG-CB 4.02Å; L124-V145 HydrophobicContact CG-CG2 4.09Å; L124-V145 WeakPolarHBondContact O-CB 3.44Å; L124-V145 PolarHBondContact O-N 2.9Å; L124-T146 HydrophobicContact CB-CG2 4.47Å; L124-T146 PolarHBondContact N-O 3.3Å; L124-T146 PolarHBondContact O-N 3.02Å; L124-V148 HydrophobicContact CB-CG2 4.14Å; L124-C171 HydrophobicContact CD2-CB 4.25Å; L124-F185 HydrophobicContact CD1-CD1 4.11Å; L124-F185 HydrophobicContact CD1-CE1 3.59Å; L124-F185 HydrophobicContact CD1-CZ 3.98Å
125	L	95.7	Very high	80.7	Confident	15 Å²	15	51.6 Å²	51.6	8%	0.079	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	161	177.6	-55.2	96.9	0	0	0	110.7	W80 N123 F142 Q143 K144 L183 A184 H186	W80-L125 HydrophobicContact CH2-CD1 4.42Å; W80-L125 HydrophobicContact CH2-CD2 4.07Å; W80-L125 HydrophobicContact CZ3-CD1 4.21Å; W80-L125 HydrophobicContact CZ3-CD2 4.28Å; N123-L125 HydrophobicContact CB-CD1 3.88Å; L125-F142 HydrophobicContact CB-CB 4.03Å; L125-F142 HydrophobicContact CB-CD1 4.12Å; L125-F142 HydrophobicContact CD2-CB 4.05Å; L125-Q143 CarbonylContact C-O 3.57Å; L125-Q143 WeakPolarHBondContact CA-O 3.06Å; L125-Q143 WeakPolarHBondContact CB-O 3.44Å; L125-K144 HydrophobicContact CD2-CB 4.24Å; L125-K144 HydrophobicContact CG-CB 4.43Å; L125-L183 WeakPolarHBondContact O-CA 3.5Å; L125-A184 HydrophobicContact CB-CB 4.38Å; L125-A184 PolarHBondContact N-O 3.5Å; L125-A184 PolarHBondContact O-N 3.41Å; L125-H186 HydrophobicContact CD1-CB 3.69Å
126	Y	95.1	Very high	80.3	Confident	20 Å²	20	54 Å²	54	8%	0.078	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	156	173.7	80.5	-68.5	0	0	0	112.2	E128 F142 Q143 V145 L173 L176 Y182	Y126-E128 HydrophobicContact CD2-CG 4.39Å; Y126-E128 HydrophobicContact CE2-CG 4.04Å; Y126-F142 CarbonylContact O-C 3.51Å; Y126-F142 WeakPolarHBondContact O-CA 3.33Å; Y126-Q143 HydrophobicContact CD1-CB 4.07Å; Y126-Q143 HydrophobicContact CE1-CB 3.67Å; Y126-Q143 PolarHBondContact N-O 3.28Å; Y126-Q143 PolarHBondContact O-N 2.96Å; Y126-Q143 PolarHBondContact OH-OE1 3.41Å; Y126-V145 HydrophobicContact CD1-CG2 3.47Å; Y126-V145 VanDerWaalsContact CD1-CG2 3.47Å; Y126-V145 HydrophobicContact CE1-CG2 4.21Å; Y126-V145 HydrophobicContact CG-CG2 4.26Å; Y126-L173 HydrophobicContact CD1-CD2 4.33Å; Y126-L173 HydrophobicContact CG-CD2 4.3Å; Y126-L176 HydrophobicContact CD2-CD2 4.04Å; Y126-L176 HydrophobicContact CE2-CD2 3.54Å; Y126-Y182 CarbonylContact C-O 3.57Å; Y126-Y182 WeakPolarHBondContact CA-O 3.24Å; Y126-Y182 WeakPolarHBondContact CB-O 3.44Å
127	M	92.1	Very high	80.7	Confident	9 Å²	9	47.1 Å²	47.1	4%	0.044	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	127.9	174.3	-179.8	-170.3	72.7	0	0	109.6	V133 R138 L141 F142 L181 Y182	M127-V133 HydrophobicContact CE-CG2 4.1Å; M127-R138 HydrophobicContact SD-CB 4.32Å; M127-L141 HydrophobicContact CG-CB 3.88Å; M127-L141 HydrophobicContact SD-CB 3.46Å; M127-L141 WeakPolarHBondContact SD-CB 3.38Å; M127-L141 HydrophobicContact SD-CD1 3.9Å; M127-L141 HydrophobicContact SD-CG 4.33Å; M127-F142 HydrophobicContact CB-CD1 3.77Å; M127-F142 HydrophobicContact CB-CD2 4.15Å; M127-F142 HydrophobicContact CB-CE1 3.69Å; M127-F142 HydrophobicContact CB-CE2 4.08Å; M127-F142 HydrophobicContact CB-CG 4Å; M127-F142 HydrophobicContact CB-CZ 3.84Å; M127-F142 HydrophobicContact CE-CE2 4.42Å; M127-F142 HydrophobicContact CE-CZ 4.4Å; M127-F142 HydrophobicContact SD-CD2 4.4Å; M127-F142 HydrophobicContact SD-CE2 4.06Å; M127-F142 HydrophobicContact SD-CZ 4.47Å; M127-L181 CarbonylContact O-C 3.56Å; M127-L181 WeakPolarHBondContact O-CA 3.41Å; M127-Y182 HydrophobicContact CE-CD2 3.43Å; M127-Y182 VanDerWaalsContact CE-CD2 3.43Å; M127-Y182 HydrophobicContact CE-CE2 3.84Å; M127-Y182 HydrophobicContact CE-CG 4.31Å; M127-Y182 PolarHBondContact N-O 2.78Å; M127-Y182 PolarHBondContact O-N 2.88Å
128	E	89.9	Confident	81.1	Confident	29 Å²	29	49.7 Å²	49.7	14%	0.136	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	138.4	175.1	-70.8	-171.2	-96	0	0	112.3	Y126 L176 T177 R178	Y126-E128 HydrophobicContact CD2-CG 4.39Å; Y126-E128 HydrophobicContact CE2-CG 4.04Å; E128-L176 HydrophobicContact CG-CD2 3.85Å; E128-L176 WeakPolarHBondContact OE2-CA 3.3Å; E128-T177 PolarHBondContact OE2-N 3.47Å; E128-T177 PolarHBondContact OE2-OG1 3.34Å; E128-R178 HydrophobicContact CB-CB 3.97Å; E128-R178 HydrophobicContact CB-CG 3.92Å; E128-R178 PolarHBondContact O-NH1 3.07Å; E128-R178 PolarHBondContact OE2-N 3.5Å
129	S	82.4	Confident	81.2	Confident	10 Å²	10	52.2 Å²	52.2	7%	0.07	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	140.4	175.9	-171	0	0	0	0	111.6	W85 Q131 G180	W85-S129 PolarHBondContact NE1-O 3.38Å; S129-Q131 VanDerWaalsContact C-N 3.28Å; S129-Q131 WeakPolarHBondContact CB-O 3.49Å; S129-Q131 PolarHBondContact OG-N 3.12Å; S129-Q131 PolarHBondContact OG-O 3.06Å; S129-G180 PolarHBondContact N-O 3.5Å; S129-G180 CarbonylContact O-C 3.6Å; S129-G180 PolarHBondContact O-N 2.9Å
130	D	76.7	Confident	81.2	Confident	82 Å²	82	54.5 Å²	54.5	44%	0.439	28%	0.278	S	S	.	.	S	Bend	trans	-77	-17.5	176.5	-66.3	-56.3	0	0	0	113.3	R178 R179	D130-R178 WeakPolarHBondContact OD1-CA 3.37Å; D130-R178 VanDerWaalsContact OD1-CB 3.31Å; D130-R178 WeakPolarHBondContact OD1-CB 3.37Å; D130-R178 IonicContact OD2-NE 3.23Å; D130-R179 PolarHBondContact OD1-N 3.46Å; D130-R179 VanDerWaalsContact OD1-N 3.1Å
131	Q	73.6	Confident	81.2	Confident	141 Å²	141	55 Å²	55	66%	0.659	28%	0.283	S	S	*	.	S	Bend	trans	-141.7	159.7	-180	64.7	-170.9	15.9	0	0	111.8	S129 V133	S129-Q131 VanDerWaalsContact C-N 3.28Å; S129-Q131 WeakPolarHBondContact CB-O 3.49Å; S129-Q131 PolarHBondContact OG-N 3.12Å; S129-Q131 PolarHBondContact OG-O 3.06Å; Q131-V133 PolarHBondContact O-N 3.39Å
132	D	68.9	Low	81.2	Confident	96 Å²	96	53.6 Å²	53.6	51%	0.513	27%	0.273	S	S	.	.			trans	-69.5	114.7	173.7	-169.3	-12.4	0	0	0	109.8	W85 G134 Y182	W85-D132 HydrophobicContact CB-CB 3.92Å; W85-D132 HydrophobicContact CD2-CB 4.28Å; W85-D132 HydrophobicContact CG-CB 4.06Å; D132-G134 VanDerWaalsContact C-N 3.26Å; D132-G134 PolarHBondContact O-N 2.67Å; D132-G134 PolarHBondContact OD1-N 3Å; D132-Y182 VanDerWaalsContact CA-OH 3.25Å; D132-Y182 WeakPolarHBondContact CA-OH 3.4Å; D132-Y182 PolarHBondContact OD1-OH 3.36Å
133	V	66.1	Low	81.1	Confident	23 Å²	23	58.3 Å²	58.3	14%	0.139	30%	0.295	C	S	.	.			trans	-84.7	9.5	178.4	-54.5	0	0	0	0	113.5	M127 Q131 Y182	M127-V133 HydrophobicContact CE-CG2 4.1Å; Q131-V133 PolarHBondContact O-N 3.39Å; V133-Y182 HydrophobicContact CG2-CE2 3.67Å; V133-Y182 PolarHBondContact N-OH 2.98Å
134	G	58.1	Low	81.1	Confident	20 Å²	20	63.3 Å²	63.3	21%	0.206	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	-137.8	172.3	0	0	0	0	0	113.1	R82 D132 Q136	R82-G134 PolarHBondContact NH1-O 3.06Å; R82-G134 PolarHBondContact NH2-O 3.01Å; D132-G134 VanDerWaalsContact C-N 3.26Å; D132-G134 PolarHBondContact O-N 2.67Å; D132-G134 PolarHBondContact OD1-N 3Å; G134-Q136 PolarHBondContact O-N 3.23Å
135	I	57.4	Low	80.9	Confident	106 Å²	106	65.1 Å²	65.1	54%	0.544	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	5	-173.6	62.6	163.7	0	0	0	114.8	L43 L137 L907	L43-I135 HydrophobicContact CD1-CB 4.27Å; L43-I135 WeakPolarHBondContact CD2-O 3.36Å; I135-L137 PolarHBondContact O-N 3.33Å; I135-L907 WeakPolarHBondContact CD1-O 3.43Å
136	Q	56.5	Low	80.9	Confident	91 Å²	91	66.6 Å²	66.6	43%	0.425	34%	0.336	S	S	.	.			trans	-77	120.7	179.5	-67.7	-176.6	-4.3	0	0	111.3	R82 G134 R138	R82-Q136 PolarHBondContact NH1-O 3.4Å; G134-Q136 PolarHBondContact O-N 3.23Å; Q136-R138 HydrophobicContact CB-CG 4.43Å; Q136-R138 PolarHBondContact O-N 2.88Å
137	L	72.3	Confident	80.9	Confident	35 Å²	35	68.3 Å²	68.3	18%	0.183	35%	0.349	C	S	.	.			trans	-90	92.1	170.4	-171.7	68.4	0	0	0	110.7	L43 D45 W80 R82 I135 R139 F142	L43-L137 HydrophobicContact CD2-CB 3.95Å; D45-L137 HydrophobicContact CB-CD2 3.67Å; D45-L137 VanDerWaalsContact OD2-CD2 3.32Å; D45-L137 WeakPolarHBondContact OD2-CD2 3.44Å; W80-L137 HydrophobicContact CB-CD2 3.56Å; W80-L137 HydrophobicContact CD2-CD2 4.21Å; W80-L137 HydrophobicContact CE3-CD2 4.38Å; W80-L137 HydrophobicContact CG-CD2 3.88Å; R82-L137 HydrophobicContact CB-CD1 3.76Å; R82-L137 HydrophobicContact CG-CD1 4.04Å; I135-L137 PolarHBondContact O-N 3.33Å; L137-R139 VanDerWaalsContact C-N 3.3Å; L137-R139 HydrophobicContact CD2-CG 3.91Å; L137-R139 HydrophobicContact CG-CG 3.91Å; L137-R139 PolarHBondContact O-N 3.27Å; L137-F142 HydrophobicContact CD1-CE2 4.02Å; L137-F142 HydrophobicContact CD1-CZ 4.38Å
138	R	80.1	Confident	81	Confident	108 Å²	108	68 Å²	68	41%	0.408	35%	0.347	S	S	.	.			trans	-82.5	67.8	179.7	-60.6	-177.7	-177.3	177.5	0.3	111.9	M127 Q136 P140 L141 F142	M127-R138 HydrophobicContact SD-CB 4.32Å; Q136-R138 HydrophobicContact CB-CG 4.43Å; Q136-R138 PolarHBondContact O-N 2.88Å; R138-P140 VanDerWaalsContact O-N 3.12Å; R138-L141 HydrophobicContact CB-CB 4.37Å; R138-L141 HydrophobicContact CB-CD1 3.73Å; R138-L141 HydrophobicContact CB-CG 4.09Å; R138-L141 HydrophobicContact CG-CD1 4.3Å; R138-L141 WeakPolarHBondContact O-CB 3.42Å; R138-L141 PolarHBondContact O-N 2.93Å; R138-F142 WeakPolarHBondContact O-CD2 3.4Å
139	R	85.3	Confident	81.1	Confident	86 Å²	86	69 Å²	69	33%	0.325	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-45	-44.1	-172.2	-56.3	-179.3	-175.9	-171.6	-4.1	115.4	D45 D78 W80 L137 L141 F142	D45-R139 IonicContact OD2-CZ 2.9Å; D45-R139 IonicContact OD2-NE 3.77Å; D45-R139 PolarHBondContact OD2-NE 3.38Å; D45-R139 IonicContact OD2-NH2 3.98Å; D45-R139 PolarHBondContact OD2-NH2 2.92Å; D78-R139 IonicContact OD1-NH1 3.59Å; D78-R139 IonicContact OD2-CZ 2.88Å; D78-R139 IonicContact OD2-NH1 3.37Å; D78-R139 PolarHBondContact OD2-NH1 3.37Å; D78-R139 IonicContact OD2-NH2 2.77Å; W80-R139 HydrophobicContact CD2-CG 4.47Å; W80-R139 HydrophobicContact CH2-CB 4.39Å; W80-R139 HydrophobicContact CZ2-CB 4.43Å; W80-R139 HydrophobicContact CZ2-CG 4.45Å; L137-R139 VanDerWaalsContact C-N 3.3Å; L137-R139 HydrophobicContact CD2-CG 3.91Å; L137-R139 HydrophobicContact CG-CG 3.91Å; L137-R139 PolarHBondContact O-N 3.27Å; R139-L141 PolarHBondContact O-N 3.33Å; R139-F142 PolarHBondContact O-N 3.09Å
140	P	88.1	Confident	81.3	Confident	125 Å²	125	69.8 Å²	69.8	81%	0.812	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-66.4	-17.6	-178.6	-21.7	34.7	0	0	0	115.2	R138	R138-P140 VanDerWaalsContact O-N 3.12Å
141	L	87.9	Confident	81.7	Confident	94 Å²	94	72.6 Å²	72.6	49%	0.492	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-87.2	-11.2	-179.5	-59.5	-177.7	0	0	0	112.7	M127 R138 R139	M127-L141 HydrophobicContact CG-CB 3.88Å; M127-L141 HydrophobicContact SD-CB 3.46Å; M127-L141 WeakPolarHBondContact SD-CB 3.38Å; M127-L141 HydrophobicContact SD-CD1 3.9Å; M127-L141 HydrophobicContact SD-CG 4.33Å; R138-L141 HydrophobicContact CB-CB 4.37Å; R138-L141 HydrophobicContact CB-CD1 3.73Å; R138-L141 HydrophobicContact CB-CG 4.09Å; R138-L141 HydrophobicContact CG-CD1 4.3Å; R138-L141 WeakPolarHBondContact O-CB 3.42Å; R138-L141 PolarHBondContact O-N 2.93Å; R139-L141 PolarHBondContact O-N 3.33Å
142	F	91.4	Very high	82	Confident	17 Å²	17	71.1 Å²	71.1	8%	0.075	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-78.5	123.4	178	-80.8	-91.3	0	0	0	110.9	W80 R82 L125 Y126 M127 L137 R138 R139 A184	W80-F142 HydrophobicContact CZ3-CB 4.28Å; W80-F142 HydrophobicContact CZ3-CG 4.36Å; R82-F142 HydrophobicContact CG-CE1 4.33Å; R82-F142 HydrophobicContact CG-CZ 3.8Å; L125-F142 HydrophobicContact CB-CB 4.03Å; L125-F142 HydrophobicContact CB-CD1 4.12Å; L125-F142 HydrophobicContact CD2-CB 4.05Å; Y126-F142 CarbonylContact O-C 3.51Å; Y126-F142 WeakPolarHBondContact O-CA 3.33Å; M127-F142 HydrophobicContact CB-CD1 3.77Å; M127-F142 HydrophobicContact CB-CD2 4.15Å; M127-F142 HydrophobicContact CB-CE1 3.69Å; M127-F142 HydrophobicContact CB-CE2 4.08Å; M127-F142 HydrophobicContact CB-CG 4Å; M127-F142 HydrophobicContact CB-CZ 3.84Å; M127-F142 HydrophobicContact CE-CE2 4.42Å; M127-F142 HydrophobicContact CE-CZ 4.4Å; M127-F142 HydrophobicContact SD-CD2 4.4Å; M127-F142 HydrophobicContact SD-CE2 4.06Å; M127-F142 HydrophobicContact SD-CZ 4.47Å; L137-F142 HydrophobicContact CD1-CE2 4.02Å; L137-F142 HydrophobicContact CD1-CZ 4.38Å; R138-F142 WeakPolarHBondContact O-CD2 3.4Å; R139-F142 PolarHBondContact O-N 3.09Å; F142-A184 HydrophobicContact CD1-CB 3.52Å; F142-A184 HydrophobicContact CE1-CB 3.41Å; F142-A184 VanDerWaalsContact CE1-CB 3.41Å; F142-A184 HydrophobicContact CG-CB 4.26Å; F142-A184 HydrophobicContact CZ-CB 4.07Å
143	Q	93.3	Very high	82.7	Confident	98 Å²	98	68.7 Å²	68.7	46%	0.458	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	133.9	174.1	-61.6	178.1	33.4	0	0	109.5	L125 Y126 V145	L125-Q143 CarbonylContact C-O 3.57Å; L125-Q143 WeakPolarHBondContact CA-O 3.06Å; L125-Q143 WeakPolarHBondContact CB-O 3.44Å; Y126-Q143 HydrophobicContact CD1-CB 4.07Å; Y126-Q143 HydrophobicContact CE1-CB 3.67Å; Y126-Q143 PolarHBondContact N-O 3.28Å; Y126-Q143 PolarHBondContact O-N 2.96Å; Y126-Q143 PolarHBondContact OH-OE1 3.41Å; Q143-V145 PolarHBondContact O-N 3.12Å
144	K	94.5	Very high	83.4	Confident	124 Å²	124	68.6 Å²	68.6	54%	0.539	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	124.6	178.1	-174.6	175.7	176.3	177.6	0	110.4	N123 L125 T147	N123-K144 WeakPolarHBondContact OD1-CE 3.46Å; N123-K144 PolarHBondContact OD1-NZ 3.3Å; N123-K144 VanDerWaalsContact OD1-NZ 3.15Å; L125-K144 HydrophobicContact CD2-CB 4.24Å; L125-K144 HydrophobicContact CG-CB 4.43Å; K144-T147 WeakPolarHBondContact CE-OG1 3.23Å; K144-T147 PolarHBondContact NZ-OG1 3.23Å
145	V	93.9	Very high	84.3	Confident	39 Å²	39	69.6 Å²	69.6	24%	0.236	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-59.3	173.9	-177.2	0	0	0	0	109.4	L124 Y126 Q143 C171 L173	L124-V145 HydrophobicContact CB-CB 4.37Å; L124-V145 HydrophobicContact CD2-CB 4.1Å; L124-V145 HydrophobicContact CD2-CG1 4.07Å; L124-V145 HydrophobicContact CD2-CG2 4.36Å; L124-V145 HydrophobicContact CG-CB 4.02Å; L124-V145 HydrophobicContact CG-CG2 4.09Å; L124-V145 WeakPolarHBondContact O-CB 3.44Å; L124-V145 PolarHBondContact O-N 2.9Å; Y126-V145 HydrophobicContact CD1-CG2 3.47Å; Y126-V145 VanDerWaalsContact CD1-CG2 3.47Å; Y126-V145 HydrophobicContact CE1-CG2 4.21Å; Y126-V145 HydrophobicContact CG-CG2 4.26Å; Q143-V145 PolarHBondContact O-N 3.12Å; V145-C171 HydrophobicContact CG1-CB 4Å; V145-L173 HydrophobicContact CB-CD2 4.41Å; V145-L173 HydrophobicContact CG1-CD2 3.97Å; V145-L173 HydrophobicContact CG2-CD2 3.49Å; V145-L173 VanDerWaalsContact CG2-CD2 3.49Å
146	T	94.9	Very high	85	Confident	46 Å²	46	69.2 Å²	69.2	28%	0.282	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	166.1	-179.7	-168	0	0	0	0	111.3	L124 V148 C171	L124-T146 HydrophobicContact CB-CG2 4.47Å; L124-T146 PolarHBondContact N-O 3.3Å; L124-T146 PolarHBondContact O-N 3.02Å; T146-V148 HydrophobicContact CG2-CG2 3.94Å; T146-C171 VanDerWaalsContact CG2-SG 3.56Å
147	T	94.9	Very high	85.6	Confident	56 Å²	56	74.8 Å²	74.8	34%	0.344	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	118.7	163	-68.6	0	0	0	0	107.9	T121 N123 K144	T121-T147 HydrophobicContact CG2-CG2 4.03Å; N123-T147 PolarHBondContact OD1-OG1 3.15Å; K144-T147 WeakPolarHBondContact CE-OG1 3.23Å; K144-T147 PolarHBondContact NZ-OG1 3.23Å
148	V	94.6	Very high	85.7	Confident	1 Å²	1	75 Å²	75	1%	0.006	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	125.1	-177.9	-175.4	0	0	0	0	108.9	L99 F101 T121 F122 L124 T146 E169	L99-V148 HydrophobicContact CD1-CG2 3.95Å; F101-V148 HydrophobicContact CD1-CG1 4.36Å; F101-V148 HydrophobicContact CE1-CG1 3.53Å; F101-V148 HydrophobicContact CE2-CG1 4.18Å; F101-V148 HydrophobicContact CZ-CG1 3.42Å; F101-V148 VanDerWaalsContact CZ-CG1 3.42Å; T121-V148 VanDerWaalsContact CA-O 3.24Å; T121-V148 WeakPolarHBondContact CA-O 2.82Å; T121-V148 WeakPolarHBondContact CB-O 3.44Å; F122-V148 HydrophobicContact CD1-CB 4.16Å; F122-V148 HydrophobicContact CD1-CG1 4.42Å; F122-V148 HydrophobicContact CD2-CB 4.31Å; F122-V148 HydrophobicContact CD2-CG2 4.5Å; F122-V148 HydrophobicContact CE1-CB 3.74Å; F122-V148 HydrophobicContact CE1-CG1 3.57Å; F122-V148 HydrophobicContact CE2-CB 3.89Å; F122-V148 HydrophobicContact CE2-CG1 4.23Å; F122-V148 HydrophobicContact CE2-CG2 3.95Å; F122-V148 HydrophobicContact CG-CB 4.43Å; F122-V148 HydrophobicContact CZ-CB 3.6Å; F122-V148 HydrophobicContact CZ-CG1 3.47Å; F122-V148 VanDerWaalsContact CZ-CG1 3.47Å; F122-V148 HydrophobicContact CZ-CG2 4.04Å; F122-V148 PolarHBondContact N-O 3.37Å; F122-V148 VanDerWaalsContact N-O 3.12Å; F122-V148 PolarHBondContact O-N 3.46Å; L124-V148 HydrophobicContact CB-CG2 4.14Å; T146-V148 HydrophobicContact CG2-CG2 3.94Å; V148-E169 HydrophobicContact CG1-CB 4.28Å; V148-E169 HydrophobicContact CG1-CG 4.23Å
149	A	91.6	Very high	85.2	Confident	52 Å²	52	73.7 Å²	73.7	43%	0.43	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	153	174	0	0	0	0	0	109.2	T121	T121-A149 HydrophobicContact CG2-CB 3.83Å
150	A	87.7	Confident	84.1	Confident	26 Å²	26	74 Å²	74	22%	0.215	41%	0.405	C	S	.	.			trans	-84.4	135.7	174.6	0	0	0	0	0	110.9	F101 L103 Q152	F101-A150 HydrophobicContact CE2-CB 3.98Å; F101-A150 HydrophobicContact CZ-CB 4.47Å; L103-A150 HydrophobicContact CB-CB 3.77Å; L103-A150 HydrophobicContact CD1-CB 4.41Å; L103-A150 HydrophobicContact CD2-CB 4.35Å; L103-A150 HydrophobicContact CG-CB 4.39Å; A150-Q152 VanDerWaalsContact C-N 3.29Å
151	D	83.6	Confident	83.1	Confident	141 Å²	141	72 Å²	72	75%	0.754	39%	0.394	S	S	*	.	S	Bend	trans	-67.2	-35.6	166.2	-72.7	-25.5	0	0	0	111	N167	D151-N167 PolarHBondContact N-OD1 3.29Å; D151-N167 VanDerWaalsContact N-OD1 3.08Å
152	Q	81.4	Confident	81.9	Confident	110 Å²	110	70.5 Å²	70.5	51%	0.514	40%	0.401	S	S	.	.	S	Bend	trans	-133.9	116.6	178.2	-62	-175.6	12.9	0	0	110.5	A150 K165 N167	A150-Q152 VanDerWaalsContact C-N 3.29Å; Q152-K165 HydrophobicContact CB-CB 4.08Å; Q152-K165 HydrophobicContact CB-CG 4.29Å; Q152-N167 PolarHBondContact N-OD1 3.05Å; Q152-N167 PolarHBondContact O-ND2 3.13Å; Q152-N167 PolarHBondContact O-OD1 3.29Å
153	S	83.9	Confident	80.6	Confident	45 Å²	45	71.8 Å²	71.8	32%	0.315	41%	0.412	S	S	.	.			trans	-91.7	150.3	169.2	54.9	0	0	0	0	111.1	L103	L103-S153 VanDerWaalsContact O-CA 3.29Å; L103-S153 WeakPolarHBondContact O-CA 3.24Å
154	F	79.3	Confident	79.5	Confident	21 Å²	21	72 Å²	72	9%	0.092	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-98.7	146.6	175.3	69	-93.8	0	0	0	112	L103 R104 D105 D158 L159	L103-F154 VanDerWaalsContact C-CE1 3.49Å; L103-F154 WeakPolarHBondContact O-CD1 3.34Å; L103-F154 WeakPolarHBondContact O-CE1 3.46Å; L103-F154 PolarHBondContact O-N 2.82Å; R104-F154 HydrophobicContact CB-CD2 4.45Å; R104-F154 HydrophobicContact CB-CE1 4.02Å; R104-F154 HydrophobicContact CB-CE2 3.82Å; R104-F154 HydrophobicContact CB-CZ 3.58Å; R104-F154 HydrophobicContact CG-CD2 4.28Å; R104-F154 HydrophobicContact CG-CE2 3.79Å; R104-F154 HydrophobicContact CG-CZ 4.1Å; D105-F154 PolarHBondContact N-O 2.94Å; D105-F154 VanDerWaalsContact N-O 3.07Å; F154-D158 HydrophobicContact CB-CB 4.06Å; F154-L159 HydrophobicContact CE2-CD1 4.33Å
155	T	78.4	Confident	78.8	Confident	40 Å²	40	70 Å²	70	25%	0.245	41%	0.405	C	S	.	.			trans	-107.2	176.9	-179.9	70.7	0	0	0	0	112.1	D105 R157 D158 L159	D105-T155 HydrophobicContact CB-CG2 4.39Å; T155-R157 PolarHBondContact O-N 2.81Å; T155-R157 PolarHBondContact OG1-N 2.62Å; T155-D158 WeakPolarHBondContact CB-OD2 3.45Å; T155-D158 PolarHBondContact N-OD2 3.25Å; T155-D158 PolarHBondContact O-N 2.88Å; T155-D158 PolarHBondContact OG1-OD2 2.94Å; T155-L159 PolarHBondContact O-N 3.39Å
156	I	70.8	Confident	78.4	Confident	98 Å²	98	72.4 Å²	72.4	50%	0.503	42%	0.416	S	S	.	.	H	α-helix	trans	-61.3	-28.3	174.6	-160.9	171.9	0	0	0	112.5	A160	I156-A160 PolarHBondContact O-N 3.06Å
157	R	70.3	Confident	78.3	Confident	208 Å²	208	70.6 Å²	70.6	79%	0.785	41%	0.405	S	S	*	.	H	α-helix	trans	-70.4	-42.8	176.2	-67	-176.7	178.9	-175.5	0.1	110.9	T155 L159 A160 S161	T155-R157 PolarHBondContact O-N 2.81Å; T155-R157 PolarHBondContact OG1-N 2.62Å; R157-L159 VanDerWaalsContact C-N 3.3Å; R157-L159 PolarHBondContact O-N 2.9Å; R157-A160 WeakPolarHBondContact O-CB 3.45Å; R157-A160 PolarHBondContact O-N 3.01Å; R157-A160 VanDerWaalsContact O-N 3.14Å; R157-S161 PolarHBondContact O-N 3.02Å; R157-S161 PolarHBondContact O-OG 3.36Å; R157-S161 VanDerWaalsContact O-OG 3.1Å
158	D	74.8	Confident	78.1	Confident	39 Å²	39	71.2 Å²	71.2	21%	0.209	41%	0.408	C	S	.	.	H	α-helix	trans	-66.3	-34.6	178	-56.9	-59.7	0	0	0	112.1	F154 T155 A160 S161 G162 S163	F154-D158 HydrophobicContact CB-CB 4.06Å; T155-D158 WeakPolarHBondContact CB-OD2 3.45Å; T155-D158 PolarHBondContact N-OD2 3.25Å; T155-D158 PolarHBondContact O-N 2.88Å; T155-D158 PolarHBondContact OG1-OD2 2.94Å; D158-A160 VanDerWaalsContact C-N 3.34Å; D158-S161 WeakPolarHBondContact CA-OG 2.99Å; D158-S161 PolarHBondContact O-N 3.29Å; D158-S161 PolarHBondContact O-OG 2.94Å; D158-G162 PolarHBondContact O-N 3.41Å; D158-G162 VanDerWaalsContact O-N 3.09Å; D158-S163 PolarHBondContact O-N 2.85Å; D158-S163 PolarHBondContact O-OG 3.19Å
159	L	68	Low	78.1	Confident	82 Å²	82	74.1 Å²	74.1	43%	0.429	42%	0.422	S	S	.	.	H	α-helix	trans	-64.7	-38.9	172.7	-164.1	72.3	0	0	0	111.4	F154 T155 R157 G162 M164	F154-L159 HydrophobicContact CE2-CD1 4.33Å; T155-L159 PolarHBondContact O-N 3.39Å; R157-L159 VanDerWaalsContact C-N 3.3Å; R157-L159 PolarHBondContact O-N 2.9Å; L159-G162 PolarHBondContact O-N 3.06Å; L159-M164 HydrophobicContact CD1-CE 3.89Å
160	A	63.7	Low	78.2	Confident	93 Å²	93	79.6 Å²	79.6	77%	0.769	43%	0.432	S	S	*	.	H	α-helix	trans	-72	-29.3	178.1	0	0	0	0	0	113.3	I156 R157 D158	I156-A160 PolarHBondContact O-N 3.06Å; R157-A160 WeakPolarHBondContact O-CB 3.45Å; R157-A160 PolarHBondContact O-N 3.01Å; R157-A160 VanDerWaalsContact O-N 3.14Å; D158-A160 VanDerWaalsContact C-N 3.34Å
161	S	66.9	Low	78.3	Confident	82 Å²	82	79 Å²	79	57%	0.573	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-1.4	174.1	50.1	0	0	0	0	114.2	R157 D158 S163	R157-S161 PolarHBondContact O-N 3.02Å; R157-S161 PolarHBondContact O-OG 3.36Å; R157-S161 VanDerWaalsContact O-OG 3.1Å; D158-S161 WeakPolarHBondContact CA-OG 2.99Å; D158-S161 PolarHBondContact O-N 3.29Å; D158-S161 PolarHBondContact O-OG 2.94Å; S161-S163 PolarHBondContact O-N 3.13Å; S161-S163 PolarHBondContact OG-OG 2.81Å
162	G	62.1	Low	78.5	Confident	62 Å²	62	75.5 Å²	75.5	64%	0.639	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	16.9	-176.6	0	0	0	0	0	114.3	D158 L159 M164	D158-G162 PolarHBondContact O-N 3.41Å; D158-G162 VanDerWaalsContact O-N 3.09Å; L159-G162 PolarHBondContact O-N 3.06Å; G162-M164 PolarHBondContact O-N 3.3Å
163	S	64.6	Low	78.8	Confident	44 Å²	44	70.5 Å²	70.5	31%	0.308	39%	0.389	S	S	.	.			trans	-98.6	62.1	-174.1	58.5	0	0	0	0	112.1	D158 S161	D158-S163 PolarHBondContact O-N 2.85Å; D158-S163 PolarHBondContact O-OG 3.19Å; S161-S163 PolarHBondContact O-N 3.13Å; S161-S163 PolarHBondContact OG-OG 2.81Å
164	M	69.3	Low	78.4	Confident	102 Å²	102	70.1 Å²	70.1	50%	0.502	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-63.3	136.7	175.1	-62.9	177.9	-178.1	0	0	110.7	L159 G162	L159-M164 HydrophobicContact CD1-CE 3.89Å; G162-M164 PolarHBondContact O-N 3.3Å
165	K	80.1	Confident	78.6	Confident	83 Å²	83	74.1 Å²	74.1	36%	0.361	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-96.8	118.2	180	-60.8	-60.1	-173.7	176.6	0	110.5	T102 Q152	T102-K165 WeakPolarHBondContact CG2-O 3.4Å; Q152-K165 HydrophobicContact CB-CB 4.08Å; Q152-K165 HydrophobicContact CB-CG 4.29Å
166	L	86.3	Confident	78.9	Confident	89 Å²	89	72.4 Å²	72.4	47%	0.466	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-90.7	122.8	176.4	-171.9	68.1	0	0	0	109.6	Q100 T102 V195	Q100-L166 HydrophobicContact CB-CD1 4.1Å; Q100-L166 HydrophobicContact CB-CG 4.45Å; T102-L166 HydrophobicContact CG2-CD1 4.21Å; L166-V195 HydrophobicContact CD1-CB 4.02Å; L166-V195 HydrophobicContact CD1-CG1 4.29Å; L166-V195 HydrophobicContact CD1-CG2 3.79Å
167	N	91.1	Very high	79.5	Confident	8 Å²	8	72.4 Å²	72.4	4%	0.043	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	146.6	176	-61.4	-90.8	0	0	0	109.2	Q100 F101 D151 Q152	Q100-N167 VanDerWaalsContact CA-O 3.28Å; Q100-N167 WeakPolarHBondContact CA-O 3.32Å; F101-N167 HydrophobicContact CD1-CB 4.24Å; F101-N167 HydrophobicContact CD2-CB 4.42Å; F101-N167 HydrophobicContact CE1-CB 3.83Å; F101-N167 HydrophobicContact CE2-CB 4.04Å; F101-N167 HydrophobicContact CZ-CB 3.71Å; F101-N167 PolarHBondContact N-O 2.96Å; F101-N167 PolarHBondContact O-N 2.99Å; F101-N167 PolarHBondContact O-ND2 3.24Å; D151-N167 PolarHBondContact N-OD1 3.29Å; D151-N167 VanDerWaalsContact N-OD1 3.08Å; Q152-N167 PolarHBondContact N-OD1 3.05Å; Q152-N167 PolarHBondContact O-ND2 3.13Å; Q152-N167 PolarHBondContact O-OD1 3.29Å
168	V	92.7	Very high	80.3	Confident	69 Å²	69	68 Å²	68	42%	0.418	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	120.2	176.9	-175.8	0	0	0	0	108.9	E98 L99 Q100	E98-V168 HydrophobicContact CG-CG1 3.96Å; L99-V168 CarbonylContact O-C 3.53Å; L99-V168 VanDerWaalsContact O-CA 3.29Å; L99-V168 WeakPolarHBondContact O-CA 3.47Å; Q100-V168 HydrophobicContact CG-CG2 4.17Å
169	E	93.9	Very high	80.5	Confident	62 Å²	62	73.3 Å²	73.3	29%	0.29	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132.4	178.4	-174.5	65.1	-169.1	0	0	109.8	E98 L99 F101 V148	E98-E169 CarbonylContact C-O 3.58Å; E98-E169 WeakPolarHBondContact CA-O 3.42Å; L99-E169 HydrophobicContact CB-CB 4.49Å; L99-E169 PolarHBondContact N-O 3.44Å; L99-E169 PolarHBondContact O-N 3.05Å; F101-E169 HydrophobicContact CE1-CB 4.03Å; V148-E169 HydrophobicContact CG1-CB 4.28Å; V148-E169 HydrophobicContact CG1-CG 4.23Å
170	R	92.4	Very high	81.3	Confident	168 Å²	168	69.5 Å²	69.5	63%	0.634	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	123.3	177.8	-74	-177.2	177.7	149.5	1.6	110.8	V97 E98	V97-R170 WeakPolarHBondContact O-CA 3.44Å; E98-R170 HydrophobicContact CB-CG 4.1Å; E98-R170 HydrophobicContact CG-CG 3.95Å; E98-R170 IonicContact OE2-CZ 3.46Å; E98-R170 IonicContact OE2-NE 2.73Å; E98-R170 PolarHBondContact OE2-NE 3.32Å; E98-R170 IonicContact OE2-NH2 2.68Å; E98-R170 PolarHBondContact OE2-NH2 3.27Å
171	C	91.1	Very high	82.6	Confident	13 Å²	13	65 Å²	65	9%	0.088	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	144.9	178.6	-52	0	0	0	0	110.2	H96 V97 L124 V145 T146	H96-C171 CarbonylContact C-O 3.51Å; H96-C171 WeakPolarHBondContact CA-O 3.5Å; V97-C171 PolarHBondContact N-O 3.32Å; V97-C171 PolarHBondContact O-N 3.23Å; L124-C171 HydrophobicContact CD2-CB 4.25Å; V145-C171 HydrophobicContact CG1-CB 4Å; T146-C171 VanDerWaalsContact CG2-SG 3.56Å
172	S	87.6	Confident	83.7	Confident	67 Å²	67	61.1 Å²	61.1	47%	0.469	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	137.1	166.5	55	0	0	0	0	109.4
173	L	88.3	Confident	85.2	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.026	29%	0.291	C	S	.	.			trans	-80.8	159.1	172	-55.3	-177.2	0	0	0	109.6	V95 V97 Y126 V145 L181 L183	V95-L173 HydrophobicContact CB-CD1 4.2Å; V95-L173 HydrophobicContact CG1-CD1 4.07Å; V95-L173 WeakPolarHBondContact O-CB 3.49Å; V95-L173 PolarHBondContact O-N 3.16Å; V97-L173 HydrophobicContact CG2-CD1 4.02Å; V97-L173 HydrophobicContact CG2-CD2 4.02Å; V97-L173 HydrophobicContact CG2-CG 4.01Å; Y126-L173 HydrophobicContact CD1-CD2 4.33Å; Y126-L173 HydrophobicContact CG-CD2 4.3Å; V145-L173 HydrophobicContact CB-CD2 4.41Å; V145-L173 HydrophobicContact CG1-CD2 3.97Å; V145-L173 HydrophobicContact CG2-CD2 3.49Å; V145-L173 VanDerWaalsContact CG2-CD2 3.49Å; L173-L181 HydrophobicContact CD1-CD1 3.39Å; L173-L183 HydrophobicContact CD1-CD2 4.31Å
174	G	75.6	Confident	86.7	Confident	37 Å²	37	56.1 Å²	56.1	38%	0.381	28%	0.276	S	S	.	.			trans	-60.4	177.5	172.4	0	0	0	0	0	112.6	L176	G174-L176 PolarHBondContact O-N 3.39Å; G174-L176 VanDerWaalsContact O-N 3.14Å
175	H	82.6	Confident	88	Confident	105 Å²	105	51.2 Å²	51.2	49%	0.486	25%	0.253	S	S	.	.			trans	-64.6	115	174.7	-177.3	73.3	0	0	0	110	S93	S93-H175 VanDerWaalsContact CB-CE1 3.5Å; S93-H175 WeakPolarHBondContact CB-CE1 3.33Å
176	L	85.4	Confident	88.7	Confident	4 Å²	4	49 Å²	49	2%	0.021	24%	0.243	C	C	.	.			trans	-90.1	134.1	-178	-57.9	-178.3	0	0	0	110.2	R88 S93 V95 Y126 E128 G174 L181	R88-L176 HydrophobicContact CG-CD1 4.38Å; S93-L176 PolarHBondContact O-N 3.32Å; V95-L176 HydrophobicContact CB-CD1 3.86Å; V95-L176 HydrophobicContact CG2-CD1 3.6Å; Y126-L176 HydrophobicContact CD2-CD2 4.04Å; Y126-L176 HydrophobicContact CE2-CD2 3.54Å; E128-L176 HydrophobicContact CG-CD2 3.85Å; E128-L176 WeakPolarHBondContact OE2-CA 3.3Å; G174-L176 PolarHBondContact O-N 3.39Å; G174-L176 VanDerWaalsContact O-N 3.14Å; L176-L181 HydrophobicContact CD1-CD2 4.02Å
177	T	83.9	Confident	88.9	Confident	99 Å²	99	44.8 Å²	44.8	61%	0.607	22%	0.221	S	C	*	.			trans	-114.5	-28.2	-176.2	57.9	0	0	0	0	112.9	E128	E128-T177 PolarHBondContact OE2-N 3.47Å; E128-T177 PolarHBondContact OE2-OG1 3.34Å
178	R	85.2	Confident	88.8	Confident	115 Å²	115	45.1 Å²	45.1	43%	0.434	22%	0.224	S	C	.	.	S	Bend	trans	-85.3	169.8	-178.9	-59.4	-165.2	177.7	-174.8	-11.5	112.8	R88 E128 D130 G180	R88-R178 PolarHBondContact NE-O 3.22Å; R88-R178 PolarHBondContact NH2-O 2.75Å; E128-R178 HydrophobicContact CB-CB 3.97Å; E128-R178 HydrophobicContact CB-CG 3.92Å; E128-R178 PolarHBondContact O-NH1 3.07Å; E128-R178 PolarHBondContact OE2-N 3.5Å; D130-R178 WeakPolarHBondContact OD1-CA 3.37Å; D130-R178 VanDerWaalsContact OD1-CB 3.31Å; D130-R178 WeakPolarHBondContact OD1-CB 3.37Å; D130-R178 IonicContact OD2-NE 3.23Å; R178-G180 VanDerWaalsContact C-N 3.31Å; R178-G180 PolarHBondContact O-N 3.05Å
179	R	79.9	Confident	88.6	Confident	151 Å²	151	42.1 Å²	42.1	57%	0.57	21%	0.207	S	C	*	.	S	Bend	trans	-67.1	-24.8	-177	-64.9	-175.1	170	-163.9	-5.4	114.9	W85 Y87 R88 D130	W85-R179 HydrophobicContact CZ2-CB 4.23Å; Y87-R179 VanDerWaalsContact CD2-O 3.23Å; Y87-R179 WeakPolarHBondContact CD2-O 3.13Å; Y87-R179 HydrophobicContact CE2-CB 4.39Å; R88-R179 WeakPolarHBondContact CB-O 3.26Å; R88-R179 PolarHBondContact N-O 3.47Å; D130-R179 PolarHBondContact OD1-N 3.46Å; D130-R179 VanDerWaalsContact OD1-N 3.1Å
180	G	84.8	Confident	88.4	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	-177.9	178.8	0	0	0	0	0	112.7	I86 S129 R178	I86-G180 CarbonylContact O-C 3.43Å; I86-G180 WeakPolarHBondContact O-CA 3.35Å; S129-G180 PolarHBondContact N-O 3.5Å; S129-G180 CarbonylContact O-C 3.6Å; S129-G180 PolarHBondContact O-N 2.9Å; R178-G180 VanDerWaalsContact C-N 3.31Å; R178-G180 PolarHBondContact O-N 3.05Å
181	L	90.7	Very high	88.2	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	163.4	-178	69.5	148.7	0	0	0	112.6	I86 R88 M127 L173 L176 L183	I86-L181 HydrophobicContact CB-CD2 4.19Å; I86-L181 HydrophobicContact CB-CG 4.28Å; I86-L181 HydrophobicContact CG2-CD2 4.23Å; I86-L181 PolarHBondContact N-O 3.5Å; I86-L181 PolarHBondContact O-N 3.37Å; R88-L181 HydrophobicContact CB-CD2 4.5Å; M127-L181 CarbonylContact O-C 3.56Å; M127-L181 WeakPolarHBondContact O-CA 3.41Å; L173-L181 HydrophobicContact CD1-CD1 3.39Å; L176-L181 HydrophobicContact CD1-CD2 4.02Å; L181-L183 HydrophobicContact CD1-CD2 3.95Å
182	Y	89.6	Confident	88.3	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	146.1	163.5	-66.1	-88.8	0	0	0	109.6	R82 S83 W85 Y126 M127 D132 V133	R82-Y182 HydrophobicContact CG-CD1 4.27Å; S83-Y182 WeakPolarHBondContact O-CD1 3.45Å; W85-Y182 VanDerWaalsContact CA-CE1 3.5Å; W85-Y182 HydrophobicContact CB-CE1 3.71Å; W85-Y182 HydrophobicContact CB-CE2 4.33Å; W85-Y182 AromaticContact CD1-CE2 3.45Å; W85-Y182 VanDerWaalsContact CD1-CE2 3.45Å; W85-Y182 AromaticContact CD1-CZ 3.62Å; W85-Y182 HydrophobicContact CG-CE1 4.47Å; W85-Y182 HydrophobicContact CG-CE2 4.25Å; W85-Y182 AromaticContact CG-CZ 3.97Å; W85-Y182 VanDerWaalsContact N-CE1 3.33Å; Y126-Y182 CarbonylContact C-O 3.57Å; Y126-Y182 WeakPolarHBondContact CA-O 3.24Å; Y126-Y182 WeakPolarHBondContact CB-O 3.44Å; M127-Y182 HydrophobicContact CE-CD2 3.43Å; M127-Y182 VanDerWaalsContact CE-CD2 3.43Å; M127-Y182 HydrophobicContact CE-CE2 3.84Å; M127-Y182 HydrophobicContact CE-CG 4.31Å; M127-Y182 PolarHBondContact N-O 2.78Å; M127-Y182 PolarHBondContact O-N 2.88Å; D132-Y182 VanDerWaalsContact CA-OH 3.25Å; D132-Y182 WeakPolarHBondContact CA-OH 3.4Å; D132-Y182 PolarHBondContact OD1-OH 3.36Å; V133-Y182 HydrophobicContact CG2-CE2 3.67Å; V133-Y182 PolarHBondContact N-OH 2.98Å
183	L	94.9	Very high	88.5	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	144.3	163	-63	-177.6	0	0	0	109.4	M31 R82 S83 I86 V97 L125 L173 L181 F185 V197 V199	M31-L183 HydrophobicContact CE-CD1 4.39Å; R82-L183 CarbonylContact C-O 3.48Å; R82-L183 WeakPolarHBondContact CA-O 3.39Å; R82-L183 WeakPolarHBondContact CG-O 3.47Å; S83-L183 PolarHBondContact N-O 3.28Å; S83-L183 PolarHBondContact OG-N 3.48Å; S83-L183 PolarHBondContact OG-O 3.26Å; I86-L183 HydrophobicContact CD1-CD1 4.14Å; I86-L183 HydrophobicContact CD1-CG 3.97Å; V97-L183 HydrophobicContact CG1-CD1 3.89Å; V97-L183 HydrophobicContact CG2-CD1 3.96Å; V97-L183 HydrophobicContact CG2-CD2 4.08Å; L125-L183 WeakPolarHBondContact O-CA 3.5Å; L173-L183 HydrophobicContact CD1-CD2 4.31Å; L181-L183 HydrophobicContact CD1-CD2 3.95Å; L183-F185 HydrophobicContact CB-CE2 4.26Å; L183-F185 HydrophobicContact CB-CZ 4.49Å; L183-V197 HydrophobicContact CD1-CG1 4.12Å; L183-V199 HydrophobicContact CD1-CG2 3.46Å; L183-V199 VanDerWaalsContact CD1-CG2 3.46Å
184	A	95.2	Very high	88.7	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	144.8	170.6	0	0	0	0	0	111.6	W80 L81 R82 L125 F142	W80-A184 HydrophobicContact CE3-CB 4.04Å; W80-A184 HydrophobicContact CZ3-CB 4.19Å; L81-A184 CarbonylContact O-C 3.5Å; L81-A184 VanDerWaalsContact O-CA 3.23Å; L81-A184 WeakPolarHBondContact O-CA 3.48Å; R82-A184 HydrophobicContact CB-CB 4.44Å; R82-A184 HydrophobicContact CG-CB 4.44Å; L125-A184 HydrophobicContact CB-CB 4.38Å; L125-A184 PolarHBondContact N-O 3.5Å; L125-A184 PolarHBondContact O-N 3.41Å; F142-A184 HydrophobicContact CD1-CB 3.52Å; F142-A184 HydrophobicContact CE1-CB 3.41Å; F142-A184 VanDerWaalsContact CE1-CB 3.41Å; F142-A184 HydrophobicContact CG-CB 4.26Å; F142-A184 HydrophobicContact CZ-CB 4.07Å
185	F	96.1	Very high	89.4	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	110.4	179.4	-55.2	-89.5	0	0	0	107.4	W42 W51 W80 L81 L99 F122 N123 L124 L183 L194 V197	W42-F185 HydrophobicContact CE3-CE2 4.25Å; W42-F185 AromaticContact CH2-CE2 3.95Å; W42-F185 HydrophobicContact CH2-CE2 3.95Å; W42-F185 HydrophobicContact CH2-CZ 4.44Å; W42-F185 HydrophobicContact CZ3-CD2 4.01Å; W42-F185 AromaticContact CZ3-CE2 3.39Å; W42-F185 HydrophobicContact CZ3-CE2 3.39Å; W42-F185 HydrophobicContact CZ3-CZ 4.18Å; W51-F185 HydrophobicContact CH2-CB 4.44Å; W51-F185 HydrophobicContact CZ2-CB 3.89Å; W51-F185 PolarHBondContact NE1-O 2.97Å; W80-F185 WeakPolarHBondContact CA-O 3.49Å; L81-F185 HydrophobicContact CB-CB 4.21Å; L81-F185 HydrophobicContact CB-CD2 4.48Å; L81-F185 HydrophobicContact CD2-CB 4.44Å; L81-F185 HydrophobicContact CD2-CD2 3.98Å; L81-F185 HydrophobicContact CD2-CG 4.43Å; L81-F185 HydrophobicContact CG-CD2 4.12Å; L81-F185 PolarHBondContact N-O 2.91Å; L81-F185 PolarHBondContact O-N 3.04Å; L99-F185 HydrophobicContact CD1-CE1 4.12Å; L99-F185 HydrophobicContact CD2-CE1 3.65Å; L99-F185 HydrophobicContact CD2-CZ 3.99Å; F122-F185 HydrophobicContact CD2-CD1 4.36Å; F122-F185 AromaticContact CE2-CD1 3.96Å; F122-F185 HydrophobicContact CE2-CD1 3.96Å; N123-F185 WeakPolarHBondContact O-CA 3.49Å; L124-F185 HydrophobicContact CD1-CD1 4.11Å; L124-F185 HydrophobicContact CD1-CE1 3.59Å; L124-F185 HydrophobicContact CD1-CZ 3.98Å; L183-F185 HydrophobicContact CB-CE2 4.26Å; L183-F185 HydrophobicContact CB-CZ 4.49Å; F185-L194 HydrophobicContact CD1-CD2 3.99Å; F185-L194 HydrophobicContact CD2-CD2 4.14Å; F185-L194 HydrophobicContact CE1-CD1 4.46Å; F185-L194 HydrophobicContact CE1-CD2 3.89Å; F185-L194 HydrophobicContact CE2-CD2 4.07Å; F185-L194 HydrophobicContact CG-CD2 4.11Å; F185-L194 HydrophobicContact CZ-CD2 3.94Å; F185-V197 HydrophobicContact CE1-CG2 4.38Å; F185-V197 HydrophobicContact CE2-CG2 4.43Å; F185-V197 HydrophobicContact CZ-CG1 4.07Å; F185-V197 HydrophobicContact CZ-CG2 3.77Å
186	H	94.8	Very high	89.7	Confident	36 Å²	36	22.6 Å²	22.6	17%	0.167	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	117.4	178.8	168.3	-134.4	0	0	0	108.9	D78 H79 W80 N123 L125 P188	D78-H186 IonicContact OD1-CD2 3.59Å; D78-H186 IonicContact OD1-NE2 3.91Å; D78-H186 PolarHBondContact OD1-NE2 3.42Å; H79-H186 WeakPolarHBondContact O-CA 3.45Å; W80-H186 AromaticContact CD1-CD2 3.96Å; W80-H186 HydrophobicContact CD2-CB 4.12Å; W80-H186 AromaticContact CE2-CD2 3.78Å; W80-H186 AromaticContact CE2-CG 3.88Å; W80-H186 HydrophobicContact CE3-CB 4.32Å; W80-H186 HydrophobicContact CH2-CB 4.35Å; W80-H186 HydrophobicContact CZ2-CB 4.14Å; W80-H186 AromaticContact CZ2-CG 3.97Å; W80-H186 HydrophobicContact CZ3-CB 4.43Å; W80-H186 AromaticContact NE1-CD2 3.45Å; W80-H186 PolarHBondContact NE1-CD2 3.03Å; N123-H186 HydrophobicContact CB-CB 4.3Å; N123-H186 PolarHBondContact N-O 2.97Å; N123-H186 PolarHBondContact ND2-ND1 3.19Å; N123-H186 PolarHBondContact O-N 3.32Å; L125-H186 HydrophobicContact CD1-CB 3.69Å; H186-P188 WeakPolarHBondContact O-CD 3.49Å
187	N	92.4	Very high	90	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	106.7	179.2	-174.4	14.5	0	0	0	111	W51 D68 H79 G189 A190	W51-N187 HydrophobicContact CZ2-CB 3.91Å; D68-N187 VanDerWaalsContact CG-ND2 3.29Å; D68-N187 PolarHBondContact OD2-ND2 3.25Å; H79-N187 HydrophobicContact CB-CB 4.41Å; H79-N187 PolarHBondContact N-O 3.3Å; H79-N187 PolarHBondContact O-N 2.85Å; N187-G189 VanDerWaalsContact C-N 3.31Å; N187-G189 PolarHBondContact O-N 2.77Å; N187-G189 PolarHBondContact OD1-N 3.29Å; N187-A190 PolarHBondContact ND2-O 3.18Å; N187-A190 WeakPolarHBondContact OD1-CA 3.16Å; N187-A190 WeakPolarHBondContact OD1-CB 3.39Å; N187-A190 PolarHBondContact OD1-N 3.04Å
188	P	89.1	Confident	90.5	Very high	15 Å²	15	19.7 Å²	19.7	10%	0.097	9%	0.086	C	C	.	.	S	Bend	trans	-88.6	10.2	-177.9	37.4	-37.6	0	0	0	114	T77 K119 H186	T77-P188 CarbonylContact O-C 3.57Å; T77-P188 VanDerWaalsContact O-CA 3.31Å; T77-P188 WeakPolarHBondContact O-CA 3.31Å; T77-P188 PolarHBondContact OG1-O 3.43Å; K119-P188 HydrophobicContact CD-CB 3.98Å; K119-P188 HydrophobicContact CD-CG 3.75Å; K119-P188 WeakPolarHBondContact CD-O 3.33Å; K119-P188 PolarHBondContact NZ-O 2.81Å; K119-P188 VanDerWaalsContact NZ-O 3.14Å; H186-P188 WeakPolarHBondContact O-CD 3.49Å
189	G	87	Confident	90.7	Very high	6 Å²	6	14.2 Å²	14.2	6%	0.062	7%	0.066	C	C	.	.	S	Bend	trans	138.7	20.1	177.1	0	0	0	0	0	116.2	T77 C118 K119 N187	T77-G189 WeakPolarHBondContact OG1-CA 3.46Å; T77-G189 PolarHBondContact OG1-N 3.31Å; C118-G189 WeakPolarHBondContact CA-O 3.48Å; K119-G189 PolarHBondContact N-O 3.09Å; N187-G189 VanDerWaalsContact C-N 3.31Å; N187-G189 PolarHBondContact O-N 2.77Å; N187-G189 PolarHBondContact OD1-N 3.29Å
190	A	89.3	Confident	91.2	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.04	C	C	.	.	B	Isolated β-bridge	trans	-89.7	152.7	177.7	0	0	0	0	0	113.1	P70 K119 N187	P70-A190 WeakPolarHBondContact CD-O 3.4Å; K119-A190 WeakPolarHBondContact O-CA 3.43Å; K119-A190 WeakPolarHBondContact O-CB 3.43Å; N187-A190 PolarHBondContact ND2-O 3.18Å; N187-A190 WeakPolarHBondContact OD1-CA 3.16Å; N187-A190 WeakPolarHBondContact OD1-CB 3.39Å; N187-A190 PolarHBondContact OD1-N 3.04Å
191	C	89.7	Confident	91.4	Very high	12 Å²	12	8.5 Å²	8.5	8%	0.081	4%	0.044	C	C	.	.			trans	-97.2	95.3	168.9	-172.7	0	0	0	0	109	D68 C69 R104 F109	D68-C191 CarbonylContact O-C 3.42Å; D68-C191 WeakPolarHBondContact O-CA 3.22Å; C69-C191 HydrophobicContact CB-CB 3.93Å; C69-C191 WeakPolarHBondContact CB-SG 3.4Å; C69-C191 WeakPolarHBondContact SG-CB 3.3Å; C69-C191 CovalentContact SG-SG 2.04Å; C69-C191 PolarHBondContact SG-SG 2.87Å; R104-C191 HydrophobicContact CB-CB 4.01Å; R104-C191 PolarHBondContact N-O 3.16Å; F109-C191 HydrophobicContact CE2-CB 4.43Å; F109-C191 HydrophobicContact CZ-CB 3.9Å
192	V	92.2	Very high	91.2	Very high	2 Å²	2	9.8 Å²	9.8	1%	0.012	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142.6	-168.6	60.2	0	0	0	0	110.8	W51 Q67 D68 F101 T102 F122	W51-V192 HydrophobicContact CH2-CG1 3.53Å; W51-V192 HydrophobicContact CZ2-CG1 4.13Å; W51-V192 HydrophobicContact CZ3-CG1 3.97Å; Q67-V192 WeakPolarHBondContact CA-O 3.48Å; D68-V192 PolarHBondContact N-O 2.73Å; D68-V192 PolarHBondContact O-N 3.27Å; D68-V192 VanDerWaalsContact O-O 3.11Å; F101-V192 HydrophobicContact CB-CG2 4.49Å; F101-V192 HydrophobicContact CD2-CG2 4.34Å; T102-V192 WeakPolarHBondContact O-CA 3Å; F122-V192 HydrophobicContact CD1-CG2 3.97Å; F122-V192 HydrophobicContact CE1-CG2 3.92Å
193	A	91.6	Very high	91.1	Very high	8 Å²	8	11.5 Å²	11.5	7%	0.066	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	116.3	163.7	0	0	0	0	0	109.5	M65 Y66 Q67 F101 T102 V195	M65-A193 HydrophobicContact SD-CB 4.33Å; Y66-A193 CarbonylContact O-C 3.56Å; Y66-A193 WeakPolarHBondContact O-CA 3.43Å; Q67-A193 HydrophobicContact CB-CB 4.22Å; Q67-A193 HydrophobicContact CG-CB 4.1Å; F101-A193 CarbonylContact C-O 3.41Å; F101-A193 WeakPolarHBondContact CA-O 3.18Å; F101-A193 WeakPolarHBondContact CB-O 3.24Å; T102-A193 PolarHBondContact N-O 3.02Å; T102-A193 PolarHBondContact O-N 2.99Å; A193-V195 PolarHBondContact O-N 2.88Å
194	L	92.4	Very high	90.9	Very high	4 Å²	4	11.5 Å²	11.5	2%	0.021	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	102.2	176.2	-172.6	63.9	0	0	0	108.9	W42 W51 M65 Y66 L81 L99 F101 F185 V197	W42-L194 HydrophobicContact CZ3-CD2 4.23Å; W51-L194 HydrophobicContact CH2-CB 4.45Å; W51-L194 HydrophobicContact CZ3-CB 4.05Å; M65-L194 WeakPolarHBondContact CA-O 3.5Å; M65-L194 VanDerWaalsContact CB-O 3.28Å; M65-L194 WeakPolarHBondContact CB-O 3.32Å; Y66-L194 PolarHBondContact N-O 3.17Å; Y66-L194 PolarHBondContact O-N 3.39Å; L81-L194 HydrophobicContact CD2-CD2 4.05Å; L99-L194 HydrophobicContact CB-CD1 4.48Å; L99-L194 HydrophobicContact CD2-CD1 4.45Å; F101-L194 HydrophobicContact CB-CD1 4.19Å; F185-L194 HydrophobicContact CD1-CD2 3.99Å; F185-L194 HydrophobicContact CD2-CD2 4.14Å; F185-L194 HydrophobicContact CE1-CD1 4.46Å; F185-L194 HydrophobicContact CE1-CD2 3.89Å; F185-L194 HydrophobicContact CE2-CD2 4.07Å; F185-L194 HydrophobicContact CG-CD2 4.11Å; F185-L194 HydrophobicContact CZ-CD2 3.94Å; L194-V197 HydrophobicContact CD1-CG2 3.9Å; L194-V197 HydrophobicContact CD2-CG2 3.57Å; L194-V197 HydrophobicContact CG-CG2 3.75Å
195	V	89.9	Confident	90.7	Very high	17 Å²	17	12.2 Å²	12.2	10%	0.103	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-41.7	-171.6	-178.8	0	0	0	0	111.8	L63 Q100 T102 L166 A193	L63-V195 HydrophobicContact CD2-CG1 3.72Å; L63-V195 HydrophobicContact CG-CG1 4.42Å; Q100-V195 HydrophobicContact CB-CB 4.47Å; Q100-V195 WeakPolarHBondContact O-CA 3.26Å; Q100-V195 WeakPolarHBondContact O-CB 3.18Å; Q100-V195 PolarHBondContact O-N 2.94Å; T102-V195 HydrophobicContact CG2-CG2 4.21Å; L166-V195 HydrophobicContact CD1-CB 4.02Å; L166-V195 HydrophobicContact CD1-CG1 4.29Å; L166-V195 HydrophobicContact CD1-CG2 3.79Å; A193-V195 PolarHBondContact O-N 2.88Å
196	S	90.3	Very high	90.4	Very high	4 Å²	4	17.7 Å²	17.7	3%	0.028	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	145.3	177.2	-177.4	0	0	0	0	111.6	T33 S34 Q100	T33-S196 WeakPolarHBondContact OG1-CA 3.32Å; S34-S196 WeakPolarHBondContact CB-OG 3.37Å; Q100-S196 PolarHBondContact N-O 2.96Å; Q100-S196 PolarHBondContact O-N 3.28Å
197	V	91.8	Very high	90.1	Very high	1 Å²	1	17.5 Å²	17.5	1%	0.006	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	119.5	169.3	-178.3	0	0	0	0	108.1	M31 D32 T33 W42 V97 E98 L99 L183 F185 L194 V199	M31-V197 HydrophobicContact CE-CB 4.29Å; M31-V197 HydrophobicContact CE-CG1 3.72Å; D32-V197 WeakPolarHBondContact CA-O 3.23Å; T33-V197 HydrophobicContact CG2-CB 4.07Å; T33-V197 PolarHBondContact N-O 2.96Å; T33-V197 PolarHBondContact OG1-N 3.24Å; W42-V197 HydrophobicContact CH2-CB 3.74Å; W42-V197 HydrophobicContact CH2-CG1 4.05Å; W42-V197 HydrophobicContact CH2-CG2 3.67Å; W42-V197 HydrophobicContact CZ3-CG2 4.11Å; V97-V197 HydrophobicContact CG1-CG1 4.21Å; E98-V197 WeakPolarHBondContact O-CA 3.4Å; L99-V197 HydrophobicContact CD2-CB 4.3Å; L99-V197 HydrophobicContact CD2-CG1 3.87Å; L99-V197 HydrophobicContact CD2-CG2 3.86Å; L183-V197 HydrophobicContact CD1-CG1 4.12Å; F185-V197 HydrophobicContact CE1-CG2 4.38Å; F185-V197 HydrophobicContact CE2-CG2 4.43Å; F185-V197 HydrophobicContact CZ-CG1 4.07Å; F185-V197 HydrophobicContact CZ-CG2 3.77Å; L194-V197 HydrophobicContact CD1-CG2 3.9Å; L194-V197 HydrophobicContact CD2-CG2 3.57Å; L194-V197 HydrophobicContact CG-CG2 3.75Å; V197-V199 HydrophobicContact CG1-CG2 4.3Å
198	R	93.4	Very high	89.9	Confident	42 Å²	42	21 Å²	21	16%	0.158	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125.9	176.1	-176.1	177.5	174.1	-132.7	-5.5	109.7	E27 T29 M31 D32 V97 E98 F200	E27-R198 IonicContact OE2-CZ 2.78Å; E27-R198 IonicContact OE2-NH1 3.74Å; E27-R198 PolarHBondContact OE2-NH1 2.98Å; E27-R198 IonicContact OE2-NH2 3.8Å; E27-R198 PolarHBondContact OE2-NH2 3.31Å; T29-R198 HydrophobicContact CG2-CG 4.29Å; T29-R198 PolarHBondContact OG1-NE 3.19Å; T29-R198 PolarHBondContact OG1-NH2 3.29Å; M31-R198 CarbonylContact O-C 3.55Å; M31-R198 WeakPolarHBondContact O-CA 3.44Å; D32-R198 HydrophobicContact CB-CG 4.17Å; V97-R198 CarbonylContact C-O 3.53Å; V97-R198 WeakPolarHBondContact CA-O 3.5Å; E98-R198 HydrophobicContact CB-CB 4.33Å; E98-R198 PolarHBondContact N-O 3.29Å; E98-R198 PolarHBondContact O-N 3.08Å; R198-F200 HydrophobicContact CG-CD1 4.15Å
199	V	90.8	Very high	89.8	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	127	178.3	-174.1	0	0	0	0	107.7	L30 M31 I86 V95 H96 V97 L183 V197	L30-V199 WeakPolarHBondContact CA-O 3.42Å; L30-V199 HydrophobicContact CB-CB 4.41Å; L30-V199 HydrophobicContact CB-CG1 4.2Å; L30-V199 HydrophobicContact CD1-CG1 4.21Å; L30-V199 PolarHBondContact N-O 2.85Å; M31-V199 HydrophobicContact CB-CB 4.08Å; M31-V199 HydrophobicContact CB-CG2 4.24Å; M31-V199 HydrophobicContact CE-CG2 3.67Å; M31-V199 PolarHBondContact N-O 3.07Å; M31-V199 VanDerWaalsContact N-O 3.09Å; M31-V199 PolarHBondContact O-N 3.37Å; I86-V199 HydrophobicContact CD1-CG2 4.06Å; I86-V199 HydrophobicContact CG2-CG1 4.46Å; V95-V199 HydrophobicContact CG1-CG1 3.29Å; H96-V199 VanDerWaalsContact O-CA 3.32Å; H96-V199 WeakPolarHBondContact O-CA 3.47Å; V97-V199 HydrophobicContact CG1-CG2 4.47Å; V97-V199 HydrophobicContact CG2-CG2 4.35Å; L183-V199 HydrophobicContact CD1-CG2 3.46Å; L183-V199 VanDerWaalsContact CD1-CG2 3.46Å; V197-V199 HydrophobicContact CG1-CG2 4.3Å
200	F	89.9	Confident	89.7	Confident	4 Å²	4	24.3 Å²	24.3	2%	0.018	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	161	-175.7	64.7	-83.5	0	0	0	111.1	E27 V28 H96 E98 R198 Q202	E27-F200 HydrophobicContact CB-CD2 3.81Å; E27-F200 HydrophobicContact CB-CE2 4.31Å; E27-F200 HydrophobicContact CB-CG 4.46Å; E27-F200 VanDerWaalsContact CD-CE2 3.48Å; E27-F200 HydrophobicContact CG-CD2 3.72Å; E27-F200 HydrophobicContact CG-CE2 3.71Å; E27-F200 WeakPolarHBondContact OE1-CE2 3.46Å; V28-F200 CarbonylContact O-C 3.58Å; V28-F200 WeakPolarHBondContact O-CA 3.42Å; V28-F200 VanDerWaalsContact O-CB 3.26Å; V28-F200 WeakPolarHBondContact O-CB 3.42Å; H96-F200 HydrophobicContact CB-CD1 4.34Å; H96-F200 HydrophobicContact CB-CD2 4.3Å; H96-F200 HydrophobicContact CB-CE1 3.97Å; H96-F200 HydrophobicContact CB-CE2 3.92Å; H96-F200 HydrophobicContact CB-CZ 3.75Å; H96-F200 PolarHBondContact N-O 2.86Å; H96-F200 PolarHBondContact O-N 2.95Å; E98-F200 HydrophobicContact CB-CE1 4.18Å; R198-F200 HydrophobicContact CG-CD1 4.15Å; F200-Q202 HydrophobicContact CD2-CG 4.26Å; F200-Q202 HydrophobicContact CE2-CG 4.04Å
201	Y	88	Confident	89.7	Confident	28 Å²	28	24.6 Å²	24.6	11%	0.11	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	159.6	166.8	69.8	-86.4	0	0	0	109.7	V28 L30 A92 R94 R203 L218	V28-Y201 HydrophobicContact CB-CD1 3.95Å; V28-Y201 HydrophobicContact CB-CD2 4.42Å; V28-Y201 HydrophobicContact CB-CE1 3.47Å; V28-Y201 VanDerWaalsContact CB-CE1 3.47Å; V28-Y201 HydrophobicContact CB-CE2 3.99Å; V28-Y201 HydrophobicContact CB-CG 4.41Å; V28-Y201 VanDerWaalsContact CB-CZ 3.48Å; V28-Y201 HydrophobicContact CG1-CD1 4.28Å; V28-Y201 HydrophobicContact CG1-CE1 3.43Å; V28-Y201 VanDerWaalsContact CG1-CE1 3.43Å; V28-Y201 HydrophobicContact CG2-CE1 4.36Å; V28-Y201 HydrophobicContact CG2-CE2 4.09Å; V28-Y201 PolarHBondContact N-O 2.76Å; V28-Y201 PolarHBondContact O-N 3.31Å; L30-Y201 HydrophobicContact CD1-CD1 4.27Å; L30-Y201 HydrophobicContact CD2-CD1 3.74Å; L30-Y201 HydrophobicContact CD2-CE1 3.76Å; L30-Y201 HydrophobicContact CG-CD1 4.01Å; L30-Y201 HydrophobicContact CG-CE1 4.5Å; A92-Y201 HydrophobicContact CB-CD1 3.62Å; A92-Y201 HydrophobicContact CB-CD2 3.76Å; A92-Y201 HydrophobicContact CB-CE1 3.95Å; A92-Y201 HydrophobicContact CB-CE2 4.06Å; A92-Y201 HydrophobicContact CB-CG 3.52Å; R94-Y201 VanDerWaalsContact O-CB 3.31Å; R94-Y201 WeakPolarHBondContact O-CB 2.8Å; Y201-R203 HydrophobicContact CD2-CG 3.91Å; Y201-R203 HydrophobicContact CE2-CG 3.47Å; Y201-R203 VanDerWaalsContact CE2-CG 3.47Å; Y201-R203 PolarHBondContact OH-NH1 3.19Å; Y201-L218 HydrophobicContact CD2-CD2 3.91Å; Y201-L218 HydrophobicContact CE2-CD2 3.72Å
202	Q	87.1	Confident	89.6	Confident	27 Å²	27	24 Å²	24	13%	0.126	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	144.8	-177.3	-69.9	173.3	-33.6	0	0	110.5	E27 F200 P219 D252	E27-Q202 HydrophobicContact CG-CG 4.18Å; F200-Q202 HydrophobicContact CD2-CG 4.26Å; F200-Q202 HydrophobicContact CE2-CG 4.04Å; Q202-P219 WeakPolarHBondContact O-CD 3.29Å; Q202-P219 WeakPolarHBondContact O-CG 3.5Å; Q202-D252 PolarHBondContact OE1-O 3.07Å; Q202-D252 VanDerWaalsContact OE1-O 3.06Å
203	R	88.1	Confident	89.6	Confident	35 Å²	35	27.7 Å²	27.7	13%	0.132	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	149.4	171.8	-55.1	-176.5	85.5	124.9	-1.5	109.9	K26 V28 E91 Y201 P205 D216 L218	K26-R203 PolarHBondContact N-O 2.65Å; K26-R203 VanDerWaalsContact N-O 3.14Å; K26-R203 PolarHBondContact O-N 2.85Å; V28-R203 HydrophobicContact CG2-CG 4.3Å; E91-R203 IonicContact OE2-CZ 3.9Å; E91-R203 IonicContact OE2-NH1 3.62Å; E91-R203 PolarHBondContact OE2-NH1 3.2Å; E91-R203 IonicContact OE2-NH2 3.89Å; E91-R203 PolarHBondContact OE2-NH2 3.06Å; Y201-R203 HydrophobicContact CD2-CG 3.91Å; Y201-R203 HydrophobicContact CE2-CG 3.47Å; Y201-R203 VanDerWaalsContact CE2-CG 3.47Å; Y201-R203 PolarHBondContact OH-NH1 3.19Å; R203-P205 WeakPolarHBondContact O-CD 3.43Å; R203-D216 WeakPolarHBondContact CB-OD1 3.35Å; R203-D216 WeakPolarHBondContact CD-OD1 3.14Å; R203-D216 IonicContact CZ-OD1 3.51Å; R203-D216 IonicContact NE-OD1 3.46Å; R203-D216 PolarHBondContact NE-OD1 2.85Å; R203-L218 HydrophobicContact CG-CD2 3.9Å; R203-L218 HydrophobicContact CG-CG 4.49Å
204	C	89.6	Confident	89.6	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.14	C	C	.	.	B	Isolated β-bridge	trans	-74.9	110.9	165	-65.9	0	0	0	0	107.7	D216 T217 C249 G253 W255	C204-D216 WeakPolarHBondContact O-CA 3.4Å; C204-T217 PolarHBondContact N-O 3.31Å; C204-T217 PolarHBondContact O-N 3.07Å; C204-C249 HydrophobicContact CB-CB 3.87Å; C204-C249 WeakPolarHBondContact CB-SG 3.44Å; C204-C249 WeakPolarHBondContact SG-CA 3.5Å; C204-C249 WeakPolarHBondContact SG-CB 3.32Å; C204-C249 CovalentContact SG-SG 2.03Å; C204-C249 PolarHBondContact SG-SG 3.03Å; C204-G253 WeakPolarHBondContact CA-O 3.46Å; C204-W255 HydrophobicContact CB-CD2 3.91Å; C204-W255 HydrophobicContact CB-CE3 4.44Å; C204-W255 HydrophobicContact CB-CG 4.31Å; C204-W255 HydrophobicContact CB-CH2 4.32Å; C204-W255 HydrophobicContact CB-CZ2 3.76Å
205	P	90.8	Very high	89.5	Confident	16 Å²	16	30.3 Å²	30.3	10%	0.104	16%	0.159	C	C	.	.			trans	-62.8	153.6	-173.5	25.6	-34.8	0	0	0	111.4	A23 K26 R203 T207 W255	A23-P205 HydrophobicContact CB-CG 3.83Å; K26-P205 HydrophobicContact CB-CB 4.02Å; K26-P205 HydrophobicContact CD-CB 4.27Å; R203-P205 WeakPolarHBondContact O-CD 3.43Å; P205-T207 PolarHBondContact O-N 2.65Å; P205-W255 PolarHBondContact O-NE1 3.44Å
206	E	89.8	Confident	89.5	Confident	115 Å²	115	31.6 Å²	31.6	54%	0.537	17%	0.165	S	C	.	.			trans	-54.5	127.8	167.5	-172.5	-177	176.7	0	0	110.3	Q213 F214 D216	E206-Q213 PolarHBondContact OE1-NE2 3.26Å; E206-F214 WeakPolarHBondContact CA-O 3.41Å; E206-D216 HydrophobicContact CB-CB 4.36Å
207	T	88.7	Confident	89.4	Confident	32 Å²	32	32.5 Å²	32.5	20%	0.196	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	151.6	-177.1	-167.8	0	0	0	0	111.5	P205 F214 M247 W255	P205-T207 PolarHBondContact O-N 2.65Å; T207-F214 HydrophobicContact CG2-CB 4.03Å; T207-F214 HydrophobicContact CG2-CD2 4.37Å; T207-F214 PolarHBondContact N-O 3.19Å; T207-F214 VanDerWaalsContact N-O 3.08Å; T207-F214 PolarHBondContact O-N 2.97Å; T207-M247 HydrophobicContact CG2-SD 4.48Å; T207-W255 HydrophobicContact CG2-CD2 4.49Å; T207-W255 HydrophobicContact CG2-CG 4.25Å
208	L	88	Confident	89.1	Confident	74 Å²	74	34.4 Å²	34.4	39%	0.387	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124.5	171	-61.4	-179.3	0	0	0	108.1	A212 Q213 L232	L208-A212 WeakPolarHBondContact CA-O 3.43Å; L208-Q213 HydrophobicContact CD2-CB 3.75Å; L208-Q213 HydrophobicContact CD2-CG 3.92Å; L208-L232 HydrophobicContact CD2-CD1 4.41Å; L208-L232 HydrophobicContact CD2-CD2 3.94Å
209	N	86.5	Confident	88.6	Confident	65 Å²	65	33.3 Å²	33.3	35%	0.348	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	131.3	174.8	-164.7	-2	0	0	0	110.1	L211 A212 F214 M247	N209-L211 VanDerWaalsContact C-N 3.34Å; N209-L211 PolarHBondContact O-N 3.34Å; N209-A212 PolarHBondContact N-O 3.34Å; N209-A212 WeakPolarHBondContact O-CB 3.39Å; N209-A212 PolarHBondContact O-N 3.4Å; N209-F214 HydrophobicContact CB-CD2 4.26Å; N209-F214 HydrophobicContact CB-CE2 3.94Å; N209-M247 HydrophobicContact CB-SD 4.08Å
210	G	85.9	Confident	87.9	Confident	24 Å²	24	34 Å²	34	25%	0.247	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	43.6	-179.8	0	0	0	0	0	114.1	A212 C262	G210-A212 PolarHBondContact O-N 3.14Å; G210-A212 VanDerWaalsContact O-N 3.13Å; G210-C262 PolarHBondContact O-N 3.39Å
211	L	88.5	Confident	86.8	Confident	7 Å²	7	38 Å²	38	4%	0.037	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	20.9	-175.3	-59.5	175.3	0	0	0	114.8	N209 L232 A235 C262 C264 E270	N209-L211 VanDerWaalsContact C-N 3.34Å; N209-L211 PolarHBondContact O-N 3.34Å; L211-L232 WeakPolarHBondContact O-CG 3.08Å; L211-L232 PolarHBondContact O-N 3.4Å; L211-A235 HydrophobicContact CB-CB 4.37Å; L211-C262 HydrophobicContact CB-CB 3.91Å; L211-C264 VanDerWaalsContact CD1-SG 3.52Å; L211-E270 HydrophobicContact CD1-CG 3.86Å; L211-E270 WeakPolarHBondContact CD1-OE1 3.44Å; L211-E270 HydrophobicContact CD2-CG 4.27Å; L211-E270 HydrophobicContact CG-CG 4.43Å
212	A	89.4	Confident	85.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	142.5	172.6	0	0	0	0	0	110.2	L208 N209 G210 F214 T230 P245	L208-A212 WeakPolarHBondContact CA-O 3.43Å; N209-A212 PolarHBondContact N-O 3.34Å; N209-A212 WeakPolarHBondContact O-CB 3.39Å; N209-A212 PolarHBondContact O-N 3.4Å; G210-A212 PolarHBondContact O-N 3.14Å; G210-A212 VanDerWaalsContact O-N 3.13Å; A212-F214 HydrophobicContact CB-CE2 3.89Å; A212-F214 HydrophobicContact CB-CZ 4.17Å; A212-T230 CarbonylContact C-O 3.52Å; A212-T230 VanDerWaalsContact CA-O 3.29Å; A212-T230 WeakPolarHBondContact CA-O 3.34Å; A212-P245 HydrophobicContact CB-CB 3.44Å; A212-P245 VanDerWaalsContact CB-CB 3.44Å; A212-P245 HydrophobicContact CB-CG 3.55Å
213	Q	91.1	Very high	85.2	Confident	78 Å²	78	41.8 Å²	41.8	36%	0.364	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	127.1	172.8	-173.8	177	24.8	0	0	109.5	E206 L208 G229 T230 L232	E206-Q213 PolarHBondContact OE1-NE2 3.26Å; L208-Q213 HydrophobicContact CD2-CB 3.75Å; L208-Q213 HydrophobicContact CD2-CG 3.92Å; Q213-G229 WeakPolarHBondContact O-CA 3.39Å; Q213-T230 PolarHBondContact N-O 3.34Å; Q213-T230 PolarHBondContact O-N 3.41Å; Q213-L232 HydrophobicContact CB-CD2 4.21Å
214	F	91.4	Very high	85.1	Confident	3 Å²	3	45 Å²	45	1%	0.013	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.4	173.2	-64.3	-87.6	0	0	0	108.1	E206 T207 N209 A212 P245 M247 W255	E206-F214 WeakPolarHBondContact CA-O 3.41Å; T207-F214 HydrophobicContact CG2-CB 4.03Å; T207-F214 HydrophobicContact CG2-CD2 4.37Å; T207-F214 PolarHBondContact N-O 3.19Å; T207-F214 VanDerWaalsContact N-O 3.08Å; T207-F214 PolarHBondContact O-N 2.97Å; N209-F214 HydrophobicContact CB-CD2 4.26Å; N209-F214 HydrophobicContact CB-CE2 3.94Å; A212-F214 HydrophobicContact CB-CE2 3.89Å; A212-F214 HydrophobicContact CB-CZ 4.17Å; F214-P245 HydrophobicContact CZ-CB 3.97Å; F214-M247 HydrophobicContact CD1-CB 3.91Å; F214-M247 HydrophobicContact CD1-CG 3.94Å; F214-M247 HydrophobicContact CD1-SD 4.4Å; F214-M247 HydrophobicContact CD2-CG 4.31Å; F214-M247 HydrophobicContact CD2-SD 3.88Å; F214-M247 HydrophobicContact CE1-CB 3.81Å; F214-M247 HydrophobicContact CE1-CG 3.56Å; F214-M247 HydrophobicContact CE1-SD 4.38Å; F214-M247 HydrophobicContact CE2-CG 3.96Å; F214-M247 HydrophobicContact CE2-SD 3.87Å; F214-M247 HydrophobicContact CG-CG 4.29Å; F214-M247 HydrophobicContact CG-SD 4.15Å; F214-M247 HydrophobicContact CZ-CB 4.33Å; F214-M247 HydrophobicContact CZ-CG 3.56Å; F214-M247 HydrophobicContact CZ-SD 4.12Å; F214-W255 HydrophobicContact CB-CH2 4.09Å; F214-W255 HydrophobicContact CB-CZ2 3.86Å
215	P	91.1	Very high	85	Confident	64 Å²	64	47.1 Å²	47.1	42%	0.416	29%	0.289	S	S	.	.			trans	-69.7	158.2	-175.4	29.5	-35.4	0	0	0	111.9	T217 V227	P215-T217 PolarHBondContact O-N 3.38Å; P215-T217 VanDerWaalsContact O-N 3.09Å; P215-T217 PolarHBondContact O-OG1 2.9Å; P215-V227 HydrophobicContact CG-CG1 4.25Å
216	D	89	Confident	84.9	Confident	44 Å²	44	51.6 Å²	51.6	24%	0.235	31%	0.308	C	S	.	.			trans	-57.2	115	170.9	-169.4	-41.4	0	0	0	109.4	K26 R203 C204 E206	K26-D216 IonicContact NZ-OD2 3.16Å; K26-D216 PolarHBondContact NZ-OD2 2.99Å; R203-D216 WeakPolarHBondContact CB-OD1 3.35Å; R203-D216 WeakPolarHBondContact CD-OD1 3.14Å; R203-D216 IonicContact CZ-OD1 3.51Å; R203-D216 IonicContact NE-OD1 3.46Å; R203-D216 PolarHBondContact NE-OD1 2.85Å; C204-D216 WeakPolarHBondContact O-CA 3.4Å; E206-D216 HydrophobicContact CB-CB 4.36Å
217	T	88.4	Confident	85	Confident	23 Å²	23	46.8 Å²	46.8	14%	0.141	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-123.3	136.5	-168.9	-56.2	0	0	0	0	111.3	C204 P215 V227 C249	C204-T217 PolarHBondContact N-O 3.31Å; C204-T217 PolarHBondContact O-N 3.07Å; P215-T217 PolarHBondContact O-N 3.38Å; P215-T217 VanDerWaalsContact O-N 3.09Å; P215-T217 PolarHBondContact O-OG1 2.9Å; T217-V227 HydrophobicContact CG2-CG2 3.75Å; T217-C249 HydrophobicContact CG2-CB 4.43Å
218	L	85.6	Confident	85.1	Confident	41 Å²	41	48.7 Å²	48.7	22%	0.215	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-78.7	137.4	173.8	-78.3	155.6	0	0	0	111.4	E91 Y201 R203	E91-L218 HydrophobicContact CB-CD1 3.21Å; E91-L218 HydrophobicContact CG-CD1 4.23Å; E91-L218 WeakPolarHBondContact OE2-CD1 3.44Å; Y201-L218 HydrophobicContact CD2-CD2 3.91Å; Y201-L218 HydrophobicContact CE2-CD2 3.72Å; R203-L218 HydrophobicContact CG-CD2 3.9Å; R203-L218 HydrophobicContact CG-CG 4.49Å
219	P	83.6	Confident	85.2	Confident	19 Å²	19	45.9 Å²	45.9	12%	0.123	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-58.3	144	171.6	-24.8	34.9	0	0	0	112.5	Q202 S250	Q202-P219 WeakPolarHBondContact O-CD 3.29Å; Q202-P219 WeakPolarHBondContact O-CG 3.5Å; P219-S250 VanDerWaalsContact CB-O 3.32Å; P219-S250 WeakPolarHBondContact CB-O 3.37Å; P219-S250 WeakPolarHBondContact CG-O 3.1Å
220	G	74.8	Confident	85.5	Confident	15 Å²	15	47.2 Å²	47.2	16%	0.155	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-72.9	153.7	178.2	0	0	0	0	0	112.2	A222	G220-A222 VanDerWaalsContact C-N 3.26Å; G220-A222 PolarHBondContact O-N 3.47Å
221	P	66.9	Low	85.7	Confident	89 Å²	89	47.8 Å²	47.8	58%	0.578	31%	0.305	S	S	*	.	S	Bend	trans	-67.7	-20.7	-176.8	25.5	-33.9	0	0	0	114.3
222	A	65.9	Low	85.8	Confident	105 Å²	105	48.5 Å²	48.5	87%	0.868	31%	0.309	S	S	*	.	S	Bend	trans	-137.6	9.9	-171.8	0	0	0	0	0	115.1	G220	G220-A222 VanDerWaalsContact C-N 3.26Å; G220-A222 PolarHBondContact O-N 3.47Å
223	G	76.4	Confident	85.8	Confident	29 Å²	29	53.3 Å²	53.3	30%	0.299	34%	0.34	S	S	.	.	S	Bend	trans	163.9	-161.3	-179.2	0	0	0	0	0	115.1
224	L	85.1	Confident	85.8	Confident	101 Å²	101	53.5 Å²	53.5	53%	0.529	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-69	132.3	178	-69.5	166.8	0	0	0	111.1	H248 C249 L256	L224-H248 HydrophobicContact CB-CB 4.39Å; L224-H248 HydrophobicContact CD2-CB 4.15Å; L224-C249 WeakPolarHBondContact CA-O 3.34Å; L224-L256 HydrophobicContact CD2-CD1 3.64Å
225	V	87.9	Confident	85.7	Confident	46 Å²	46	53.9 Å²	53.9	28%	0.279	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	117.5	173.4	178.8	0	0	0	0	108.6	V227 H248 C249	V225-V227 HydrophobicContact CG1-CG2 4.15Å; V225-H248 CarbonylContact O-C 3.48Å; V225-H248 VanDerWaalsContact O-CA 3.28Å; V225-H248 WeakPolarHBondContact O-CA 3.44Å; V225-C249 HydrophobicContact CB-CB 4.38Å; V225-C249 PolarHBondContact N-O 2.86Å; V225-C249 PolarHBondContact O-N 2.79Å
226	E	89.8	Confident	85.6	Confident	109 Å²	109	56.1 Å²	56.1	51%	0.509	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	128.4	170.4	-175.8	176.1	138.3	0	0	109.4	R246 H248	E226-R246 WeakPolarHBondContact OE1-CD 3.47Å; E226-R246 IonicContact OE1-CZ 3.21Å; E226-R246 IonicContact OE1-NE 3.54Å; E226-R246 IonicContact OE1-NH1 3.84Å; E226-R246 PolarHBondContact OE1-NH1 3.19Å; E226-R246 IonicContact OE2-NH1 3.35Å; E226-H248 IonicContact OE2-NE2 2.68Å
227	V	91.1	Very high	85.4	Confident	15 Å²	15	55.5 Å²	55.5	9%	0.091	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.8	-179.3	-173.2	0	0	0	0	109.1	P215 T217 V225 R246 M247 C249 W255	P215-V227 HydrophobicContact CG-CG1 4.25Å; T217-V227 HydrophobicContact CG2-CG2 3.75Å; V225-V227 HydrophobicContact CG1-CG2 4.15Å; V227-R246 WeakPolarHBondContact O-CA 3.31Å; V227-M247 PolarHBondContact N-O 2.86Å; V227-M247 PolarHBondContact O-N 2.85Å; V227-C249 HydrophobicContact CG2-CB 4.49Å; V227-W255 HydrophobicContact CB-CH2 3.74Å; V227-W255 HydrophobicContact CB-CZ3 3.8Å; V227-W255 HydrophobicContact CG1-CH2 3.92Å; V227-W255 HydrophobicContact CG1-CZ3 4.47Å; V227-W255 HydrophobicContact CG2-CH2 3.68Å; V227-W255 HydrophobicContact CG2-CZ3 3.72Å
228	A	90.9	Very high	84.7	Confident	71 Å²	71	56.5 Å²	56.5	59%	0.587	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	130.1	173.4	0	0	0	0	0	110.4
229	G	90.4	Very high	83.9	Confident	15 Å²	15	60.9 Å²	60.9	16%	0.155	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-82.6	147.9	172.6	0	0	0	0	0	111.2	Q213 P245	Q213-G229 WeakPolarHBondContact O-CA 3.39Å; G229-P245 PolarHBondContact N-O 2.77Å
230	T	91.6	Very high	83.3	Confident	94 Å²	94	68.7 Å²	68.7	58%	0.577	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	125.5	172.9	-56.7	0	0	0	0	108.9	A212 Q213 L232	A212-T230 CarbonylContact C-O 3.52Å; A212-T230 VanDerWaalsContact CA-O 3.29Å; A212-T230 WeakPolarHBondContact CA-O 3.34Å; Q213-T230 PolarHBondContact N-O 3.34Å; Q213-T230 PolarHBondContact O-N 3.41Å; T230-L232 PolarHBondContact O-N 2.79Å
231	C	90.9	Very high	82.6	Confident	36 Å²	36	73.6 Å²	73.6	24%	0.243	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	139.8	176.5	-65.6	0	0	0	0	110.9	A235 A237 C262	C231-A235 HydrophobicContact CB-CB 4.25Å; C231-A235 VanDerWaalsContact CB-O 3.3Å; C231-A235 WeakPolarHBondContact CB-O 3.44Å; C231-A237 PolarHBondContact SG-N 3.03Å; C231-A237 VanDerWaalsContact SG-N 3.45Å; C231-C262 WeakPolarHBondContact CA-SG 3.46Å; C231-C262 HydrophobicContact CB-CB 3.78Å; C231-C262 WeakPolarHBondContact CB-SG 3.3Å; C231-C262 WeakPolarHBondContact SG-CB 3.4Å; C231-C262 CovalentContact SG-SG 2.03Å; C231-C262 PolarHBondContact SG-SG 3.33Å
232	L	91	Very high	82.3	Confident	22 Å²	22	73.3 Å²	73.3	12%	0.115	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-62.8	160.2	174.5	-68.1	176.1	0	0	0	111.2	L208 L211 Q213 T230 H234 A235	L208-L232 HydrophobicContact CD2-CD1 4.41Å; L208-L232 HydrophobicContact CD2-CD2 3.94Å; L211-L232 WeakPolarHBondContact O-CG 3.08Å; L211-L232 PolarHBondContact O-N 3.4Å; Q213-L232 HydrophobicContact CB-CD2 4.21Å; T230-L232 PolarHBondContact O-N 2.79Å; L232-H234 PolarHBondContact O-N 3Å; L232-A235 VanDerWaalsContact O-CB 3.28Å; L232-A235 WeakPolarHBondContact O-CB 3.46Å; L232-A235 PolarHBondContact O-N 3.06Å
233	P	89.6	Confident	82.4	Confident	101 Å²	101	68.7 Å²	68.7	66%	0.656	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	138.2	174.5	-26.4	35.1	0	0	0	111.8	A235	P233-A235 PolarHBondContact O-N 3.18Å
234	H	90.5	Very high	82.7	Confident	81 Å²	81	69.4 Å²	69.4	38%	0.375	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	23.8	-175.2	-47.1	-68.8	0	0	0	114.4	L232 C264 E265 Y268 C277	L232-H234 PolarHBondContact O-N 3Å; H234-C264 CarbonylContact O-C 3.6Å; H234-C264 WeakPolarHBondContact O-CA 3.49Å; H234-E265 PolarHBondContact O-N 2.66Å; H234-Y268 HydrophobicContact CB-CD1 3.67Å; H234-Y268 HydrophobicContact CB-CD2 3.95Å; H234-Y268 HydrophobicContact CB-CE1 3.84Å; H234-Y268 HydrophobicContact CB-CE2 4.12Å; H234-Y268 HydrophobicContact CB-CG 3.75Å; H234-Y268 AromaticContact CD2-CE1 3.44Å; H234-Y268 VanDerWaalsContact CD2-CE1 3.44Å; H234-Y268 WeakPolarHBondContact CD2-CE1 3.46Å; H234-Y268 AromaticContact CD2-CZ 3.84Å; H234-Y268 AromaticContact CE1-CZ 3.63Å; H234-Y268 PolarHBondContact CE1-OH 2.82Å; H234-Y268 AromaticContact CG-CD1 3.79Å; H234-Y268 AromaticContact CG-CE1 3.4Å; H234-Y268 VanDerWaalsContact CG-CE1 3.4Å; H234-Y268 AromaticContact CG-CE2 3.94Å; H234-Y268 AromaticContact CG-CZ 3.5Å; H234-Y268 VanDerWaalsContact CG-CZ 3.5Å; H234-Y268 AromaticContact ND1-CE1 3.79Å; H234-Y268 AromaticContact ND1-CE2 3.73Å; H234-Y268 AromaticContact ND1-CZ 3.37Å; H234-Y268 PolarHBondContact ND1-OH 3.34Å; H234-Y268 AromaticContact NE2-CE1 3.84Å; H234-Y268 AromaticContact NE2-CZ 3.93Å; H234-C277 HydrophobicContact CB-CB 4.09Å
235	A	89.6	Confident	82.9	Confident	11 Å²	11	65 Å²	65	9%	0.091	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	142.8	170.8	0	0	0	0	0	111.2	L211 C231 L232 P233 C262 H263	L211-A235 HydrophobicContact CB-CB 4.37Å; C231-A235 HydrophobicContact CB-CB 4.25Å; C231-A235 VanDerWaalsContact CB-O 3.3Å; C231-A235 WeakPolarHBondContact CB-O 3.44Å; L232-A235 VanDerWaalsContact O-CB 3.28Å; L232-A235 WeakPolarHBondContact O-CB 3.46Å; L232-A235 PolarHBondContact O-N 3.06Å; P233-A235 PolarHBondContact O-N 3.18Å; A235-C262 HydrophobicContact CB-CB 3.96Å; A235-H263 CarbonylContact C-O 3.59Å; A235-H263 VanDerWaalsContact CA-O 3.28Å; A235-H263 WeakPolarHBondContact CA-O 3.46Å
236	Q	88.2	Confident	83.1	Confident	111 Å²	111	66.3 Å²	66.3	52%	0.519	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	140.6	-179.4	-166.1	175.5	48.2	0	0	111.5	C262 H263 E265 M289	Q236-C262 WeakPolarHBondContact O-CA 3.36Å; Q236-H263 PolarHBondContact N-O 3.27Å; Q236-H263 PolarHBondContact O-N 3.31Å; Q236-E265 HydrophobicContact CB-CG 4.26Å; Q236-M289 HydrophobicContact CB-CE 4.12Å
237	A	84.3	Confident	83.1	Confident	32 Å²	32	61.4 Å²	61.4	26%	0.264	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	145.4	172.1	0	0	0	0	0	110.6	C231	C231-A237 PolarHBondContact SG-N 3.03Å; C231-A237 VanDerWaalsContact SG-N 3.45Å
238	S	75.5	Confident	83.1	Confident	44 Å²	44	62.8 Å²	62.8	31%	0.308	37%	0.372	S	S	.	.			trans	-61.7	137.6	173.4	-177	0	0	0	0	110	R240	S238-R240 PolarHBondContact O-N 3.28Å
239	P	67.1	Low	83	Confident	133 Å²	133	59.4 Å²	59.4	86%	0.864	34%	0.344	S	S	*	.	S	Bend	trans	-66.8	-0.1	-176	24.2	-33.6	0	0	0	114.9
240	R	72.3	Confident	82.8	Confident	182 Å²	182	59 Å²	59	69%	0.687	34%	0.338	S	S	*	.	S	Bend	trans	-81.8	146.4	174.1	-65.7	-179.4	-165.9	163.8	7.1	110.5	S238 S242 G243	S238-R240 PolarHBondContact O-N 3.28Å; R240-S242 PolarHBondContact O-N 3.45Å; R240-S242 VanDerWaalsContact O-N 3.11Å; R240-G243 WeakPolarHBondContact O-CA 3.25Å; R240-G243 PolarHBondContact O-N 2.9Å
241	P	59.3	Low	82.3	Confident	118 Å²	118	56.1 Å²	56.1	77%	0.766	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.7	-179.3	20.9	-30.7	0	0	0	114.6	G243	P241-G243 VanDerWaalsContact C-N 3.32Å
242	S	61.3	Low	81.8	Confident	83 Å²	83	58.6 Å²	58.6	58%	0.58	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-4.8	170.8	53.7	0	0	0	0	114.2	R240 G260	R240-S242 PolarHBondContact O-N 3.45Å; R240-S242 VanDerWaalsContact O-N 3.11Å; S242-G260 WeakPolarHBondContact O-CA 3.1Å
243	G	67.3	Low	81.4	Confident	9 Å²	9	57.6 Å²	57.6	9%	0.093	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-24.1	-175.3	0	0	0	0	0	114.7	R240 P241 R261	R240-G243 WeakPolarHBondContact O-CA 3.25Å; R240-G243 PolarHBondContact O-N 2.9Å; P241-G243 VanDerWaalsContact C-N 3.32Å; G243-R261 PolarHBondContact O-N 3.45Å
244	A	82.7	Confident	81.3	Confident	44 Å²	44	57.6 Å²	57.6	36%	0.364	32%	0.318	S	S	.	.	S	Bend	trans	-67.7	127.2	179.7	0	0	0	0	0	111.1	R246	A244-R246 PolarHBondContact O-N 3.04Å
245	P	90.6	Very high	81.2	Confident	8 Å²	8	55 Å²	55	5%	0.052	31%	0.305	C	S	.	.			trans	-69.1	126.9	-175.8	31.2	-38.4	0	0	0	111.2	A212 F214 G229 V259	A212-P245 HydrophobicContact CB-CB 3.44Å; A212-P245 VanDerWaalsContact CB-CB 3.44Å; A212-P245 HydrophobicContact CB-CG 3.55Å; F214-P245 HydrophobicContact CZ-CB 3.97Å; G229-P245 PolarHBondContact N-O 2.77Å; P245-V259 CarbonylContact C-O 3.55Å; P245-V259 VanDerWaalsContact CA-O 3.31Å; P245-V259 WeakPolarHBondContact CA-O 3.23Å
246	R	90.4	Very high	81.1	Confident	73 Å²	73	57.6 Å²	57.6	28%	0.275	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	146.8	-179.4	-71.1	-179.6	-78.7	167.8	-2.2	110.9	E226 V227 A244 V259	E226-R246 WeakPolarHBondContact OE1-CD 3.47Å; E226-R246 IonicContact OE1-CZ 3.21Å; E226-R246 IonicContact OE1-NE 3.54Å; E226-R246 IonicContact OE1-NH1 3.84Å; E226-R246 PolarHBondContact OE1-NH1 3.19Å; E226-R246 IonicContact OE2-NH1 3.35Å; V227-R246 WeakPolarHBondContact O-CA 3.31Å; A244-R246 PolarHBondContact O-N 3.04Å; R246-V259 HydrophobicContact CB-CB 4.49Å; R246-V259 PolarHBondContact N-O 3.27Å; R246-V259 PolarHBondContact O-N 2.87Å
247	M	90.5	Very high	80.8	Confident	7 Å²	7	57 Å²	57	3%	0.034	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	161.7	174.4	-70.8	-164.3	79.5	0	0	110.5	T207 N209 F214 V227 W255 P258	T207-M247 HydrophobicContact CG2-SD 4.48Å; N209-M247 HydrophobicContact CB-SD 4.08Å; F214-M247 HydrophobicContact CD1-CB 3.91Å; F214-M247 HydrophobicContact CD1-CG 3.94Å; F214-M247 HydrophobicContact CD1-SD 4.4Å; F214-M247 HydrophobicContact CD2-CG 4.31Å; F214-M247 HydrophobicContact CD2-SD 3.88Å; F214-M247 HydrophobicContact CE1-CB 3.81Å; F214-M247 HydrophobicContact CE1-CG 3.56Å; F214-M247 HydrophobicContact CE1-SD 4.38Å; F214-M247 HydrophobicContact CE2-CG 3.96Å; F214-M247 HydrophobicContact CE2-SD 3.87Å; F214-M247 HydrophobicContact CG-CG 4.29Å; F214-M247 HydrophobicContact CG-SD 4.15Å; F214-M247 HydrophobicContact CZ-CB 4.33Å; F214-M247 HydrophobicContact CZ-CG 3.56Å; F214-M247 HydrophobicContact CZ-SD 4.12Å; V227-M247 PolarHBondContact N-O 2.86Å; V227-M247 PolarHBondContact O-N 2.85Å; M247-W255 HydrophobicContact CB-CD2 4.38Å; M247-W255 HydrophobicContact CB-CE3 3.48Å; M247-W255 VanDerWaalsContact CB-CE3 3.48Å; M247-W255 HydrophobicContact CB-CZ3 3.66Å; M247-W255 HydrophobicContact CE-CB 3.65Å; M247-W255 HydrophobicContact CE-CG 4.23Å; M247-W255 HydrophobicContact SD-CD2 4.47Å; M247-W255 HydrophobicContact SD-CE3 4.45Å; M247-P258 HydrophobicContact CE-CB 4.11Å; M247-P258 HydrophobicContact CG-CB 4.2Å; M247-P258 HydrophobicContact SD-CB 4.42Å
248	H	90.3	Very high	80.8	Confident	43 Å²	43	58.3 Å²	58.3	20%	0.199	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.4	179.6	-64.1	78.7	0	0	0	110.5	L224 V225 E226 L256	L224-H248 HydrophobicContact CB-CB 4.39Å; L224-H248 HydrophobicContact CD2-CB 4.15Å; V225-H248 CarbonylContact O-C 3.48Å; V225-H248 VanDerWaalsContact O-CA 3.28Å; V225-H248 WeakPolarHBondContact O-CA 3.44Å; E226-H248 IonicContact OE2-NE2 2.68Å; H248-L256 HydrophobicContact CB-CB 4.4Å; H248-L256 PolarHBondContact N-O 3.07Å; H248-L256 PolarHBondContact O-N 3.16Å
249	C	90.1	Very high	81.3	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	121.5	174.2	-179	0	0	0	0	110	C204 T217 L224 V225 V227 W255	C204-C249 HydrophobicContact CB-CB 3.87Å; C204-C249 WeakPolarHBondContact CB-SG 3.44Å; C204-C249 WeakPolarHBondContact SG-CA 3.5Å; C204-C249 WeakPolarHBondContact SG-CB 3.32Å; C204-C249 CovalentContact SG-SG 2.03Å; C204-C249 PolarHBondContact SG-SG 3.03Å; T217-C249 HydrophobicContact CG2-CB 4.43Å; L224-C249 WeakPolarHBondContact CA-O 3.34Å; V225-C249 HydrophobicContact CB-CB 4.38Å; V225-C249 PolarHBondContact N-O 2.86Å; V225-C249 PolarHBondContact O-N 2.79Å; V227-C249 HydrophobicContact CG2-CB 4.49Å; C249-W255 HydrophobicContact CB-CE3 4.32Å; C249-W255 HydrophobicContact CB-CH2 4.48Å; C249-W255 HydrophobicContact CB-CZ3 4.03Å
250	S	86.8	Confident	82.1	Confident	6 Å²	6	53.9 Å²	53.9	4%	0.042	30%	0.302	C	S	.	.			trans	-79.4	159.2	178.8	82.7	0	0	0	0	112.6	P219 D252 G253 E254	P219-S250 VanDerWaalsContact CB-O 3.32Å; P219-S250 WeakPolarHBondContact CB-O 3.37Å; P219-S250 WeakPolarHBondContact CG-O 3.1Å; S250-D252 PolarHBondContact O-N 2.95Å; S250-D252 VanDerWaalsContact O-N 3.11Å; S250-D252 PolarHBondContact OG-N 2.86Å; S250-G253 PolarHBondContact O-N 3.17Å; S250-E254 PolarHBondContact N-O 2.94Å; S250-E254 WeakPolarHBondContact OG-CB 3.47Å; S250-E254 PolarHBondContact OG-N 2.85Å; S250-E254 PolarHBondContact OG-O 2.88Å
251	P	80.9	Confident	82.8	Confident	34 Å²	34	50.2 Å²	50.2	22%	0.221	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-26.2	170.7	-29.4	38	0	0	0	114.8	G253	P251-G253 VanDerWaalsContact C-N 3.32Å
252	D	79.8	Confident	84.2	Confident	89 Å²	89	44.6 Å²	44.6	48%	0.476	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	5.9	-178.8	-53.5	-52.6	0	0	0	112.5	T25 Q202 S250	T25-D252 WeakPolarHBondContact CG2-O 3.32Å; Q202-D252 PolarHBondContact OE1-O 3.07Å; Q202-D252 VanDerWaalsContact OE1-O 3.06Å; S250-D252 PolarHBondContact O-N 2.95Å; S250-D252 VanDerWaalsContact O-N 3.11Å; S250-D252 PolarHBondContact OG-N 2.86Å
253	G	83.1	Confident	85.5	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.238	C	C	.	.	S	Bend	trans	77.3	22.2	179.4	0	0	0	0	0	114.2	C204 S250 P251	C204-G253 WeakPolarHBondContact CA-O 3.46Å; S250-G253 PolarHBondContact O-N 3.17Å; P251-G253 VanDerWaalsContact C-N 3.32Å
254	E	86.8	Confident	86.6	Confident	102 Å²	102	43.2 Å²	43.2	48%	0.477	23%	0.234	S	C	.	.			trans	-98.6	139.5	176.9	-66.4	-170.6	161.9	0	0	111.9	T25 S250 L256	T25-E254 HydrophobicContact CG2-CB 4.42Å; T25-E254 HydrophobicContact CG2-CG 3.29Å; S250-E254 PolarHBondContact N-O 2.94Å; S250-E254 WeakPolarHBondContact OG-CB 3.47Å; S250-E254 PolarHBondContact OG-N 2.85Å; S250-E254 PolarHBondContact OG-O 2.88Å; E254-L256 HydrophobicContact CB-CD2 4.4Å
255	W	89.2	Confident	87	Confident	26 Å²	26	44.2 Å²	44.2	10%	0.098	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	120.7	169.8	-79.2	119.1	0	0	0	111	C204 P205 T207 F214 V227 M247 C249	C204-W255 HydrophobicContact CB-CD2 3.91Å; C204-W255 HydrophobicContact CB-CE3 4.44Å; C204-W255 HydrophobicContact CB-CG 4.31Å; C204-W255 HydrophobicContact CB-CH2 4.32Å; C204-W255 HydrophobicContact CB-CZ2 3.76Å; P205-W255 PolarHBondContact O-NE1 3.44Å; T207-W255 HydrophobicContact CG2-CD2 4.49Å; T207-W255 HydrophobicContact CG2-CG 4.25Å; F214-W255 HydrophobicContact CB-CH2 4.09Å; F214-W255 HydrophobicContact CB-CZ2 3.86Å; V227-W255 HydrophobicContact CB-CH2 3.74Å; V227-W255 HydrophobicContact CB-CZ3 3.8Å; V227-W255 HydrophobicContact CG1-CH2 3.92Å; V227-W255 HydrophobicContact CG1-CZ3 4.47Å; V227-W255 HydrophobicContact CG2-CH2 3.68Å; V227-W255 HydrophobicContact CG2-CZ3 3.72Å; M247-W255 HydrophobicContact CB-CD2 4.38Å; M247-W255 HydrophobicContact CB-CE3 3.48Å; M247-W255 VanDerWaalsContact CB-CE3 3.48Å; M247-W255 HydrophobicContact CB-CZ3 3.66Å; M247-W255 HydrophobicContact CE-CB 3.65Å; M247-W255 HydrophobicContact CE-CG 4.23Å; M247-W255 HydrophobicContact SD-CD2 4.47Å; M247-W255 HydrophobicContact SD-CE3 4.45Å; C249-W255 HydrophobicContact CB-CE3 4.32Å; C249-W255 HydrophobicContact CB-CH2 4.48Å; C249-W255 HydrophobicContact CB-CZ3 4.03Å
256	L	86.1	Confident	87	Confident	65 Å²	65	46.1 Å²	46.1	34%	0.34	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	154.1	-179.5	-57.9	-177.7	0	0	0	111.3	L224 H248 E254	L224-L256 HydrophobicContact CD2-CD1 3.64Å; H248-L256 HydrophobicContact CB-CB 4.4Å; H248-L256 PolarHBondContact N-O 3.07Å; H248-L256 PolarHBondContact O-N 3.16Å; E254-L256 HydrophobicContact CB-CD2 4.4Å
257	V	82.4	Confident	87	Confident	100 Å²	100	42.6 Å²	42.6	61%	0.606	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	32.7	90.6	172.6	-168.5	0	0	0	0	114.5	V259	V257-V259 HydrophobicContact CG1-CG2 4.13Å
258	P	84.3	Confident	87.1	Confident	59 Å²	59	44.8 Å²	44.8	38%	0.383	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	130.9	169.1	28.9	-32	0	0	0	111.2	M247	M247-P258 HydrophobicContact CE-CB 4.11Å; M247-P258 HydrophobicContact CG-CB 4.2Å; M247-P258 HydrophobicContact SD-CB 4.42Å
259	V	85.4	Confident	87.1	Confident	49 Å²	49	45 Å²	45	30%	0.297	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128.2	176.8	-177.2	0	0	0	0	108.6	P245 R246 V257	P245-V259 CarbonylContact C-O 3.55Å; P245-V259 VanDerWaalsContact CA-O 3.31Å; P245-V259 WeakPolarHBondContact CA-O 3.23Å; R246-V259 HydrophobicContact CB-CB 4.49Å; R246-V259 PolarHBondContact N-O 3.27Å; R246-V259 PolarHBondContact O-N 2.87Å; V257-V259 HydrophobicContact CG1-CG2 4.13Å
260	G	85.1	Confident	87	Confident	35 Å²	35	48.3 Å²	48.3	36%	0.361	26%	0.255	S	S	.	.			trans	76.7	169.2	-178.2	0	0	0	0	0	114	S242	S242-G260 WeakPolarHBondContact O-CA 3.1Å
261	R	86.5	Confident	86.6	Confident	104 Å²	104	48.9 Å²	48.9	39%	0.392	26%	0.262	S	S	.	.			trans	-157.4	155.9	176.7	69.8	177.7	-73.4	176.5	0	110.5	G243 H263 E270	G243-R261 PolarHBondContact O-N 3.45Å; R261-H263 WeakPolarHBondContact CD-NE2 3.31Å; R261-H263 VanDerWaalsContact CG-CE1 3.49Å; R261-H263 WeakPolarHBondContact CG-CE1 3.19Å; R261-E270 IonicContact CZ-OE1 2.69Å; R261-E270 IonicContact NH2-OE1 3.14Å; R261-E270 PolarHBondContact NH2-OE1 3.46Å; R261-E270 IonicContact NH2-OE2 2.7Å
262	C	88.6	Confident	85.9	Confident	0 Å²	0	52 Å²	52	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	159.6	165.7	-49.9	0	0	0	0	110.3	G210 L211 C231 A235 Q236	G210-C262 PolarHBondContact O-N 3.39Å; L211-C262 HydrophobicContact CB-CB 3.91Å; C231-C262 WeakPolarHBondContact CA-SG 3.46Å; C231-C262 HydrophobicContact CB-CB 3.78Å; C231-C262 WeakPolarHBondContact CB-SG 3.3Å; C231-C262 WeakPolarHBondContact SG-CB 3.4Å; C231-C262 CovalentContact SG-SG 2.03Å; C231-C262 PolarHBondContact SG-SG 3.33Å; A235-C262 HydrophobicContact CB-CB 3.96Å; Q236-C262 WeakPolarHBondContact O-CA 3.36Å
263	H	88.6	Confident	84.9	Confident	62 Å²	62	51.9 Å²	51.9	29%	0.287	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	139.8	174.8	-57.5	84.3	0	0	0	108.7	A235 Q236 R261 E265 M289	A235-H263 CarbonylContact C-O 3.59Å; A235-H263 VanDerWaalsContact CA-O 3.28Å; A235-H263 WeakPolarHBondContact CA-O 3.46Å; Q236-H263 PolarHBondContact N-O 3.27Å; Q236-H263 PolarHBondContact O-N 3.31Å; R261-H263 WeakPolarHBondContact CD-NE2 3.31Å; R261-H263 VanDerWaalsContact CG-CE1 3.49Å; R261-H263 WeakPolarHBondContact CG-CE1 3.19Å; H263-E265 PolarHBondContact O-N 2.69Å; H263-M289 HydrophobicContact CB-SD 4.23Å
264	C	90	Very high	83.9	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.007	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	134.2	177.3	-61	0	0	0	0	111.4	L211 H234 C277 R286	L211-C264 VanDerWaalsContact CD1-SG 3.52Å; H234-C264 CarbonylContact O-C 3.6Å; H234-C264 WeakPolarHBondContact O-CA 3.49Å; C264-C277 WeakPolarHBondContact CA-SG 3.47Å; C264-C277 HydrophobicContact CB-CB 3.7Å; C264-C277 WeakPolarHBondContact CB-SG 3.48Å; C264-C277 WeakPolarHBondContact SG-CA 3.34Å; C264-C277 WeakPolarHBondContact SG-CB 3.46Å; C264-C277 CovalentContact SG-SG 2.03Å; C264-C277 PolarHBondContact SG-SG 3.47Å; C264-R286 PolarHBondContact O-NH1 3.47Å
265	E	91.6	Very high	82.9	Confident	66 Å²	66	56.4 Å²	56.4	31%	0.308	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-58.5	157.6	178.2	-66.5	175.8	166.2	0	0	112.6	H234 Q236 H263 G267 Y268 M289	H234-E265 PolarHBondContact O-N 2.66Å; Q236-E265 HydrophobicContact CB-CG 4.26Å; H263-E265 PolarHBondContact O-N 2.69Å; E265-G267 PolarHBondContact O-N 2.88Å; E265-Y268 PolarHBondContact O-N 3.23Å; E265-M289 HydrophobicContact CB-CE 4.32Å; E265-M289 HydrophobicContact CG-CE 4.1Å
266	P	91.3	Very high	82.7	Confident	47 Å²	47	55.9 Å²	55.9	31%	0.305	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	138.7	171.8	-27.6	36.1	0	0	0	111.5	Y268 T309	P266-Y268 VanDerWaalsContact C-N 3.34Å; P266-T309 HydrophobicContact CB-CG2 3.7Å
267	G	90.7	Very high	82.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	-8.1	-172.7	0	0	0	0	0	115.1	E265 C280 R286 G307	E265-G267 PolarHBondContact O-N 2.88Å; G267-C280 PolarHBondContact O-N 3.24Å; G267-C280 PolarHBondContact O-SG 2.97Å; G267-R286 PolarHBondContact N-O 3.06Å; G267-G307 WeakPolarHBondContact CA-O 3.46Å; G267-G307 VanDerWaalsContact O-CA 3.28Å; G267-G307 WeakPolarHBondContact O-CA 3.32Å
268	Y	91.9	Very high	83.3	Confident	52 Å²	52	52.6 Å²	52.6	20%	0.204	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	146.6	179.4	-64.8	-102.1	0	0	0	110.8	H234 E265 P266 V278 A279 R286	H234-Y268 HydrophobicContact CB-CD1 3.67Å; H234-Y268 HydrophobicContact CB-CD2 3.95Å; H234-Y268 HydrophobicContact CB-CE1 3.84Å; H234-Y268 HydrophobicContact CB-CE2 4.12Å; H234-Y268 HydrophobicContact CB-CG 3.75Å; H234-Y268 AromaticContact CD2-CE1 3.44Å; H234-Y268 VanDerWaalsContact CD2-CE1 3.44Å; H234-Y268 WeakPolarHBondContact CD2-CE1 3.46Å; H234-Y268 AromaticContact CD2-CZ 3.84Å; H234-Y268 AromaticContact CE1-CZ 3.63Å; H234-Y268 PolarHBondContact CE1-OH 2.82Å; H234-Y268 AromaticContact CG-CD1 3.79Å; H234-Y268 AromaticContact CG-CE1 3.4Å; H234-Y268 VanDerWaalsContact CG-CE1 3.4Å; H234-Y268 AromaticContact CG-CE2 3.94Å; H234-Y268 AromaticContact CG-CZ 3.5Å; H234-Y268 VanDerWaalsContact CG-CZ 3.5Å; H234-Y268 AromaticContact ND1-CE1 3.79Å; H234-Y268 AromaticContact ND1-CE2 3.73Å; H234-Y268 AromaticContact ND1-CZ 3.37Å; H234-Y268 PolarHBondContact ND1-OH 3.34Å; H234-Y268 AromaticContact NE2-CE1 3.84Å; H234-Y268 AromaticContact NE2-CZ 3.93Å; E265-Y268 PolarHBondContact O-N 3.23Å; P266-Y268 VanDerWaalsContact C-N 3.34Å; Y268-V278 CarbonylContact C-O 3.52Å; Y268-V278 WeakPolarHBondContact CA-O 3.31Å; Y268-A279 VanDerWaalsContact CD1-CA 3.48Å; Y268-A279 HydrophobicContact CD1-CB 3.95Å; Y268-A279 HydrophobicContact CE1-CB 3.68Å; Y268-R286 WeakPolarHBondContact O-CD 3.5Å; Y268-R286 PolarHBondContact O-NH1 3.33Å
269	E	90.3	Very high	83.7	Confident	48 Å²	48	51 Å²	51	22%	0.224	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	163.5	174.5	66.1	178.2	-179.5	0	0	112.4	G271 C277 V278 H293 C294	E269-G271 PolarHBondContact O-N 2.9Å; E269-C277 CarbonylContact O-C 3.54Å; E269-C277 WeakPolarHBondContact O-CA 3.48Å; E269-V278 PolarHBondContact N-O 2.85Å; E269-V278 PolarHBondContact O-N 3.21Å; E269-H293 WeakPolarHBondContact OE2-CA 3.49Å; E269-C294 VanDerWaalsContact CG-SG 3.52Å; E269-C294 WeakPolarHBondContact OE2-CB 3.41Å; E269-C294 PolarHBondContact OE2-N 3.43Å
270	E	87.8	Confident	84	Confident	70 Å²	70	48.7 Å²	48.7	33%	0.327	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	117.9	175.4	-68.3	-172.3	-177.3	0	0	110.2	L211 R261	L211-E270 HydrophobicContact CD1-CG 3.86Å; L211-E270 WeakPolarHBondContact CD1-OE1 3.44Å; L211-E270 HydrophobicContact CD2-CG 4.27Å; L211-E270 HydrophobicContact CG-CG 4.43Å; R261-E270 IonicContact CZ-OE1 2.69Å; R261-E270 IonicContact NH2-OE1 3.14Å; R261-E270 PolarHBondContact NH2-OE1 3.46Å; R261-E270 IonicContact NH2-OE2 2.7Å
271	G	78.6	Confident	84.4	Confident	18 Å²	18	50.1 Å²	50.1	19%	0.186	30%	0.301	C	S	.	.			trans	-62.3	147.5	175.6	0	0	0	0	0	111.3	E269 S273 G274 G276	E269-G271 PolarHBondContact O-N 2.9Å; G271-S273 PolarHBondContact O-N 2.98Å; G271-G274 PolarHBondContact O-N 3.4Å; G271-G276 PolarHBondContact N-O 2.95Å
272	G	66.4	Low	84.6	Confident	99 Å²	99	48.6 Å²	48.6	100%	1.021	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	6.4	-169	0	0	0	0	0	118.6
273	S	59.4	Low	84.6	Confident	86 Å²	86	50 Å²	50	60%	0.601	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.3	8	171.4	57.5	0	0	0	0	114.3	G271 K275	G271-S273 PolarHBondContact O-N 2.98Å; S273-K275 PolarHBondContact O-N 3.47Å; S273-K275 WeakPolarHBondContact OG-CG 3.47Å
274	G	61.5	Low	84.8	Confident	37 Å²	37	47.8 Å²	47.8	38%	0.381	31%	0.313	S	S	.	.	S	Bend	trans	68.5	12.4	-176.7	0	0	0	0	0	114.4	G271 G276	G271-G274 PolarHBondContact O-N 3.4Å; G274-G276 VanDerWaalsContact C-N 3.33Å; G274-G276 PolarHBondContact O-N 2.75Å
275	K	66	Low	84.9	Confident	160 Å²	160	48 Å²	48	70%	0.696	31%	0.313	S	S	*	.	S	Bend	trans	-86.5	7.7	-174.8	-69.6	-172.7	178.8	-174.8	0	114.9	S273	S273-K275 PolarHBondContact O-N 3.47Å; S273-K275 WeakPolarHBondContact OG-CG 3.47Å
276	G	84.4	Confident	84.9	Confident	15 Å²	15	45.3 Å²	45.3	16%	0.155	30%	0.3	C	S	.	.			trans	152.1	176.8	176.8	0	0	0	0	0	113.7	G271 G274	G271-G276 PolarHBondContact N-O 2.95Å; G274-G276 VanDerWaalsContact C-N 3.33Å; G274-G276 PolarHBondContact O-N 2.75Å
277	C	90.3	Very high	84.7	Confident	18 Å²	18	46.6 Å²	46.6	12%	0.122	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.7	178.1	-63.4	0	0	0	0	110	H234 C264 E269	H234-C277 HydrophobicContact CB-CB 4.09Å; C264-C277 WeakPolarHBondContact CA-SG 3.47Å; C264-C277 HydrophobicContact CB-CB 3.7Å; C264-C277 WeakPolarHBondContact CB-SG 3.48Å; C264-C277 WeakPolarHBondContact SG-CA 3.34Å; C264-C277 WeakPolarHBondContact SG-CB 3.46Å; C264-C277 CovalentContact SG-SG 2.03Å; C264-C277 PolarHBondContact SG-SG 3.47Å; E269-C277 CarbonylContact O-C 3.54Å; E269-C277 WeakPolarHBondContact O-CA 3.48Å
278	V	91.8	Very high	84.4	Confident	79 Å²	79	48.9 Å²	48.9	48%	0.479	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	133.5	-178.5	-176.5	0	0	0	0	108.4	Y268 E269	Y268-V278 CarbonylContact C-O 3.52Å; Y268-V278 WeakPolarHBondContact CA-O 3.31Å; E269-V278 PolarHBondContact N-O 2.85Å; E269-V278 PolarHBondContact O-N 3.21Å
279	A	92.1	Very high	83.9	Confident	25 Å²	25	49.2 Å²	49.2	21%	0.207	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	140.6	177.7	0	0	0	0	0	110.2	Y268 E306	Y268-A279 VanDerWaalsContact CD1-CA 3.48Å; Y268-A279 HydrophobicContact CD1-CB 3.95Å; Y268-A279 HydrophobicContact CE1-CB 3.68Å; A279-E306 HydrophobicContact CB-CB 4.32Å
280	C	92.4	Very high	83.3	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-56.6	131.8	173.1	-67.6	0	0	0	0	109.6	G267 R286 C294 E306 G307	G267-C280 PolarHBondContact O-N 3.24Å; G267-C280 PolarHBondContact O-SG 2.97Å; C280-R286 VanDerWaalsContact SG-CB 3.56Å; C280-C294 WeakPolarHBondContact CA-SG 3.22Å; C280-C294 HydrophobicContact CB-CB 3.8Å; C280-C294 WeakPolarHBondContact CB-SG 3.27Å; C280-C294 WeakPolarHBondContact SG-CB 3.43Å; C280-C294 CovalentContact SG-SG 2.03Å; C280-C294 PolarHBondContact SG-SG 3.18Å; C280-E306 WeakPolarHBondContact O-CA 3.48Å; C280-G307 PolarHBondContact O-N 3.15Å
281	P	91.9	Very high	83.1	Confident	66 Å²	66	51.9 Å²	51.9	43%	0.429	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-64.5	156	-179.4	26.9	-34.2	0	0	0	110.7	G283 S284	P281-G283 PolarHBondContact O-N 2.88Å; P281-S284 WeakPolarHBondContact O-CA 3.5Å; P281-S284 WeakPolarHBondContact O-CB 3.45Å; P281-S284 PolarHBondContact O-N 2.86Å
282	S	91	Very high	83	Confident	72 Å²	72	55 Å²	55	50%	0.503	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	134.7	174.5	-60.5	0	0	0	0	111.4	S284 E304	S282-S284 VanDerWaalsContact C-N 3.33Å; S282-E304 PolarHBondContact OG-O 2.81Å
283	G	89.8	Confident	84	Confident	30 Å²	30	55.7 Å²	55.7	31%	0.309	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	6.8	-171.9	0	0	0	0	0	115.2	P281 C297 A303	P281-G283 PolarHBondContact O-N 2.88Å; G283-C297 WeakPolarHBondContact O-CB 3.38Å; G283-C297 PolarHBondContact O-N 3.34Å; G283-C297 PolarHBondContact O-SG 3.37Å; G283-C297 VanDerWaalsContact O-SG 3.42Å; G283-A303 PolarHBondContact N-O 3.09Å
284	S	92.4	Very high	85.6	Confident	15 Å²	15	52.6 Å²	52.6	11%	0.105	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	158	173.1	-54.6	0	0	0	0	111.4	P281 S282 L295	P281-S284 WeakPolarHBondContact O-CA 3.5Å; P281-S284 WeakPolarHBondContact O-CB 3.45Å; P281-S284 PolarHBondContact O-N 2.86Å; S282-S284 VanDerWaalsContact C-N 3.33Å; S284-L295 CarbonylContact C-O 3.58Å; S284-L295 WeakPolarHBondContact CA-O 3.15Å; S284-L295 VanDerWaalsContact CB-O 3.3Å; S284-L295 WeakPolarHBondContact CB-O 3.32Å
285	Y	91.5	Very high	87	Confident	4 Å²	4	54.4 Å²	54.4	2%	0.016	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	160	-178.3	78.5	-69.4	0	0	0	112.4	M287 L295 A308 T309 C311 P325 Q326	Y285-M287 HydrophobicContact CE2-CB 4.34Å; Y285-L295 HydrophobicContact CD1-CB 4.17Å; Y285-L295 WeakPolarHBondContact CD1-O 3.28Å; Y285-L295 HydrophobicContact CE1-CB 3.7Å; Y285-L295 PolarHBondContact N-O 3.05Å; Y285-L295 PolarHBondContact O-N 3.11Å; Y285-A308 CarbonylContact C-O 3.5Å; Y285-A308 WeakPolarHBondContact CA-O 3.38Å; Y285-A308 WeakPolarHBondContact CB-O 3.46Å; Y285-T309 WeakPolarHBondContact CD2-O 3.49Å; Y285-C311 WeakPolarHBondContact CD1-SG 3.25Å; Y285-C311 VanDerWaalsContact CG-SG 3.59Å; Y285-P325 HydrophobicContact CE2-CB 4.02Å; Y285-P325 HydrophobicContact CE2-CG 4.18Å; Y285-Q326 VanDerWaalsContact OH-CA 3.22Å; Y285-Q326 WeakPolarHBondContact OH-CA 3.42Å; Y285-Q326 PolarHBondContact OH-N 2.87Å
286	R	91.3	Very high	88.2	Confident	10 Å²	10	52.1 Å²	52.1	4%	0.038	31%	0.31	C	S	.	.			trans	-140.8	115.3	169.9	-176.2	-171	176.9	-176.9	2.3	110.5	C264 G267 Y268 C280 D288 M289 T291 A308 T309	C264-R286 PolarHBondContact O-NH1 3.47Å; G267-R286 PolarHBondContact N-O 3.06Å; Y268-R286 WeakPolarHBondContact O-CD 3.5Å; Y268-R286 PolarHBondContact O-NH1 3.33Å; C280-R286 VanDerWaalsContact SG-CB 3.56Å; R286-D288 PolarHBondContact NE-O 3.32Å; R286-D288 VanDerWaalsContact NE-O 3.08Å; R286-M289 PolarHBondContact NH2-O 3.04Å; R286-T291 HydrophobicContact CG-CG2 4.41Å; R286-T291 PolarHBondContact NE-O 3.33Å; R286-T291 PolarHBondContact NH2-O 3.05Å; R286-A308 PolarHBondContact N-O 3.22Å; R286-T309 WeakPolarHBondContact O-CA 3.45Å
287	M	86.4	Confident	88.6	Confident	75 Å²	75	52.5 Å²	52.5	37%	0.369	31%	0.311	S	S	.	.			trans	-81.7	-35.3	-170.2	61	-179.7	-81.4	0	0	114.9	Y285 T309 P325	Y285-M287 HydrophobicContact CE2-CB 4.34Å; M287-T309 WeakPolarHBondContact CA-O 3.31Å; M287-P325 HydrophobicContact CB-CG 4.4Å; M287-P325 HydrophobicContact CE-CG 4.34Å; M287-P325 HydrophobicContact SD-CG 3.76Å
288	D	85.7	Confident	88.7	Confident	47 Å²	47	52.8 Å²	52.8	25%	0.251	31%	0.312	S	S	.	.	S	Bend	trans	-148.1	173.6	-174.1	60.1	32.7	0	0	0	112.3	R286 D290 T291	R286-D288 PolarHBondContact NE-O 3.32Å; R286-D288 VanDerWaalsContact NE-O 3.08Å; D288-D290 VanDerWaalsContact C-N 3.29Å; D288-D290 PolarHBondContact OD1-N 3.05Å; D288-T291 WeakPolarHBondContact OD1-CB 3.42Å; D288-T291 PolarHBondContact OD1-N 2.98Å; D288-T291 PolarHBondContact OD1-OG1 3.15Å
289	M	80.5	Confident	88.7	Confident	59 Å²	59	56.1 Å²	56.1	29%	0.291	32%	0.322	S	S	.	.	S	Bend	trans	-71	-24.8	178.6	-59.8	-68.4	-163.5	0	0	112.5	Q236 H263 E265 R286 T291	Q236-M289 HydrophobicContact CB-CE 4.12Å; H263-M289 HydrophobicContact CB-SD 4.23Å; E265-M289 HydrophobicContact CB-CE 4.32Å; E265-M289 HydrophobicContact CG-CE 4.1Å; R286-M289 PolarHBondContact NH2-O 3.04Å; M289-T291 VanDerWaalsContact C-N 3.33Å
290	D	78.9	Confident	88.7	Confident	152 Å²	152	58.7 Å²	58.7	81%	0.813	33%	0.33	S	S	*	.	S	Bend	trans	-76	-25	-177.9	-66.4	-37.3	0	0	0	112	D288 P292	D288-D290 VanDerWaalsContact C-N 3.29Å; D288-D290 PolarHBondContact OD1-N 3.05Å; D290-P292 WeakPolarHBondContact O-CD 3.45Å
291	T	82.4	Confident	88.7	Confident	22 Å²	22	59.1 Å²	59.1	14%	0.135	33%	0.333	C	S	.	.	S	Bend	trans	-75.2	118.3	172.2	-53.9	0	0	0	0	109.1	R286 D288 M289 H293 L295	R286-T291 HydrophobicContact CG-CG2 4.41Å; R286-T291 PolarHBondContact NE-O 3.33Å; R286-T291 PolarHBondContact NH2-O 3.05Å; D288-T291 WeakPolarHBondContact OD1-CB 3.42Å; D288-T291 PolarHBondContact OD1-N 2.98Å; D288-T291 PolarHBondContact OD1-OG1 3.15Å; M289-T291 VanDerWaalsContact C-N 3.33Å; T291-H293 WeakPolarHBondContact CG2-O 3.24Å; T291-L295 HydrophobicContact CG2-CD1 4.01Å; T291-L295 HydrophobicContact CG2-CG 4.09Å
292	P	77	Confident	88.7	Confident	85 Å²	85	58.4 Å²	58.4	55%	0.552	33%	0.327	S	S	*	.			trans	-76.5	-26.9	-170.2	27.5	-34.4	0	0	0	114.7	D290	D290-P292 WeakPolarHBondContact O-CD 3.45Å
293	H	88.3	Confident	88.7	Confident	112 Å²	112	55.3 Å²	55.3	52%	0.519	31%	0.306	S	S	.	.	S	Bend	trans	-140.4	159.9	-173.8	-58.8	-60.8	0	0	0	111.2	E269 T291 L295	E269-H293 WeakPolarHBondContact OE2-CA 3.49Å; T291-H293 WeakPolarHBondContact CG2-O 3.24Å; H293-L295 PolarHBondContact O-N 3.36Å
294	C	91.2	Very high	88.5	Confident	22 Å²	22	62 Å²	62	15%	0.149	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-62.7	129.5	173.5	-65.1	0	0	0	0	110.5	E269 C280	E269-C294 VanDerWaalsContact CG-SG 3.52Å; E269-C294 WeakPolarHBondContact OE2-CB 3.41Å; E269-C294 PolarHBondContact OE2-N 3.43Å; C280-C294 WeakPolarHBondContact CA-SG 3.22Å; C280-C294 HydrophobicContact CB-CB 3.8Å; C280-C294 WeakPolarHBondContact CB-SG 3.27Å; C280-C294 WeakPolarHBondContact SG-CB 3.43Å; C280-C294 CovalentContact SG-SG 2.03Å; C280-C294 PolarHBondContact SG-SG 3.18Å
295	L	91.1	Very high	88.2	Confident	75 Å²	75	65 Å²	65	39%	0.393	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	143.5	176.9	-61.1	177.8	0	0	0	109.4	S284 Y285 T291 H293	S284-L295 CarbonylContact C-O 3.58Å; S284-L295 WeakPolarHBondContact CA-O 3.15Å; S284-L295 VanDerWaalsContact CB-O 3.3Å; S284-L295 WeakPolarHBondContact CB-O 3.32Å; Y285-L295 HydrophobicContact CD1-CB 4.17Å; Y285-L295 WeakPolarHBondContact CD1-O 3.28Å; Y285-L295 HydrophobicContact CE1-CB 3.7Å; Y285-L295 PolarHBondContact N-O 3.05Å; Y285-L295 PolarHBondContact O-N 3.11Å; T291-L295 HydrophobicContact CG2-CD1 4.01Å; T291-L295 HydrophobicContact CG2-CG 4.09Å; H293-L295 PolarHBondContact O-N 3.36Å
296	T	92.4	Very high	88.1	Confident	111 Å²	111	71.5 Å²	71.5	68%	0.681	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	145.1	172.6	51.2	0	0	0	0	110.4
297	C	92.3	Very high	88.1	Confident	24 Å²	24	71.8 Å²	71.8	16%	0.162	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-60.2	131.2	176.1	-74.7	0	0	0	0	110.3	G283 S301 A303 C311	G283-C297 WeakPolarHBondContact O-CB 3.38Å; G283-C297 PolarHBondContact O-N 3.34Å; G283-C297 PolarHBondContact O-SG 3.37Å; G283-C297 VanDerWaalsContact O-SG 3.42Å; C297-S301 WeakPolarHBondContact CB-O 3Å; C297-A303 VanDerWaalsContact SG-CB 3.52Å; C297-C311 WeakPolarHBondContact CA-SG 3.18Å; C297-C311 HydrophobicContact CB-CB 3.78Å; C297-C311 WeakPolarHBondContact CB-SG 3.26Å; C297-C311 WeakPolarHBondContact SG-CB 3.38Å; C297-C311 CovalentContact SG-SG 2.04Å; C297-C311 PolarHBondContact SG-SG 2.91Å
298	P	91.9	Very high	88.3	Confident	24 Å²	24	68.7 Å²	68.7	16%	0.156	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-67.5	165.1	177	29.3	-34.9	0	0	0	110.8	S301 P325 A328	P298-S301 VanDerWaalsContact CD-OG 3.23Å; P298-S301 WeakPolarHBondContact CD-OG 3.35Å; P298-S301 WeakPolarHBondContact CG-OG 3.36Å; P298-S301 PolarHBondContact O-N 3.47Å; P298-S301 PolarHBondContact O-OG 2.99Å; P298-P325 WeakPolarHBondContact CG-O 3.24Å; P298-A328 HydrophobicContact CB-CB 4.33Å
299	Q	91.9	Very high	88.5	Confident	148 Å²	148	69.6 Å²	69.6	69%	0.692	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	143.6	-174.8	-66.9	-178.1	-11.1	0	0	112.7	S301 A328 C329	Q299-S301 PolarHBondContact O-N 2.87Å; Q299-A328 HydrophobicContact CB-CB 4.08Å; Q299-C329 PolarHBondContact O-N 3.24Å
300	H	92.2	Very high	89	Confident	80 Å²	80	71.1 Å²	71.1	37%	0.37	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	25.7	-177.4	-52.7	-62.1	0	0	0	114.6	E314 H317 C329	H300-E314 IonicContact ND1-OE2 2.68Å; H300-E314 PolarHBondContact O-N 3.18Å; H300-H317 HydrophobicContact CB-CB 4.19Å; H300-H317 AromaticContact CD2-CD2 3.99Å; H300-H317 AromaticContact CG-CD2 3.59Å; H300-H317 AromaticContact CG-NE2 3.69Å; H300-H317 AromaticContact ND1-NE2 3.66Å; H300-C329 HydrophobicContact CB-CB 4.08Å; H300-C329 WeakPolarHBondContact CB-O 3.44Å; H300-C329 VanDerWaalsContact O-CB 3.29Å; H300-C329 WeakPolarHBondContact O-CB 3.43Å
301	S	92.6	Very high	89.6	Confident	8 Å²	8	63.9 Å²	63.9	6%	0.056	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	148.2	172.7	77	0	0	0	0	110.3	C297 P298 Q299 C311 T312	C297-S301 WeakPolarHBondContact CB-O 3Å; P298-S301 VanDerWaalsContact CD-OG 3.23Å; P298-S301 WeakPolarHBondContact CD-OG 3.35Å; P298-S301 WeakPolarHBondContact CG-OG 3.36Å; P298-S301 PolarHBondContact O-N 3.47Å; P298-S301 PolarHBondContact O-OG 2.99Å; Q299-S301 PolarHBondContact O-N 2.87Å; S301-C311 WeakPolarHBondContact OG-CB 3.32Å; S301-T312 CarbonylContact C-O 3.52Å; S301-T312 WeakPolarHBondContact CA-O 3.16Å; S301-T312 WeakPolarHBondContact CB-O 3.46Å
302	T	91.4	Very high	90	Very high	51 Å²	51	67 Å²	67	31%	0.313	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	155.6	-176.5	58.4	0	0	0	0	110.5	C311 T312 E314	T302-C311 CarbonylContact O-C 3.59Å; T302-C311 WeakPolarHBondContact O-CA 3.38Å; T302-T312 PolarHBondContact N-O 3.03Å; T302-T312 PolarHBondContact O-N 3.41Å; T302-T312 PolarHBondContact O-OG1 3.19Å; T302-E314 HydrophobicContact CG2-CG 4.04Å
303	A	91.8	Very high	90.7	Very high	7 Å²	7	64.9 Å²	64.9	6%	0.058	36%	0.356	C	S	.	.			trans	-129.1	101.9	169.9	0	0	0	0	0	107.1	G283 C297 A308	G283-A303 PolarHBondContact N-O 3.09Å; C297-A303 VanDerWaalsContact SG-CB 3.52Å; A303-A308 HydrophobicContact CB-CB 3.56Å
304	E	84.5	Confident	90.8	Very high	172 Å²	172	63.3 Å²	63.3	80%	0.804	35%	0.349	S	S	*	.			trans	-74.8	-36.8	-176.2	-63.5	-174.1	169.9	0	0	111.8	S282	S282-E304 PolarHBondContact OG-O 2.81Å
305	S	86.4	Confident	90.7	Very high	77 Å²	77	68.2 Å²	68.2	54%	0.538	38%	0.383	S	S	.	.	S	Bend	trans	-84.7	141.8	177	57.8	0	0	0	0	112
306	E	90.3	Very high	90.5	Very high	141 Å²	141	66.2 Å²	66.2	66%	0.659	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	149.3	162.1	-63.3	-177.7	169.3	0	0	110.1	A279 C280	A279-E306 HydrophobicContact CB-CB 4.32Å; C280-E306 WeakPolarHBondContact O-CA 3.48Å
307	G	90.1	Very high	90.4	Very high	16 Å²	16	62 Å²	62	17%	0.165	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	79	20.9	178.2	0	0	0	0	0	114.9	G267 C280	G267-G307 WeakPolarHBondContact CA-O 3.46Å; G267-G307 VanDerWaalsContact O-CA 3.28Å; G267-G307 WeakPolarHBondContact O-CA 3.32Å; C280-G307 PolarHBondContact O-N 3.15Å
308	A	91.4	Very high	90.3	Very high	9 Å²	9	63.9 Å²	63.9	7%	0.074	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-66.2	136.1	-176.7	0	0	0	0	0	112.5	Y285 R286 A303	Y285-A308 CarbonylContact C-O 3.5Å; Y285-A308 WeakPolarHBondContact CA-O 3.38Å; Y285-A308 WeakPolarHBondContact CB-O 3.46Å; R286-A308 PolarHBondContact N-O 3.22Å; A303-A308 HydrophobicContact CB-CB 3.56Å
309	T	90.2	Very high	90.3	Very high	66 Å²	66	64.7 Å²	64.7	41%	0.405	36%	0.357	S	S	.	.	S	Bend	trans	-91.8	-16.8	173.4	55.8	0	0	0	0	112.8	P266 Y285 R286 M287	P266-T309 HydrophobicContact CB-CG2 3.7Å; Y285-T309 WeakPolarHBondContact CD2-O 3.49Å; R286-T309 WeakPolarHBondContact O-CA 3.45Å; M287-T309 WeakPolarHBondContact CA-O 3.31Å
310	I	90.5	Very high	90.1	Very high	91 Å²	91	58.2 Å²	58.2	47%	0.467	33%	0.33	S	S	.	.	S	Bend	trans	-152.1	144.7	-179.4	-176.5	159.6	0	0	0	109.8	P325	I310-P325 HydrophobicContact CD1-CB 3.88Å; I310-P325 HydrophobicContact CG1-CB 3.77Å
311	C	91	Very high	89.7	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-89.1	125.6	171	-55.9	0	0	0	0	110.7	Y285 C297 S301 T302 R319	Y285-C311 WeakPolarHBondContact CD1-SG 3.25Å; Y285-C311 VanDerWaalsContact CG-SG 3.59Å; C297-C311 WeakPolarHBondContact CA-SG 3.18Å; C297-C311 HydrophobicContact CB-CB 3.78Å; C297-C311 WeakPolarHBondContact CB-SG 3.26Å; C297-C311 WeakPolarHBondContact SG-CB 3.38Å; C297-C311 CovalentContact SG-SG 2.04Å; C297-C311 PolarHBondContact SG-SG 2.91Å; S301-C311 WeakPolarHBondContact OG-CB 3.32Å; T302-C311 CarbonylContact O-C 3.59Å; T302-C311 WeakPolarHBondContact O-CA 3.38Å; C311-R319 PolarHBondContact O-NH1 3.44Å; C311-R319 PolarHBondContact O-NH2 3.32Å
312	T	91.6	Very high	89.2	Confident	87 Å²	87	64 Å²	64	53%	0.534	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	141.2	175.7	47.1	0	0	0	0	110.5	S301 T302	S301-T312 CarbonylContact C-O 3.52Å; S301-T312 WeakPolarHBondContact CA-O 3.16Å; S301-T312 WeakPolarHBondContact CB-O 3.46Å; T302-T312 PolarHBondContact N-O 3.03Å; T302-T312 PolarHBondContact O-N 3.41Å; T302-T312 PolarHBondContact O-OG1 3.19Å
313	C	91.3	Very high	89	Confident	41 Å²	41	64.4 Å²	64.4	28%	0.277	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	143	176.3	-64.8	0	0	0	0	111.2	H317 C329	C313-H317 HydrophobicContact CB-CB 4.48Å; C313-H317 WeakPolarHBondContact CB-O 3.23Å; C313-C329 WeakPolarHBondContact CA-SG 3.32Å; C313-C329 HydrophobicContact CB-CB 3.67Å; C313-C329 WeakPolarHBondContact CB-SG 3.08Å; C313-C329 WeakPolarHBondContact SG-CB 3.41Å; C313-C329 CovalentContact SG-SG 2.04Å; C313-C329 PolarHBondContact SG-SG 2.91Å
314	E	91.5	Very high	88.5	Confident	79 Å²	79	65 Å²	65	37%	0.369	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-62.9	157.1	170.6	-68.6	171.8	-172	0	0	111.1	H300 T302 G316 H317	H300-E314 IonicContact ND1-OE2 2.68Å; H300-E314 PolarHBondContact O-N 3.18Å; T302-E314 HydrophobicContact CG2-CG 4.04Å; E314-G316 PolarHBondContact O-N 3.11Å; E314-H317 PolarHBondContact O-N 3.07Å
315	S	89	Confident	88.3	Confident	126 Å²	126	57.9 Å²	57.9	88%	0.881	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	130.3	178.7	-170.9	0	0	0	0	111.7	H317	S315-H317 VanDerWaalsContact C-N 3.32Å; S315-H317 PolarHBondContact O-ND1 3.47Å
316	G	86.2	Confident	88.2	Confident	33 Å²	33	59.5 Å²	59.5	34%	0.34	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	1.3	-177.3	0	0	0	0	0	115.6	E314 Y318 R331	E314-G316 PolarHBondContact O-N 3.11Å; G316-Y318 WeakPolarHBondContact O-CE2 3.36Å; G316-R331 WeakPolarHBondContact O-CB 3.47Å
317	H	90.6	Very high	88.2	Confident	21 Å²	21	55.2 Å²	55.2	10%	0.097	35%	0.347	C	S	.	.			trans	-117	150.2	174.2	-60.7	76.4	0	0	0	111.1	H300 C313 E314 S315 C329 T330	H300-H317 HydrophobicContact CB-CB 4.19Å; H300-H317 AromaticContact CD2-CD2 3.99Å; H300-H317 AromaticContact CG-CD2 3.59Å; H300-H317 AromaticContact CG-NE2 3.69Å; H300-H317 AromaticContact ND1-NE2 3.66Å; C313-H317 HydrophobicContact CB-CB 4.48Å; C313-H317 WeakPolarHBondContact CB-O 3.23Å; E314-H317 PolarHBondContact O-N 3.07Å; S315-H317 VanDerWaalsContact C-N 3.32Å; S315-H317 PolarHBondContact O-ND1 3.47Å; H317-C329 HydrophobicContact CB-CB 3.74Å; H317-T330 CarbonylContact C-O 3.48Å; H317-T330 VanDerWaalsContact CA-O 3.31Å; H317-T330 WeakPolarHBondContact CA-O 3.48Å
318	Y	90.9	Very high	88.3	Confident	64 Å²	64	56 Å²	56	25%	0.251	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-147.6	163	-170.9	-49.4	-84.6	0	0	0	111.1	G316 T330 L428 G429	G316-Y318 WeakPolarHBondContact O-CE2 3.36Å; Y318-T330 PolarHBondContact N-O 3.5Å; Y318-T330 PolarHBondContact O-N 3.19Å; Y318-T330 PolarHBondContact O-OG1 2.86Å; Y318-L428 HydrophobicContact CD1-CB 3.88Å; Y318-L428 HydrophobicContact CE1-CB 4.4Å; Y318-L428 HydrophobicContact CG-CB 3.96Å; Y318-L428 HydrophobicContact CG-CD1 4.49Å; Y318-G429 WeakPolarHBondContact OH-CA 3.3Å
319	R	90.6	Very high	88.3	Confident	41 Å²	41	55.6 Å²	55.6	16%	0.155	35%	0.348	C	S	.	.			trans	-111.8	141.9	167.5	-68.2	-176.6	-175.8	100.6	-3.4	109.3	C311 E323 P325 V327 L428	C311-R319 PolarHBondContact O-NH1 3.44Å; C311-R319 PolarHBondContact O-NH2 3.32Å; R319-E323 HydrophobicContact CB-CB 4.4Å; R319-P325 PolarHBondContact NH2-O 2.91Å; R319-V327 PolarHBondContact NE-O 2.95Å; R319-V327 PolarHBondContact NH2-O 2.68Å; R319-L428 VanDerWaalsContact O-CD1 3.25Å; R319-L428 WeakPolarHBondContact O-CD1 3.35Å
320	A	88.6	Confident	88.5	Confident	13 Å²	13	53.1 Å²	53.1	11%	0.107	33%	0.333	C	S	.	.			trans	-72.1	151.8	176.6	0	0	0	0	0	110.5	G322 E323 V425	A320-G322 PolarHBondContact O-N 2.95Å; A320-E323 HydrophobicContact CB-CG 4.12Å; A320-E323 WeakPolarHBondContact CB-OE2 3.46Å; A320-E323 PolarHBondContact N-OE2 3.48Å; A320-E323 WeakPolarHBondContact O-CB 3.42Å; A320-E323 PolarHBondContact O-N 3.23Å; A320-V425 HydrophobicContact CB-CG1 4.34Å
321	P	84.2	Confident	88.5	Confident	120 Å²	120	54 Å²	54	78%	0.779	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	125.9	176.9	-24.4	34	0	0	0	111.9
322	G	82.3	Confident	88.5	Confident	89 Å²	89	55.6 Å²	55.6	92%	0.918	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.3	-7.5	-177.5	0	0	0	0	0	114.9	A320	A320-G322 PolarHBondContact O-N 2.95Å
323	E	86	Confident	88.5	Confident	59 Å²	59	51.8 Å²	51.8	28%	0.276	32%	0.317	S	S	.	.			trans	-78.9	131.8	170.4	-64.2	-176	148.7	0	0	110.7	R319 A320 V327 R361	R319-E323 HydrophobicContact CB-CB 4.4Å; A320-E323 HydrophobicContact CB-CG 4.12Å; A320-E323 WeakPolarHBondContact CB-OE2 3.46Å; A320-E323 PolarHBondContact N-OE2 3.48Å; A320-E323 WeakPolarHBondContact O-CB 3.42Å; A320-E323 PolarHBondContact O-N 3.23Å; E323-V327 HydrophobicContact CB-CB 4.38Å; E323-V327 HydrophobicContact CB-CG2 4.32Å; E323-R361 IonicContact OE1-CZ 3.03Å; E323-R361 IonicContact OE1-NH1 2.68Å; E323-R361 PolarHBondContact OE1-NH1 2.82Å; E323-R361 VanDerWaalsContact OE1-NH1 3.16Å; E323-R361 IonicContact OE1-NH2 3.36Å; E323-R361 PolarHBondContact OE1-NH2 2.97Å; E323-R361 IonicContact OE2-CZ 2.63Å; E323-R361 IonicContact OE2-NH1 2.74Å; E323-R361 PolarHBondContact OE2-NH1 3.32Å; E323-R361 IonicContact OE2-NH2 3.07Å
324	G	82.1	Confident	88.6	Confident	21 Å²	21	51.6 Å²	51.6	22%	0.216	32%	0.316	C	S	.	.			trans	-75.3	167.1	177.6	0	0	0	0	0	113.4	Q326 V327	G324-Q326 VanDerWaalsContact CA-OE1 3.26Å; G324-Q326 PolarHBondContact O-N 3.33Å; G324-Q326 VanDerWaalsContact O-N 3.16Å; G324-V327 PolarHBondContact O-N 2.82Å; G324-V327 VanDerWaalsContact O-N 3.12Å
325	P	80.6	Confident	88.5	Confident	21 Å²	21	49.5 Å²	49.5	14%	0.136	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-22	-178	28.1	-37.5	0	0	0	114.2	Y285 M287 P298 I310 R319 V327	Y285-P325 HydrophobicContact CE2-CB 4.02Å; Y285-P325 HydrophobicContact CE2-CG 4.18Å; M287-P325 HydrophobicContact CB-CG 4.4Å; M287-P325 HydrophobicContact CE-CG 4.34Å; M287-P325 HydrophobicContact SD-CG 3.76Å; P298-P325 WeakPolarHBondContact CG-O 3.24Å; I310-P325 HydrophobicContact CD1-CB 3.88Å; I310-P325 HydrophobicContact CG1-CB 3.77Å; R319-P325 PolarHBondContact NH2-O 2.91Å; P325-V327 VanDerWaalsContact C-N 3.26Å; P325-V327 PolarHBondContact O-N 3.44Å
326	Q	84.2	Confident	88.6	Confident	112 Å²	112	43.8 Å²	43.8	52%	0.523	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-17.6	176.6	70.7	-80.8	14.8	0	0	114.3	Y285 G324	Y285-Q326 VanDerWaalsContact OH-CA 3.22Å; Y285-Q326 WeakPolarHBondContact OH-CA 3.42Å; Y285-Q326 PolarHBondContact OH-N 2.87Å; G324-Q326 VanDerWaalsContact CA-OE1 3.26Å; G324-Q326 PolarHBondContact O-N 3.33Å; G324-Q326 VanDerWaalsContact O-N 3.16Å
327	V	89.6	Confident	88.9	Confident	51 Å²	51	45.9 Å²	45.9	31%	0.309	27%	0.274	S	S	.	.	S	Bend	trans	-81.1	138.8	178.2	-174.6	0	0	0	0	109.4	R319 E323 G324 P325	R319-V327 PolarHBondContact NE-O 2.95Å; R319-V327 PolarHBondContact NH2-O 2.68Å; E323-V327 HydrophobicContact CB-CB 4.38Å; E323-V327 HydrophobicContact CB-CG2 4.32Å; G324-V327 PolarHBondContact O-N 2.82Å; G324-V327 VanDerWaalsContact O-N 3.12Å; P325-V327 VanDerWaalsContact C-N 3.26Å; P325-V327 PolarHBondContact O-N 3.44Å
328	A	91.5	Very high	88.8	Confident	31 Å²	31	49.9 Å²	49.9	26%	0.256	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-61.9	146	175.6	0	0	0	0	0	111.6	P298 Q299	P298-A328 HydrophobicContact CB-CB 4.33Å; Q299-A328 HydrophobicContact CB-CB 4.08Å
329	C	92.7	Very high	88.7	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.007	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-75.3	141.8	173.5	-59	0	0	0	0	109.7	Q299 H300 C313 H317	Q299-C329 PolarHBondContact O-N 3.24Å; H300-C329 HydrophobicContact CB-CB 4.08Å; H300-C329 WeakPolarHBondContact CB-O 3.44Å; H300-C329 VanDerWaalsContact O-CB 3.29Å; H300-C329 WeakPolarHBondContact O-CB 3.43Å; C313-C329 WeakPolarHBondContact CA-SG 3.32Å; C313-C329 HydrophobicContact CB-CB 3.67Å; C313-C329 WeakPolarHBondContact CB-SG 3.08Å; C313-C329 WeakPolarHBondContact SG-CB 3.41Å; C313-C329 CovalentContact SG-SG 2.04Å; C313-C329 PolarHBondContact SG-SG 2.91Å; H317-C329 HydrophobicContact CB-CB 3.74Å
330	T	93.3	Very high	88.5	Confident	14 Å²	14	49.3 Å²	49.3	9%	0.086	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-127.7	163.4	-171.9	50.4	0	0	0	0	109.7	H317 Y318 G359 R361	H317-T330 CarbonylContact C-O 3.48Å; H317-T330 VanDerWaalsContact CA-O 3.31Å; H317-T330 WeakPolarHBondContact CA-O 3.48Å; Y318-T330 PolarHBondContact N-O 3.5Å; Y318-T330 PolarHBondContact O-N 3.19Å; Y318-T330 PolarHBondContact O-OG1 2.86Å; T330-G359 VanDerWaalsContact CB-O 3.27Å; T330-G359 WeakPolarHBondContact CB-O 3.39Å; T330-R361 HydrophobicContact CG2-CG 3.66Å; T330-R361 WeakPolarHBondContact OG1-CD 3.37Å; T330-R361 PolarHBondContact OG1-NH1 3.18Å
331	R	91.3	Very high	88.3	Confident	110 Å²	110	51.1 Å²	51.1	42%	0.415	32%	0.317	S	S	.	.			trans	-122.5	162.7	-176.5	65.9	179.9	-178.1	-161	2.4	112.1	G316 D357 G359 N423	G316-R331 WeakPolarHBondContact O-CB 3.47Å; R331-D357 IonicContact CZ-OD2 2.85Å; R331-D357 IonicContact NE-OD2 3.41Å; R331-D357 PolarHBondContact NE-OD2 3.44Å; R331-D357 IonicContact NH2-OD2 2.88Å; R331-D357 PolarHBondContact NH2-OD2 3.04Å; R331-G359 PolarHBondContact N-O 2.88Å; R331-G359 VanDerWaalsContact N-O 3.08Å; R331-G359 WeakPolarHBondContact O-CA 3.28Å; R331-N423 PolarHBondContact O-ND2 3.03Å
332	P	91.3	Very high	88.2	Confident	33 Å²	33	49.3 Å²	49.3	21%	0.214	31%	0.307	C	S	.	.			trans	-57.8	147.3	170.6	-22.9	34.5	0	0	0	111.3
333	P	91.9	Very high	87.9	Confident	7 Å²	7	47.7 Å²	47.7	5%	0.045	29%	0.285	C	S	.	.			trans	-71.9	159	-179.5	33	-33.8	0	0	0	110.9	P355 D357 V364 A421 S426 A434	P333-P355 HydrophobicContact CB-CB 4.36Å; P333-P355 HydrophobicContact CB-CG 4.25Å; P333-D357 WeakPolarHBondContact CA-O 3.44Å; P333-V364 HydrophobicContact CB-CG2 4.41Å; P333-V364 HydrophobicContact CG-CG1 4.4Å; P333-A421 HydrophobicContact CB-CB 4.42Å; P333-A421 HydrophobicContact CG-CB 3.89Å; P333-S426 WeakPolarHBondContact CD-OG 3.35Å; P333-A434 WeakPolarHBondContact O-CB 3.45Å
334	S	91.5	Very high	87.2	Confident	37 Å²	37	49.2 Å²	49.2	26%	0.259	30%	0.302	S	S	.	.			trans	-71	174.1	169.8	57.7	0	0	0	0	112.2	P355 A356 D357	S334-P355 VanDerWaalsContact O-CB 3.27Å; S334-P355 WeakPolarHBondContact O-CB 3.4Å; S334-P355 VanDerWaalsContact O-CG 3.28Å; S334-P355 WeakPolarHBondContact O-CG 3.38Å; S334-P355 WeakPolarHBondContact OG-CB 3.44Å; S334-A356 PolarHBondContact OG-N 2.92Å; S334-D357 PolarHBondContact N-O 3.41Å; S334-D357 PolarHBondContact OG-N 2.92Å; S334-D357 PolarHBondContact OG-O 3.09Å
335	A	90.4	Very high	86.6	Confident	36 Å²	36	51.5 Å²	51.5	30%	0.298	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-67	146.7	178.3	0	0	0	0	0	110.9	A434	A335-A434 HydrophobicContact CB-CB 4.2Å
336	P	91.6	Very high	86.2	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.032	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-56.1	146.2	172	-20.6	29.7	0	0	0	112.2	W352 Y366 V419 A421 T436	P336-W352 HydrophobicContact CB-CB 4.22Å; P336-W352 HydrophobicContact CB-CG 4.15Å; P336-Y366 HydrophobicContact CG-CD1 4.18Å; P336-Y366 HydrophobicContact CG-CE1 4.24Å; P336-V419 HydrophobicContact CG-CB 4.47Å; P336-V419 HydrophobicContact CG-CG1 4.01Å; P336-A421 HydrophobicContact CG-CB 4.05Å; P336-T436 HydrophobicContact CB-CG2 3.84Å; P336-T436 HydrophobicContact CG-CG2 4.11Å; P336-T436 WeakPolarHBondContact O-CG2 3.4Å
337	Q	91.7	Very high	85.9	Confident	78 Å²	78	54.4 Å²	54.4	36%	0.364	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	160.9	-177.7	-69.1	-178	89.1	0	0	111.6	L339 E353 P354 A356	Q337-L339 VanDerWaalsContact C-N 3.25Å; Q337-L339 PolarHBondContact O-N 2.93Å; Q337-L339 VanDerWaalsContact O-N 3.08Å; Q337-E353 HydrophobicContact CB-CB 4.09Å; Q337-E353 PolarHBondContact N-O 2.96Å; Q337-E353 PolarHBondContact O-N 2.95Å; Q337-P354 PolarHBondContact NE2-O 2.77Å; Q337-A356 HydrophobicContact CG-CB 4.48Å; Q337-A356 VanDerWaalsContact NE2-CB 3.32Å
338	N	88.8	Confident	85.8	Confident	104 Å²	104	52 Å²	52	56%	0.556	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	47.6	45.2	170	-63.9	-13.3	0	0	0	113.8	S340 E353	N338-S340 PolarHBondContact O-N 2.8Å; N338-E353 HydrophobicContact CB-CB 4.37Å; N338-E353 HydrophobicContact CB-CG 4.14Å; N338-E353 PolarHBondContact ND2-OE1 2.88Å; N338-E353 PolarHBondContact ND2-OE2 2.86Å
339	L	89.6	Confident	85.6	Confident	28 Å²	28	51.5 Å²	51.5	15%	0.147	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	109.3	174.9	178.4	62.2	0	0	0	109	Q337 W352 V419 T436 V438	Q337-L339 VanDerWaalsContact C-N 3.25Å; Q337-L339 PolarHBondContact O-N 2.93Å; Q337-L339 VanDerWaalsContact O-N 3.08Å; L339-W352 HydrophobicContact CB-CB 4.48Å; L339-W352 HydrophobicContact CD1-CB 4.04Å; L339-W352 HydrophobicContact CD1-CE3 3.96Å; L339-V419 HydrophobicContact CD1-CG2 3.88Å; L339-V419 HydrophobicContact CD2-CG2 3.97Å; L339-T436 HydrophobicContact CB-CG2 3.85Å; L339-T436 HydrophobicContact CD2-CG2 3.87Å; L339-T436 HydrophobicContact CG-CG2 4.41Å; L339-V438 HydrophobicContact CD2-CB 3.77Å; L339-V438 HydrophobicContact CD2-CG1 3.68Å; L339-V438 HydrophobicContact CG-CB 4.15Å; L339-V438 HydrophobicContact CG-CG1 4.07Å
340	S	85.9	Confident	85.5	Confident	65 Å²	65	51.5 Å²	51.5	46%	0.455	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	144.8	180	64.7	0	0	0	0	110.3	N338 R351	N338-S340 PolarHBondContact O-N 2.8Å; S340-R351 PolarHBondContact N-O 2.82Å; S340-R351 PolarHBondContact O-N 3.1Å; S340-R351 PolarHBondContact OG-O 3.03Å
341	S	83.8	Confident	85.4	Confident	51 Å²	51	57.9 Å²	57.9	36%	0.357	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	124.4	-179	56.3	0	0	0	0	109.6
342	S	81.5	Confident	85.5	Confident	82 Å²	82	53 Å²	53	57%	0.573	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	111.8	173	-178.7	0	0	0	0	109.1	S349	S342-S349 PolarHBondContact N-O 3.08Å; S342-S349 PolarHBondContact O-N 3.29Å
343	A	75.6	Confident	85.6	Confident	55 Å²	55	55.9 Å²	55.9	46%	0.455	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	134.7	179.3	0	0	0	0	0	110.5	L348 M442	A343-L348 HydrophobicContact CB-CD1 4.16Å; A343-M442 HydrophobicContact CB-CE 4.48Å; A343-M442 HydrophobicContact CB-SD 4.35Å
344	S	71.6	Confident	85.5	Confident	92 Å²	92	58.3 Å²	58.3	64%	0.643	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.5	103.2	173.6	-169.5	0	0	0	0	108.5	T346 Q347	S344-T346 PolarHBondContact O-N 2.77Å; S344-Q347 PolarHBondContact N-O 3.09Å; S344-Q347 PolarHBondContact O-N 2.82Å; S344-Q347 VanDerWaalsContact O-N 3.13Å
345	G	70.6	Confident	85.5	Confident	69 Å²	69	56.9 Å²	56.9	71%	0.711	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	-121.1	-173.3	0	0	0	0	0	112.1	M442	G345-M442 WeakPolarHBondContact O-CE 3.46Å
346	T	70.8	Confident	85.5	Confident	69 Å²	69	59 Å²	59	42%	0.423	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	11.4	177.2	54	0	0	0	0	113.6	S344 L409 P411	S344-T346 PolarHBondContact O-N 2.77Å; T346-L409 WeakPolarHBondContact CB-O 3.31Å; T346-L409 WeakPolarHBondContact CG2-O 3.38Å; T346-L409 PolarHBondContact O-N 3.49Å; T346-P411 HydrophobicContact CG2-CG 3.97Å
347	Q	79.2	Confident	85.4	Confident	124 Å²	124	61 Å²	61	58%	0.579	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.5	145.5	176.9	-64.3	-176.2	-12	0	0	110.7	S344	S344-Q347 PolarHBondContact N-O 3.09Å; S344-Q347 PolarHBondContact O-N 2.82Å; S344-Q347 VanDerWaalsContact O-N 3.13Å
348	L	86.3	Confident	85.3	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.01	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	130.7	179.1	178.2	70	0	0	0	110.4	A343 L350 V406 L409 F417 I440	A343-L348 HydrophobicContact CB-CD1 4.16Å; L348-L350 HydrophobicContact CD2-CD1 4.42Å; L348-L350 HydrophobicContact CD2-CD2 3.84Å; L348-L350 HydrophobicContact CD2-CG 3.98Å; L348-L350 HydrophobicContact CG-CD2 4.18Å; L348-L350 HydrophobicContact CG-CG 4.2Å; L348-V406 HydrophobicContact CB-CB 4.28Å; L348-V406 PolarHBondContact N-O 3.34Å; L348-V406 PolarHBondContact O-N 3.47Å; L348-L409 HydrophobicContact CB-CD1 3.5Å; L348-L409 HydrophobicContact CD2-CD1 4.12Å; L348-L409 HydrophobicContact CG-CD1 4.44Å; L348-F417 HydrophobicContact CD2-CD2 3.72Å; L348-F417 HydrophobicContact CD2-CE2 3.23Å; L348-F417 HydrophobicContact CD2-CZ 3.71Å; L348-I440 HydrophobicContact CD1-CD1 3.62Å; L348-I440 HydrophobicContact CD2-CD1 3.43Å; L348-I440 VanDerWaalsContact CD2-CD1 3.43Å; L348-I440 HydrophobicContact CG-CD1 4.15Å
349	S	88.3	Confident	85.2	Confident	20 Å²	20	55.8 Å²	55.8	14%	0.14	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	113.3	171.4	-172.4	0	0	0	0	108.2	S342 H405	S342-S349 PolarHBondContact N-O 3.08Å; S342-S349 PolarHBondContact O-N 3.29Å; S349-H405 PolarHBondContact OG-CE1 3.27Å
350	L	90.5	Very high	85.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	128.4	173.4	-67.5	175.3	0	0	0	108.7	L348 W352 V368 A403 V404 V406 F417 V438 I440	L348-L350 HydrophobicContact CD2-CD1 4.42Å; L348-L350 HydrophobicContact CD2-CD2 3.84Å; L348-L350 HydrophobicContact CD2-CG 3.98Å; L348-L350 HydrophobicContact CG-CD2 4.18Å; L348-L350 HydrophobicContact CG-CG 4.2Å; L350-W352 HydrophobicContact CB-CE3 4.44Å; L350-W352 HydrophobicContact CB-CZ3 4.09Å; L350-V368 HydrophobicContact CD1-CG1 4.23Å; L350-A403 VanDerWaalsContact O-CA 3.26Å; L350-A403 WeakPolarHBondContact O-CA 3.25Å; L350-V404 HydrophobicContact CB-CG1 4Å; L350-V404 HydrophobicContact CD1-CG1 4.12Å; L350-V404 PolarHBondContact N-O 3.35Å; L350-V404 PolarHBondContact O-N 3.04Å; L350-V406 HydrophobicContact CD1-CG2 4.14Å; L350-F417 HydrophobicContact CD1-CB 3.75Å; L350-F417 HydrophobicContact CD1-CD1 3.83Å; L350-F417 HydrophobicContact CD1-CD2 4.32Å; L350-F417 HydrophobicContact CD1-CG 3.7Å; L350-V438 HydrophobicContact CD2-CG1 3.82Å; L350-I440 HydrophobicContact CD2-CD1 4.31Å
351	R	91.4	Very high	85.3	Confident	149 Å²	149	56.3 Å²	56.3	56%	0.562	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.9	133.7	175.7	-65.2	-174.6	176.3	-157.6	-0.9	109.5	S340 S402 A403	S340-R351 PolarHBondContact N-O 2.82Å; S340-R351 PolarHBondContact O-N 3.1Å; S340-R351 PolarHBondContact OG-O 3.03Å; R351-S402 WeakPolarHBondContact CA-O 3.28Å; R351-A403 HydrophobicContact CG-CB 4.08Å
352	W	93.1	Very high	85.5	Confident	7 Å²	7	63.6 Å²	63.6	3%	0.027	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	165.1	175.7	55.3	95.2	0	0	0	110.4	P336 L339 L350 Y366 V368 L399 S402 V404 V419	P336-W352 HydrophobicContact CB-CB 4.22Å; P336-W352 HydrophobicContact CB-CG 4.15Å; L339-W352 HydrophobicContact CB-CB 4.48Å; L339-W352 HydrophobicContact CD1-CB 4.04Å; L339-W352 HydrophobicContact CD1-CE3 3.96Å; L350-W352 HydrophobicContact CB-CE3 4.44Å; L350-W352 HydrophobicContact CB-CZ3 4.09Å; W352-Y366 HydrophobicContact CZ2-CD2 4.26Å; W352-Y366 HydrophobicContact CZ2-CG 4.02Å; W352-Y366 AromaticContact NE1-CD1 3.42Å; W352-Y366 AromaticContact NE1-CD2 3.7Å; W352-Y366 AromaticContact NE1-CE1 3.59Å; W352-Y366 AromaticContact NE1-CE2 3.88Å; W352-Y366 AromaticContact NE1-CG 3.48Å; W352-Y366 AromaticContact NE1-CZ 3.83Å; W352-V368 HydrophobicContact CH2-CG2 3.98Å; W352-V368 HydrophobicContact CZ3-CG2 4.4Å; W352-L399 HydrophobicContact CH2-CD1 4.2Å; W352-L399 HydrophobicContact CZ2-CD1 4.48Å; W352-S402 VanDerWaalsContact CE2-CA 3.5Å; W352-S402 PolarHBondContact N-O 3.19Å; W352-S402 WeakPolarHBondContact O-CB 3.31Å; W352-S402 PolarHBondContact O-OG 3.38Å; W352-V404 HydrophobicContact CH2-CB 4.16Å; W352-V404 HydrophobicContact CH2-CG1 4.1Å; W352-V404 HydrophobicContact CZ3-CB 4.4Å; W352-V404 HydrophobicContact CZ3-CG1 3.98Å; W352-V419 HydrophobicContact CD2-CG1 3.89Å; W352-V419 HydrophobicContact CE3-CG1 4.21Å; W352-V419 HydrophobicContact CE3-CG2 4.15Å; W352-V419 HydrophobicContact CG-CG1 4.38Å; W352-V419 HydrophobicContact CH2-CG1 4.33Å; W352-V419 HydrophobicContact CZ2-CG1 4Å; W352-V419 HydrophobicContact CZ3-CG1 4.42Å; W352-V419 HydrophobicContact CZ3-CG2 4.3Å
353	E	92.6	Very high	85.9	Confident	94 Å²	94	62.4 Å²	62.4	44%	0.439	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	154.2	167.4	-74.3	173.8	-154.7	0	0	110.1	Q337 N338	Q337-E353 HydrophobicContact CB-CB 4.09Å; Q337-E353 PolarHBondContact N-O 2.96Å; Q337-E353 PolarHBondContact O-N 2.95Å; N338-E353 HydrophobicContact CB-CB 4.37Å; N338-E353 HydrophobicContact CB-CG 4.14Å; N338-E353 PolarHBondContact ND2-OE1 2.88Å; N338-E353 PolarHBondContact ND2-OE2 2.86Å
354	P	90.8	Very high	86.7	Confident	57 Å²	57	60.6 Å²	60.6	37%	0.37	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-58.6	155	175.5	-20.9	32.1	0	0	0	113	Q337 M358	Q337-P354 PolarHBondContact NE2-O 2.77Å; P354-M358 HydrophobicContact CB-CE 3.28Å; P354-M358 HydrophobicContact CB-SD 4.28Å; P354-M358 HydrophobicContact CG-CE 4.23Å
355	P	92	Very high	87.6	Confident	7 Å²	7	63.3 Å²	63.3	5%	0.045	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-50.1	143.5	174	-29.9	37.4	0	0	0	112.8	P333 S334 D357 M358 Y366 A421	P333-P355 HydrophobicContact CB-CB 4.36Å; P333-P355 HydrophobicContact CB-CG 4.25Å; S334-P355 VanDerWaalsContact O-CB 3.27Å; S334-P355 WeakPolarHBondContact O-CB 3.4Å; S334-P355 VanDerWaalsContact O-CG 3.28Å; S334-P355 WeakPolarHBondContact O-CG 3.38Å; S334-P355 WeakPolarHBondContact OG-CB 3.44Å; P355-D357 WeakPolarHBondContact CB-O 3.44Å; P355-D357 PolarHBondContact O-N 2.85Å; P355-M358 HydrophobicContact CB-SD 4.27Å; P355-M358 HydrophobicContact CG-SD 4.31Å; P355-Y366 WeakPolarHBondContact CD-OH 3.48Å; P355-Y366 HydrophobicContact CG-CE1 4.36Å; P355-A421 HydrophobicContact CG-CB 3.74Å
356	A	89.9	Confident	88.7	Confident	80 Å²	80	60.6 Å²	60.6	66%	0.661	32%	0.32	S	S	*	.	S	Bend	trans	-60.4	-36.5	176.9	0	0	0	0	0	111.4	S334 Q337	S334-A356 PolarHBondContact OG-N 2.92Å; Q337-A356 HydrophobicContact CG-CB 4.48Å; Q337-A356 VanDerWaalsContact NE2-CB 3.32Å
357	D	89.9	Confident	89.7	Confident	49 Å²	49	57.8 Å²	57.8	26%	0.262	30%	0.303	S	S	.	.			trans	-122.1	120.3	171.2	177	23.7	0	0	0	110.2	R331 P333 S334 P355 G359	R331-D357 IonicContact CZ-OD2 2.85Å; R331-D357 IonicContact NE-OD2 3.41Å; R331-D357 PolarHBondContact NE-OD2 3.44Å; R331-D357 IonicContact NH2-OD2 2.88Å; R331-D357 PolarHBondContact NH2-OD2 3.04Å; P333-D357 WeakPolarHBondContact CA-O 3.44Å; S334-D357 PolarHBondContact N-O 3.41Å; S334-D357 PolarHBondContact OG-N 2.92Å; S334-D357 PolarHBondContact OG-O 3.09Å; P355-D357 WeakPolarHBondContact CB-O 3.44Å; P355-D357 PolarHBondContact O-N 2.85Å; D357-G359 VanDerWaalsContact C-N 3.27Å; D357-G359 WeakPolarHBondContact OD1-CA 3.29Å; D357-G359 PolarHBondContact OD1-N 3.24Å
358	M	88.9	Confident	90.3	Very high	66 Å²	66	52.2 Å²	52.2	33%	0.325	28%	0.278	S	S	.	.			trans	-83.6	-3.8	176.9	-58.9	-71.1	-154.1	0	0	112.9	P354 P355 G360 R361 V364 N423	P354-M358 HydrophobicContact CB-CE 3.28Å; P354-M358 HydrophobicContact CB-SD 4.28Å; P354-M358 HydrophobicContact CG-CE 4.23Å; P355-M358 HydrophobicContact CB-SD 4.27Å; P355-M358 HydrophobicContact CG-SD 4.31Å; M358-G360 VanDerWaalsContact C-N 3.34Å; M358-R361 WeakPolarHBondContact CB-O 3.42Å; M358-V364 HydrophobicContact CB-CG2 4.18Å; M358-V364 HydrophobicContact SD-CB 4.35Å; M358-V364 HydrophobicContact SD-CG2 3.79Å; M358-N423 PolarHBondContact O-ND2 3.1Å
359	G	87	Confident	90.5	Very high	5 Å²	5	58.2 Å²	58.2	5%	0.052	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	24.9	-178.5	0	0	0	0	0	113.9	T330 R331 D357 R361	T330-G359 VanDerWaalsContact CB-O 3.27Å; T330-G359 WeakPolarHBondContact CB-O 3.39Å; R331-G359 PolarHBondContact N-O 2.88Å; R331-G359 VanDerWaalsContact N-O 3.08Å; R331-G359 WeakPolarHBondContact O-CA 3.28Å; D357-G359 VanDerWaalsContact C-N 3.27Å; D357-G359 WeakPolarHBondContact OD1-CA 3.29Å; D357-G359 PolarHBondContact OD1-N 3.24Å; G359-R361 VanDerWaalsContact C-N 3.35Å
360	G	87.6	Confident	90.5	Very high	70 Å²	70	58.1 Å²	58.1	72%	0.722	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	10.6	178.4	0	0	0	0	0	115.3	M358	M358-G360 VanDerWaalsContact C-N 3.34Å
361	R	89.1	Confident	90.4	Very high	35 Å²	35	59.6 Å²	59.6	13%	0.132	31%	0.309	C	S	.	.			trans	-122.6	160.5	179.3	-48.8	-177.1	73.2	90.5	4.3	111.9	E323 T330 M358 G359 D363	E323-R361 IonicContact OE1-CZ 3.03Å; E323-R361 IonicContact OE1-NH1 2.68Å; E323-R361 PolarHBondContact OE1-NH1 2.82Å; E323-R361 VanDerWaalsContact OE1-NH1 3.16Å; E323-R361 IonicContact OE1-NH2 3.36Å; E323-R361 PolarHBondContact OE1-NH2 2.97Å; E323-R361 IonicContact OE2-CZ 2.63Å; E323-R361 IonicContact OE2-NH1 2.74Å; E323-R361 PolarHBondContact OE2-NH1 3.32Å; E323-R361 IonicContact OE2-NH2 3.07Å; T330-R361 HydrophobicContact CG2-CG 3.66Å; T330-R361 WeakPolarHBondContact OG1-CD 3.37Å; T330-R361 PolarHBondContact OG1-NH1 3.18Å; M358-R361 WeakPolarHBondContact CB-O 3.42Å; G359-R361 VanDerWaalsContact C-N 3.35Å; R361-D363 WeakPolarHBondContact CB-OD1 3.38Å; R361-D363 WeakPolarHBondContact CD-OD1 3.37Å; R361-D363 IonicContact CZ-OD2 3.07Å; R361-D363 IonicContact NE-OD1 3.22Å; R361-D363 PolarHBondContact NE-OD1 3.23Å; R361-D363 IonicContact NE-OD2 3.27Å; R361-D363 PolarHBondContact NE-OD2 3.01Å; R361-D363 IonicContact NH2-OD2 3.9Å
362	Q	88.4	Confident	90.2	Very high	203 Å²	203	55.3 Å²	55.3	95%	0.949	30%	0.296	S	S	*	.	S	Bend	trans	-109	-1.2	176.9	-62.6	-178.4	1.7	0	0	112.8	V364	Q362-V364 PolarHBondContact O-N 3.31Å
363	D	90.9	Very high	89.6	Confident	58 Å²	58	56 Å²	56	31%	0.31	30%	0.302	S	S	.	.			trans	-88.6	30.3	-177.9	64.3	-18.2	0	0	0	113	R361 G424	R361-D363 WeakPolarHBondContact CB-OD1 3.38Å; R361-D363 WeakPolarHBondContact CD-OD1 3.37Å; R361-D363 IonicContact CZ-OD2 3.07Å; R361-D363 IonicContact NE-OD1 3.22Å; R361-D363 PolarHBondContact NE-OD1 3.23Å; R361-D363 IonicContact NE-OD2 3.27Å; R361-D363 PolarHBondContact NE-OD2 3.01Å; R361-D363 IonicContact NH2-OD2 3.9Å; D363-G424 WeakPolarHBondContact OD2-CA 3.28Å; D363-G424 PolarHBondContact OD2-N 3.4Å; D363-G424 VanDerWaalsContact OD2-N 3.16Å
364	V	90.8	Very high	88.3	Confident	16 Å²	16	59.5 Å²	59.5	10%	0.097	32%	0.318	C	S	.	.			trans	-71	130.7	-179.2	-177.3	0	0	0	0	110.6	P333 M358 Q362 Y366 A421 Q422 N423	P333-V364 HydrophobicContact CB-CG2 4.41Å; P333-V364 HydrophobicContact CG-CG1 4.4Å; M358-V364 HydrophobicContact CB-CG2 4.18Å; M358-V364 HydrophobicContact SD-CB 4.35Å; M358-V364 HydrophobicContact SD-CG2 3.79Å; Q362-V364 PolarHBondContact O-N 3.31Å; V364-Y366 HydrophobicContact CG1-CE1 4.11Å; V364-A421 HydrophobicContact CG1-CB 4.35Å; V364-Q422 CarbonylContact C-O 3.41Å; V364-Q422 WeakPolarHBondContact CA-O 3.5Å; V364-N423 HydrophobicContact CG2-CB 4.3Å
365	R	92.4	Very high	86.9	Confident	150 Å²	150	59.1 Å²	59.1	57%	0.566	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.7	148.1	178.8	-60.3	178	-173.7	174.6	1.2	109.5	L399 Q422	R365-L399 CarbonylContact C-O 3.58Å; R365-L399 WeakPolarHBondContact CA-O 3.39Å; R365-Q422 PolarHBondContact N-O 3.38Å; R365-Q422 PolarHBondContact O-N 2.65Å
366	Y	92.3	Very high	85.1	Confident	11 Å²	11	64.3 Å²	64.3	4%	0.043	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	148.9	-178	-50.6	-79.6	0	0	0	112	P336 W352 P355 V364 G398 L399 E420 A421	P336-Y366 HydrophobicContact CG-CD1 4.18Å; P336-Y366 HydrophobicContact CG-CE1 4.24Å; W352-Y366 HydrophobicContact CZ2-CD2 4.26Å; W352-Y366 HydrophobicContact CZ2-CG 4.02Å; W352-Y366 AromaticContact NE1-CD1 3.42Å; W352-Y366 AromaticContact NE1-CD2 3.7Å; W352-Y366 AromaticContact NE1-CE1 3.59Å; W352-Y366 AromaticContact NE1-CE2 3.88Å; W352-Y366 AromaticContact NE1-CG 3.48Å; W352-Y366 AromaticContact NE1-CZ 3.83Å; P355-Y366 WeakPolarHBondContact CD-OH 3.48Å; P355-Y366 HydrophobicContact CG-CE1 4.36Å; V364-Y366 HydrophobicContact CG1-CE1 4.11Å; Y366-G398 PolarHBondContact O-N 2.85Å; Y366-L399 WeakPolarHBondContact CD2-O 3.07Å; Y366-L399 PolarHBondContact N-O 2.61Å; Y366-L399 PolarHBondContact O-N 3.34Å; Y366-E420 CarbonylContact C-O 3.53Å; Y366-E420 VanDerWaalsContact CA-O 3.28Å; Y366-E420 WeakPolarHBondContact CA-O 3.16Å; Y366-A421 HydrophobicContact CD1-CB 4.07Å; Y366-A421 HydrophobicContact CE1-CB 4.06Å
367	S	92.1	Very high	83.3	Confident	11 Å²	11	66.7 Å²	66.7	8%	0.077	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	135.4	168.5	51.2	0	0	0	0	111.3	A396 E420	S367-A396 CarbonylContact C-O 3.59Å; S367-A396 VanDerWaalsContact CA-O 3.3Å; S367-A396 WeakPolarHBondContact CA-O 3.49Å; S367-E420 PolarHBondContact N-O 3.1Å; S367-E420 PolarHBondContact O-N 3.46Å
368	V	91.7	Very high	81.4	Confident	7 Å²	7	73.3 Å²	73.3	4%	0.042	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.9	-177.5	-172.9	0	0	0	0	109.5	L350 W352 F392 A396 L399 V404 F417 N418 V419	L350-V368 HydrophobicContact CD1-CG1 4.23Å; W352-V368 HydrophobicContact CH2-CG2 3.98Å; W352-V368 HydrophobicContact CZ3-CG2 4.4Å; V368-F392 HydrophobicContact CB-CE1 4.28Å; V368-F392 HydrophobicContact CG1-CE1 3.86Å; V368-A396 PolarHBondContact N-O 3.46Å; V368-L399 HydrophobicContact CG2-CD1 4.03Å; V368-V404 HydrophobicContact CG2-CG1 4.06Å; V368-F417 HydrophobicContact CG1-CD1 4.28Å; V368-N418 CarbonylContact C-O 3.5Å; V368-N418 WeakPolarHBondContact CA-O 3.32Å; V368-V419 HydrophobicContact CG1-CG2 4.33Å; V368-V419 HydrophobicContact CG2-CG1 4.29Å; V368-V419 HydrophobicContact CG2-CG2 4.1Å
369	R	90.4	Very high	79.3	Confident	127 Å²	127	76.8 Å²	76.8	48%	0.479	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	141.5	172.3	-62.9	-174.3	-173.1	-109	0.2	109.6	F417 N418 E420	R369-F417 CarbonylContact O-C 3.54Å; R369-F417 WeakPolarHBondContact O-CA 3.34Å; R369-N418 HydrophobicContact CB-CB 4.42Å; R369-N418 PolarHBondContact N-O 3.45Å; R369-N418 PolarHBondContact O-N 3Å; R369-E420 WeakPolarHBondContact CD-OE1 3.41Å; R369-E420 IonicContact CZ-OE1 2.66Å; R369-E420 IonicContact NE-OE1 3.21Å; R369-E420 PolarHBondContact NE-OE1 2.89Å; R369-E420 IonicContact NE-OE2 2.92Å; R369-E420 IonicContact NH2-OE1 2.84Å; R369-E420 IonicContact NH2-OE2 3.84Å
370	C	89.3	Confident	77.7	Confident	18 Å²	18	80.9 Å²	80.9	12%	0.122	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135	177.9	178	0	0	0	0	109.8	C386 F392 F417	C370-C386 HydrophobicContact CB-CB 3.68Å; C370-C386 WeakPolarHBondContact CB-SG 3.27Å; C370-C386 PolarHBondContact O-N 2.76Å; C370-C386 PolarHBondContact O-SG 3.25Å; C370-C386 VanDerWaalsContact O-SG 3.41Å; C370-C386 WeakPolarHBondContact SG-CB 3.43Å; C370-C386 CovalentContact SG-SG 2.03Å; C370-C386 PolarHBondContact SG-SG 3.4Å; C370-F392 HydrophobicContact CB-CZ 3.81Å; C370-F417 HydrophobicContact CB-CD1 3.84Å; C370-F417 HydrophobicContact CB-CE1 3.69Å; C370-F417 WeakPolarHBondContact SG-CE1 3.43Å
371	S	88.4	Confident	76.3	Confident	31 Å²	31	78.8 Å²	78.8	22%	0.217	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	133.6	171.2	56	0	0	0	0	110.8	Q384 C386 T416	S371-Q384 CarbonylContact C-O 3.52Å; S371-Q384 WeakPolarHBondContact CA-O 3.33Å; S371-C386 VanDerWaalsContact C-SG 3.52Å; S371-C386 VanDerWaalsContact CA-SG 3.6Å; S371-C386 PolarHBondContact N-SG 2.59Å; S371-T416 PolarHBondContact N-O 3.24Å; S371-T416 PolarHBondContact O-N 3.07Å; S371-T416 PolarHBondContact OG-O 3.39Å
372	Q	86.1	Confident	75.2	Confident	60 Å²	60	82.2 Å²	82.2	28%	0.28	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.1	174.1	-170.9	177.9	14.7	0	0	108.7	C383 Q384 E410 Y415	Q372-C383 WeakPolarHBondContact O-CA 3.1Å; Q372-Q384 PolarHBondContact N-O 2.56Å; Q372-Q384 PolarHBondContact O-N 2.75Å; Q372-E410 PolarHBondContact NE2-OE2 2.8Å; Q372-Y415 HydrophobicContact CB-CD1 4.11Å; Q372-Y415 HydrophobicContact CB-CE1 3.95Å; Q372-Y415 HydrophobicContact CG-CD1 4.27Å; Q372-Y415 HydrophobicContact CG-CE1 3.89Å
373	C	81	Confident	74.6	Confident	22 Å²	22	75.7 Å²	75.7	15%	0.149	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	134.9	-176.9	-53.2	0	0	0	0	110.1	C383 N414	C373-C383 HydrophobicContact CB-CB 4.1Å; C373-C383 WeakPolarHBondContact CB-SG 3.44Å; C373-C383 WeakPolarHBondContact SG-CB 3.22Å; C373-C383 CovalentContact SG-SG 2.04Å; C373-C383 PolarHBondContact SG-SG 3.26Å; C373-N414 PolarHBondContact N-O 3.23Å
374	Q	66.2	Low	74.1	Confident	166 Å²	166	79.5 Å²	79.5	78%	0.776	45%	0.451	S	S	*	.			trans	-91.7	111.8	174.8	-70.1	-177	-4.8	0	0	110
375	G	60.2	Low	73.8	Confident	49 Å²	49	84.1 Å²	84.1	51%	0.505	48%	0.481	S	S	.	.	S	Bend	trans	122.9	166.8	173.5	0	0	0	0	0	115.5	N414	G375-N414 PolarHBondContact O-ND2 2.79Å
376	T	54.7	Low	73.5	Confident	116 Å²	116	78.2 Å²	78.2	71%	0.712	46%	0.462	S	S	*	.			trans	-75	142.4	172.9	42.8	0	0	0	0	111.2	Q378 D379	T376-Q378 PolarHBondContact O-N 2.64Å; T376-D379 PolarHBondContact O-N 2.91Å
377	V	51.9	Low	72.7	Confident	130 Å²	130	80 Å²	80	79%	0.788	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.4	-13.2	-168.9	-177.3	0	0	0	0	117.7
378	Q	49.8	Very low	71.9	Confident	188 Å²	188	86.5 Å²	86.5	88%	0.879	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-16.6	-175	-73.6	-179	-5.9	0	0	115.7	T376	T376-Q378 PolarHBondContact O-N 2.64Å
379	D	45.3	Very low	71.1	Confident	140 Å²	140	88.3 Å²	88.3	75%	0.749	54%	0.544	S	S	*	.	S	Bend	trans	-111.7	110.9	169.8	-82.6	-34.1	0	0	0	107.8	T376 G381	T376-D379 PolarHBondContact O-N 2.91Å; D379-G381 PolarHBondContact O-N 3.42Å
380	G	52.6	Low	70.9	Confident	90 Å²	90	83.2 Å²	83.2	93%	0.928	53%	0.527	S	S	*	.			trans	-63.2	70.6	-178.5	0	0	0	0	0	113.7
381	G	59.1	Low	70.9	Confident	27 Å²	27	88 Å²	88	28%	0.278	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-63.8	152.3	172.3	0	0	0	0	0	111.3	D379 C383	D379-G381 PolarHBondContact O-N 3.42Å; G381-C383 PolarHBondContact O-N 3.07Å; G381-C383 VanDerWaalsContact O-N 3.16Å
382	P	66.2	Low	71	Confident	106 Å²	106	88.9 Å²	88.9	69%	0.688	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-63.9	117.9	-179.1	25.5	-32.8	0	0	0	110.7
383	C	74.4	Confident	71	Confident	66 Å²	66	89.6 Å²	89.6	45%	0.446	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.5	128.4	170.9	-57.8	0	0	0	0	109.7	Q372 C373 G381	Q372-C383 WeakPolarHBondContact O-CA 3.1Å; C373-C383 HydrophobicContact CB-CB 4.1Å; C373-C383 WeakPolarHBondContact CB-SG 3.44Å; C373-C383 WeakPolarHBondContact SG-CB 3.22Å; C373-C383 CovalentContact SG-SG 2.04Å; C373-C383 PolarHBondContact SG-SG 3.26Å; G381-C383 PolarHBondContact O-N 3.07Å; G381-C383 VanDerWaalsContact O-N 3.16Å
384	Q	81.7	Confident	71.2	Confident	138 Å²	138	93.5 Å²	93.5	65%	0.645	58%	0.583	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.6	149	175.3	-69.3	-172.5	-17.7	0	0	110.2	S371 Q372 C386	S371-Q384 CarbonylContact C-O 3.52Å; S371-Q384 WeakPolarHBondContact CA-O 3.33Å; Q372-Q384 PolarHBondContact N-O 2.56Å; Q372-Q384 PolarHBondContact O-N 2.75Å; Q384-C386 PolarHBondContact O-N 2.73Å
385	P	84.3	Confident	72.3	Confident	113 Å²	113	86.6 Å²	86.6	73%	0.734	56%	0.557	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-57.5	138.7	173.3	24.7	-32.9	0	0	0	110
386	C	85.1	Confident	73.6	Confident	26 Å²	26	85.7 Å²	85.7	18%	0.176	55%	0.545	C	S	.	.	P	Polyproline II helix	trans	-58.2	140.9	-178.4	-62.2	0	0	0	0	111.5	C370 S371 Q384 V390	C370-C386 HydrophobicContact CB-CB 3.68Å; C370-C386 WeakPolarHBondContact CB-SG 3.27Å; C370-C386 PolarHBondContact O-N 2.76Å; C370-C386 PolarHBondContact O-SG 3.25Å; C370-C386 VanDerWaalsContact O-SG 3.41Å; C370-C386 WeakPolarHBondContact SG-CB 3.43Å; C370-C386 CovalentContact SG-SG 2.03Å; C370-C386 PolarHBondContact SG-SG 3.4Å; S371-C386 VanDerWaalsContact C-SG 3.52Å; S371-C386 VanDerWaalsContact CA-SG 3.6Å; S371-C386 PolarHBondContact N-SG 2.59Å; Q384-C386 PolarHBondContact O-N 2.73Å; C386-V390 HydrophobicContact CB-CB 4.39Å; C386-V390 HydrophobicContact CB-CG2 4.01Å
387	G	75.8	Confident	75.3	Confident	49 Å²	49	89.3 Å²	89.3	51%	0.505	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-67.4	169	179.4	0	0	0	0	0	113.5	G389 V390	G387-G389 PolarHBondContact O-N 3.47Å; G387-V390 PolarHBondContact O-N 3.21Å
388	V	74.8	Confident	76.9	Confident	148 Å²	148	85.4 Å²	85.4	90%	0.897	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-9.5	-179.2	-83.8	0	0	0	0	115.4	V390	V388-V390 VanDerWaalsContact C-N 3.34Å
389	G	76.2	Confident	78.8	Confident	45 Å²	45	76.9 Å²	76.9	46%	0.464	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-11.7	176.4	0	0	0	0	0	115.1	G387 H391	G387-G389 PolarHBondContact O-N 3.47Å; G389-H391 PolarHBondContact O-CD2 2.94Å
390	V	86.3	Confident	80.9	Confident	20 Å²	20	75.5 Å²	75.5	12%	0.121	49%	0.489	C	S	.	.			trans	-90	120.2	177.6	-178.5	0	0	0	0	110	C386 G387 V388 F392 V406 S407 L409	C386-V390 HydrophobicContact CB-CB 4.39Å; C386-V390 HydrophobicContact CB-CG2 4.01Å; G387-V390 PolarHBondContact O-N 3.21Å; V388-V390 VanDerWaalsContact C-N 3.34Å; V390-F392 HydrophobicContact CG1-CE2 4.1Å; V390-F392 HydrophobicContact CG1-CZ 4.22Å; V390-V406 HydrophobicContact CG1-CG1 3.4Å; V390-V406 VanDerWaalsContact CG1-CG1 3.4Å; V390-S407 WeakPolarHBondContact CA-O 3.21Å; V390-L409 HydrophobicContact CG1-CD2 4.08Å; V390-L409 HydrophobicContact CG2-CD2 4.1Å
391	H	88.4	Confident	82.6	Confident	118 Å²	118	74.8 Å²	74.8	55%	0.546	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134.8	-177	-64.8	-69.2	0	0	0	111.8	G389 V406 S407	G389-H391 PolarHBondContact O-CD2 2.94Å; H391-V406 WeakPolarHBondContact O-CA 3.23Å; H391-S407 PolarHBondContact N-O 3.05Å; H391-S407 PolarHBondContact O-N 3.35Å
392	F	90.4	Very high	84.1	Confident	49 Å²	49	75.7 Å²	75.7	22%	0.215	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128	176.1	-61.4	-94.9	0	0	0	110	V368 C370 V390 G395 A396 V404 H405 V406 F417	V368-F392 HydrophobicContact CB-CE1 4.28Å; V368-F392 HydrophobicContact CG1-CE1 3.86Å; C370-F392 HydrophobicContact CB-CZ 3.81Å; V390-F392 HydrophobicContact CG1-CE2 4.1Å; V390-F392 HydrophobicContact CG1-CZ 4.22Å; F392-G395 PolarHBondContact O-N 3.37Å; F392-A396 HydrophobicContact CB-CB 4.13Å; F392-A396 HydrophobicContact CD1-CB 4.37Å; F392-A396 HydrophobicContact CD2-CB 3.82Å; F392-A396 HydrophobicContact CE2-CB 4.32Å; F392-A396 HydrophobicContact CG-CB 3.85Å; F392-V404 HydrophobicContact CB-CG2 4.06Å; F392-V404 HydrophobicContact CD1-CG1 4.44Å; F392-V404 HydrophobicContact CD1-CG2 4.11Å; F392-H405 WeakPolarHBondContact CA-O 3.36Å; F392-V406 HydrophobicContact CD1-CG2 3.72Å; F392-V406 HydrophobicContact CE1-CG1 4.27Å; F392-V406 HydrophobicContact CE1-CG2 3.73Å; F392-F417 HydrophobicContact CE1-CD1 4.35Å; F392-F417 HydrophobicContact CE1-CE1 4.22Å; F392-F417 HydrophobicContact CZ-CE1 4.33Å
393	S	87.1	Confident	85.2	Confident	75 Å²	75	72.1 Å²	72.1	52%	0.524	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	123.7	174.6	-179.3	0	0	0	0	109.7	V404 H405	S393-V404 WeakPolarHBondContact O-CG2 3.27Å; S393-H405 PolarHBondContact N-O 3.47Å; S393-H405 PolarHBondContact O-N 2.86Å
394	P	85.6	Confident	86.1	Confident	104 Å²	104	69 Å²	69	68%	0.675	43%	0.427	S	S	*	.	S	Bend	cis	-82.1	-9.9	7.6	32.4	-35.7	0	0	0	115.6	L399	P394-L399 HydrophobicContact CG-CD2 3.79Å
395	G	88.8	Confident	86.5	Confident	22 Å²	22	67.3 Å²	67.3	23%	0.227	42%	0.419	C	S	.	.			trans	172.6	178.1	177.9	0	0	0	0	0	111.4	F392 L399 V404	F392-G395 PolarHBondContact O-N 3.37Å; G395-L399 WeakPolarHBondContact O-CD2 3.32Å; G395-V404 WeakPolarHBondContact O-CG2 3.46Å
396	A	86.8	Confident	86.8	Confident	30 Å²	30	62 Å²	62	25%	0.248	38%	0.384	C	S	.	.	S	Bend	trans	-102	-13.6	-177.1	0	0	0	0	0	114.6	S367 V368 F392	S367-A396 CarbonylContact C-O 3.59Å; S367-A396 VanDerWaalsContact CA-O 3.3Å; S367-A396 WeakPolarHBondContact CA-O 3.49Å; V368-A396 PolarHBondContact N-O 3.46Å; F392-A396 HydrophobicContact CB-CB 4.13Å; F392-A396 HydrophobicContact CD1-CB 4.37Å; F392-A396 HydrophobicContact CD2-CB 3.82Å; F392-A396 HydrophobicContact CE2-CB 4.32Å; F392-A396 HydrophobicContact CG-CB 3.85Å
397	R	90.2	Very high	86.9	Confident	191 Å²	191	62.9 Å²	62.9	72%	0.721	39%	0.391	S	S	*	.	S	Bend	trans	-137.1	153.8	-176.7	-63.7	-174.5	-179.8	-177.4	1.3	110.8	L399	R397-L399 PolarHBondContact O-N 2.94Å
398	G	86.3	Confident	87.1	Confident	48 Å²	48	62.6 Å²	62.6	50%	0.495	39%	0.388	S	S	.	.	S	Bend	trans	68.5	24.7	176.7	0	0	0	0	0	113.3	Y366	Y366-G398 PolarHBondContact O-N 2.85Å
399	L	90.4	Very high	87.5	Confident	9 Å²	9	55.8 Å²	55.8	5%	0.047	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-71.1	131.2	-180	-66.7	169.2	0	0	0	109.8	W352 R365 Y366 V368 P394 G395 R397 V404	W352-L399 HydrophobicContact CH2-CD1 4.2Å; W352-L399 HydrophobicContact CZ2-CD1 4.48Å; R365-L399 CarbonylContact C-O 3.58Å; R365-L399 WeakPolarHBondContact CA-O 3.39Å; Y366-L399 WeakPolarHBondContact CD2-O 3.07Å; Y366-L399 PolarHBondContact N-O 2.61Å; Y366-L399 PolarHBondContact O-N 3.34Å; V368-L399 HydrophobicContact CG2-CD1 4.03Å; P394-L399 HydrophobicContact CG-CD2 3.79Å; G395-L399 WeakPolarHBondContact O-CD2 3.32Å; R397-L399 PolarHBondContact O-N 2.94Å; L399-V404 HydrophobicContact CD1-CB 4.24Å; L399-V404 HydrophobicContact CD1-CG2 4.31Å
400	T	88.1	Confident	87.4	Confident	111 Å²	111	59 Å²	59	68%	0.681	35%	0.349	S	S	*	.			trans	-97.5	-18.5	172.8	51.9	0	0	0	0	112.3
401	T	88.6	Confident	86.5	Confident	76 Å²	76	61.9 Å²	61.9	47%	0.466	37%	0.369	S	S	.	.	S	Bend	trans	-93.9	146.7	176.9	53.6	0	0	0	0	111.2	A403	T401-A403 PolarHBondContact O-N 3.48Å; T401-A403 VanDerWaalsContact O-N 3.16Å
402	S	90.4	Very high	85.5	Confident	46 Å²	46	65.7 Å²	65.7	32%	0.322	38%	0.38	S	S	.	.	S	Bend	trans	-88	31.8	-177.4	70	0	0	0	0	114.2	R351 W352	R351-S402 WeakPolarHBondContact CA-O 3.28Å; W352-S402 VanDerWaalsContact CE2-CA 3.5Å; W352-S402 PolarHBondContact N-O 3.19Å; W352-S402 WeakPolarHBondContact O-CB 3.31Å; W352-S402 PolarHBondContact O-OG 3.38Å
403	A	90.3	Very high	84.6	Confident	31 Å²	31	64.1 Å²	64.1	26%	0.256	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	143.1	178.8	0	0	0	0	0	110.7	L350 R351 T401	L350-A403 VanDerWaalsContact O-CA 3.26Å; L350-A403 WeakPolarHBondContact O-CA 3.25Å; R351-A403 HydrophobicContact CG-CB 4.08Å; T401-A403 PolarHBondContact O-N 3.48Å; T401-A403 VanDerWaalsContact O-N 3.16Å
404	V	92.8	Very high	84.3	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	140.2	170.5	74.5	0	0	0	0	109.9	L350 W352 V368 F392 S393 G395 L399 V406	L350-V404 HydrophobicContact CB-CG1 4Å; L350-V404 HydrophobicContact CD1-CG1 4.12Å; L350-V404 PolarHBondContact N-O 3.35Å; L350-V404 PolarHBondContact O-N 3.04Å; W352-V404 HydrophobicContact CH2-CB 4.16Å; W352-V404 HydrophobicContact CH2-CG1 4.1Å; W352-V404 HydrophobicContact CZ3-CB 4.4Å; W352-V404 HydrophobicContact CZ3-CG1 3.98Å; V368-V404 HydrophobicContact CG2-CG1 4.06Å; F392-V404 HydrophobicContact CB-CG2 4.06Å; F392-V404 HydrophobicContact CD1-CG1 4.44Å; F392-V404 HydrophobicContact CD1-CG2 4.11Å; S393-V404 WeakPolarHBondContact O-CG2 3.27Å; G395-V404 WeakPolarHBondContact O-CG2 3.46Å; L399-V404 HydrophobicContact CD1-CB 4.24Å; L399-V404 HydrophobicContact CD1-CG2 4.31Å; V404-V406 HydrophobicContact CG1-CG2 4.16Å
405	H	90.6	Very high	84.3	Confident	102 Å²	102	57.4 Å²	57.4	47%	0.472	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	128.5	172.6	-68.2	-71.7	0	0	0	109.5	S349 F392 S393	S349-H405 PolarHBondContact OG-CE1 3.27Å; F392-H405 WeakPolarHBondContact CA-O 3.36Å; S393-H405 PolarHBondContact N-O 3.47Å; S393-H405 PolarHBondContact O-N 2.86Å
406	V	90.4	Very high	84.2	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.006	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126.5	-179.9	-170.7	0	0	0	0	109	L348 L350 V390 H391 F392 V404 L409 F417	L348-V406 HydrophobicContact CB-CB 4.28Å; L348-V406 PolarHBondContact N-O 3.34Å; L348-V406 PolarHBondContact O-N 3.47Å; L350-V406 HydrophobicContact CD1-CG2 4.14Å; V390-V406 HydrophobicContact CG1-CG1 3.4Å; V390-V406 VanDerWaalsContact CG1-CG1 3.4Å; H391-V406 WeakPolarHBondContact O-CA 3.23Å; F392-V406 HydrophobicContact CD1-CG2 3.72Å; F392-V406 HydrophobicContact CE1-CG1 4.27Å; F392-V406 HydrophobicContact CE1-CG2 3.73Å; V404-V406 HydrophobicContact CG1-CG2 4.16Å; V406-L409 HydrophobicContact CG1-CD1 4.46Å; V406-L409 HydrophobicContact CG1-CD2 4.07Å; V406-L409 HydrophobicContact CG1-CG 4.36Å; V406-F417 HydrophobicContact CB-CE1 4.46Å; V406-F417 HydrophobicContact CG1-CE1 3.87Å; V406-F417 HydrophobicContact CG1-CZ 4.02Å; V406-F417 HydrophobicContact CG2-CE1 4.11Å
407	S	85.8	Confident	84.4	Confident	46 Å²	46	56.1 Å²	56.1	32%	0.322	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	162.9	178.4	60.6	0	0	0	0	111.2	V390 H391	V390-S407 WeakPolarHBondContact CA-O 3.21Å; H391-S407 PolarHBondContact N-O 3.05Å; H391-S407 PolarHBondContact O-N 3.35Å
408	G	80.9	Confident	84.4	Confident	43 Å²	43	48.9 Å²	48.9	44%	0.443	29%	0.288	S	S	.	.			trans	84.5	26.5	-177.7	0	0	0	0	0	114
409	L	83.2	Confident	84.7	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.026	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-83.9	135.3	177.3	-58.8	176.1	0	0	0	111.4	T346 L348 V390 V406 Y415 F417 M442	T346-L409 WeakPolarHBondContact CB-O 3.31Å; T346-L409 WeakPolarHBondContact CG2-O 3.38Å; T346-L409 PolarHBondContact O-N 3.49Å; L348-L409 HydrophobicContact CB-CD1 3.5Å; L348-L409 HydrophobicContact CD2-CD1 4.12Å; L348-L409 HydrophobicContact CG-CD1 4.44Å; V390-L409 HydrophobicContact CG1-CD2 4.08Å; V390-L409 HydrophobicContact CG2-CD2 4.1Å; V406-L409 HydrophobicContact CG1-CD1 4.46Å; V406-L409 HydrophobicContact CG1-CD2 4.07Å; V406-L409 HydrophobicContact CG1-CG 4.36Å; L409-Y415 HydrophobicContact CB-CD2 4.47Å; L409-Y415 HydrophobicContact CB-CE2 4.01Å; L409-Y415 HydrophobicContact CD2-CD1 4.05Å; L409-Y415 HydrophobicContact CD2-CD2 4.06Å; L409-Y415 HydrophobicContact CD2-CE1 3.98Å; L409-Y415 HydrophobicContact CD2-CE2 4Å; L409-Y415 HydrophobicContact CD2-CG 4.09Å; L409-F417 HydrophobicContact CD1-CZ 4.33Å; L409-F417 HydrophobicContact CD2-CZ 3.93Å; L409-M442 HydrophobicContact CB-CE 4.14Å; L409-M442 HydrophobicContact CD1-CE 4.08Å; L409-M442 HydrophobicContact CD1-SD 4.24Å
410	E	74.1	Confident	84.8	Confident	111 Å²	111	46.9 Å²	46.9	52%	0.519	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-71.8	132.5	177.6	-66.4	179.2	158.2	0	0	111.7	Q372 A413 Y415	Q372-E410 PolarHBondContact NE2-OE2 2.8Å; E410-A413 HydrophobicContact CB-CB 3.97Å; E410-A413 PolarHBondContact O-N 3.26Å; E410-Y415 WeakPolarHBondContact CB-OH 3.36Å; E410-Y415 PolarHBondContact N-OH 3.2Å; E410-Y415 VanDerWaalsContact N-OH 3.15Å
411	P	66.6	Low	84.9	Confident	82 Å²	82	41.6 Å²	41.6	53%	0.532	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	143.4	171.2	-21	31.4	0	0	0	111.6	T346 A413	T346-P411 HydrophobicContact CG2-CG 3.97Å; P411-A413 PolarHBondContact O-N 3.23Å; P411-A413 VanDerWaalsContact O-N 3.14Å
412	Y	67.3	Low	85	Confident	198 Å²	198	41 Å²	41	78%	0.776	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.5	8	179.2	-47	-79.4	0	0	0	116.2	M442	Y412-M442 PolarHBondContact N-O 3.23Å
413	A	73.4	Confident	85	Confident	15 Å²	15	39.5 Å²	39.5	12%	0.124	21%	0.214	C	C	.	.			trans	-92.7	152.2	173	0	0	0	0	0	112.2	E410 P411 Y415 M442	E410-A413 HydrophobicContact CB-CB 3.97Å; E410-A413 PolarHBondContact O-N 3.26Å; P411-A413 PolarHBondContact O-N 3.23Å; P411-A413 VanDerWaalsContact O-N 3.14Å; A413-Y415 HydrophobicContact CB-CD2 4.29Å; A413-Y415 HydrophobicContact CB-CE2 3.6Å; A413-M442 PolarHBondContact O-N 3.37Å
414	N	80.6	Confident	84.9	Confident	33 Å²	33	39.7 Å²	39.7	18%	0.176	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	120	177.1	-67.3	-16.8	0	0	0	110.1	C373 G375 I440 S441	C373-N414 PolarHBondContact N-O 3.23Å; G375-N414 PolarHBondContact O-ND2 2.79Å; N414-I440 WeakPolarHBondContact CA-O 3.35Å; N414-S441 WeakPolarHBondContact OD1-CA 3.49Å; N414-S441 WeakPolarHBondContact OD1-CB 3.32Å; N414-S441 PolarHBondContact OD1-OG 2.91Å
415	Y	85.2	Confident	84.8	Confident	5 Å²	5	39.7 Å²	39.7	2%	0.02	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135.5	178.4	-68.7	-85.1	0	0	0	110.4	Q372 L409 E410 A413 F417 S439 I440	Q372-Y415 HydrophobicContact CB-CD1 4.11Å; Q372-Y415 HydrophobicContact CB-CE1 3.95Å; Q372-Y415 HydrophobicContact CG-CD1 4.27Å; Q372-Y415 HydrophobicContact CG-CE1 3.89Å; L409-Y415 HydrophobicContact CB-CD2 4.47Å; L409-Y415 HydrophobicContact CB-CE2 4.01Å; L409-Y415 HydrophobicContact CD2-CD1 4.05Å; L409-Y415 HydrophobicContact CD2-CD2 4.06Å; L409-Y415 HydrophobicContact CD2-CE1 3.98Å; L409-Y415 HydrophobicContact CD2-CE2 4Å; L409-Y415 HydrophobicContact CD2-CG 4.09Å; E410-Y415 WeakPolarHBondContact CB-OH 3.36Å; E410-Y415 PolarHBondContact N-OH 3.2Å; E410-Y415 VanDerWaalsContact N-OH 3.15Å; A413-Y415 HydrophobicContact CB-CD2 4.29Å; A413-Y415 HydrophobicContact CB-CE2 3.6Å; Y415-F417 HydrophobicContact CG-CE2 4.41Å; Y415-S439 CarbonylContact O-C 3.55Å; Y415-S439 WeakPolarHBondContact O-CA 3.29Å; Y415-I440 PolarHBondContact N-O 2.62Å; Y415-I440 PolarHBondContact O-N 2.91Å
416	T	87.4	Confident	84.6	Confident	26 Å²	26	35.3 Å²	35.3	16%	0.16	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	125	169.2	-57.4	0	0	0	0	109	S371 V438 S439	S371-T416 PolarHBondContact N-O 3.24Å; S371-T416 PolarHBondContact O-N 3.07Å; S371-T416 PolarHBondContact OG-O 3.39Å; T416-V438 CarbonylContact C-O 3.51Å; T416-V438 WeakPolarHBondContact CA-O 3.07Å; T416-S439 PolarHBondContact OG1-OG 2.81Å
417	F	90.4	Very high	84.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	126.2	176.2	-65.6	-88	0	0	0	109.4	L348 L350 V368 R369 C370 F392 V406 L409 Y415 S437 V438 I440	L348-F417 HydrophobicContact CD2-CD2 3.72Å; L348-F417 HydrophobicContact CD2-CE2 3.23Å; L348-F417 HydrophobicContact CD2-CZ 3.71Å; L350-F417 HydrophobicContact CD1-CB 3.75Å; L350-F417 HydrophobicContact CD1-CD1 3.83Å; L350-F417 HydrophobicContact CD1-CD2 4.32Å; L350-F417 HydrophobicContact CD1-CG 3.7Å; V368-F417 HydrophobicContact CG1-CD1 4.28Å; R369-F417 CarbonylContact O-C 3.54Å; R369-F417 WeakPolarHBondContact O-CA 3.34Å; C370-F417 HydrophobicContact CB-CD1 3.84Å; C370-F417 HydrophobicContact CB-CE1 3.69Å; C370-F417 WeakPolarHBondContact SG-CE1 3.43Å; F392-F417 HydrophobicContact CE1-CD1 4.35Å; F392-F417 HydrophobicContact CE1-CE1 4.22Å; F392-F417 HydrophobicContact CZ-CE1 4.33Å; V406-F417 HydrophobicContact CB-CE1 4.46Å; V406-F417 HydrophobicContact CG1-CE1 3.87Å; V406-F417 HydrophobicContact CG1-CZ 4.02Å; V406-F417 HydrophobicContact CG2-CE1 4.11Å; L409-F417 HydrophobicContact CD1-CZ 4.33Å; L409-F417 HydrophobicContact CD2-CZ 3.93Å; Y415-F417 HydrophobicContact CG-CE2 4.41Å; F417-S437 CarbonylContact O-C 3.49Å; F417-S437 WeakPolarHBondContact O-CA 3.23Å; F417-V438 HydrophobicContact CB-CG1 4.19Å; F417-V438 PolarHBondContact N-O 2.81Å; F417-V438 PolarHBondContact O-N 2.54Å; F417-I440 HydrophobicContact CD2-CD1 4.12Å; F417-I440 HydrophobicContact CE2-CD1 4.34Å
418	N	90.1	Very high	84.2	Confident	39 Å²	39	40.6 Å²	40.6	21%	0.209	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	120.7	175.8	-166.6	14	0	0	0	110.3	V368 R369 S435 T436	V368-N418 CarbonylContact C-O 3.5Å; V368-N418 WeakPolarHBondContact CA-O 3.32Å; R369-N418 HydrophobicContact CB-CB 4.42Å; R369-N418 PolarHBondContact N-O 3.45Å; R369-N418 PolarHBondContact O-N 3Å; N418-S435 WeakPolarHBondContact ND2-CB 3.49Å; N418-S435 PolarHBondContact ND2-OG 3.1Å; N418-S435 WeakPolarHBondContact OD1-CB 3.37Å; N418-S435 PolarHBondContact OD1-OG 3.19Å; N418-S435 VanDerWaalsContact OD1-OG 3.05Å; N418-T436 WeakPolarHBondContact CA-O 3.4Å; N418-T436 PolarHBondContact OD1-N 3.42Å; N418-T436 PolarHBondContact OD1-O 3.07Å; N418-T436 VanDerWaalsContact OD1-O 3.08Å
419	V	92.1	Very high	83.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	112.8	178.4	-173.2	0	0	0	0	108.8	P336 L339 W352 V368 S435 T436	P336-V419 HydrophobicContact CG-CB 4.47Å; P336-V419 HydrophobicContact CG-CG1 4.01Å; L339-V419 HydrophobicContact CD1-CG2 3.88Å; L339-V419 HydrophobicContact CD2-CG2 3.97Å; W352-V419 HydrophobicContact CD2-CG1 3.89Å; W352-V419 HydrophobicContact CE3-CG1 4.21Å; W352-V419 HydrophobicContact CE3-CG2 4.15Å; W352-V419 HydrophobicContact CG-CG1 4.38Å; W352-V419 HydrophobicContact CH2-CG1 4.33Å; W352-V419 HydrophobicContact CZ2-CG1 4Å; W352-V419 HydrophobicContact CZ3-CG1 4.42Å; W352-V419 HydrophobicContact CZ3-CG2 4.3Å; V368-V419 HydrophobicContact CG1-CG2 4.33Å; V368-V419 HydrophobicContact CG2-CG1 4.29Å; V368-V419 HydrophobicContact CG2-CG2 4.1Å; V419-S435 CarbonylContact O-C 3.59Å; V419-S435 VanDerWaalsContact O-CA 3.28Å; V419-S435 WeakPolarHBondContact O-CA 3.44Å; V419-T436 HydrophobicContact CB-CG2 4.24Å; V419-T436 PolarHBondContact N-O 2.91Å; V419-T436 PolarHBondContact O-N 2.84Å
420	E	92.1	Very high	83	Confident	14 Å²	14	45.4 Å²	45.4	7%	0.065	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	137.1	177.4	-70.4	168.8	-156.4	0	0	110.4	Y366 S367 R369 Q422 H433 A434	Y366-E420 CarbonylContact C-O 3.53Å; Y366-E420 VanDerWaalsContact CA-O 3.28Å; Y366-E420 WeakPolarHBondContact CA-O 3.16Å; S367-E420 PolarHBondContact N-O 3.1Å; S367-E420 PolarHBondContact O-N 3.46Å; R369-E420 WeakPolarHBondContact CD-OE1 3.41Å; R369-E420 IonicContact CZ-OE1 2.66Å; R369-E420 IonicContact NE-OE1 3.21Å; R369-E420 PolarHBondContact NE-OE1 2.89Å; R369-E420 IonicContact NE-OE2 2.92Å; R369-E420 IonicContact NH2-OE1 2.84Å; R369-E420 IonicContact NH2-OE2 3.84Å; E420-Q422 PolarHBondContact OE2-NE2 3.05Å; E420-H433 HydrophobicContact CB-CB 4.31Å; E420-H433 HydrophobicContact CG-CB 4.07Å; E420-H433 IonicContact OE2-CD2 3.4Å; E420-H433 IonicContact OE2-CG 3.49Å; E420-A434 WeakPolarHBondContact CA-O 3.46Å
421	A	91.7	Very high	82.6	Confident	1 Å²	1	44 Å²	44	1%	0.008	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	136.6	169.3	0	0	0	0	0	110.6	P333 P336 P355 V364 Y366 A434	P333-A421 HydrophobicContact CB-CB 4.42Å; P333-A421 HydrophobicContact CG-CB 3.89Å; P336-A421 HydrophobicContact CG-CB 4.05Å; P355-A421 HydrophobicContact CG-CB 3.74Å; V364-A421 HydrophobicContact CG1-CB 4.35Å; Y366-A421 HydrophobicContact CD1-CB 4.07Å; Y366-A421 HydrophobicContact CE1-CB 4.06Å; A421-A434 PolarHBondContact N-O 3.2Å; A421-A434 VanDerWaalsContact N-O 3.12Å
422	Q	90.8	Very high	82.5	Confident	63 Å²	63	43.3 Å²	43.3	29%	0.294	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	148.2	-178.6	-58.1	-178.1	7	0	0	110.6	V364 R365 E420	V364-Q422 CarbonylContact C-O 3.41Å; V364-Q422 WeakPolarHBondContact CA-O 3.5Å; R365-Q422 PolarHBondContact N-O 3.38Å; R365-Q422 PolarHBondContact O-N 2.65Å; E420-Q422 PolarHBondContact OE2-NE2 3.05Å
423	N	90.4	Very high	82.9	Confident	15 Å²	15	37.8 Å²	37.8	8%	0.08	26%	0.263	C	S	.	.			trans	-132.7	-178.3	172.7	70.1	5.3	0	0	0	110.6	R331 M358 V364 V425 S426	R331-N423 PolarHBondContact O-ND2 3.03Å; M358-N423 PolarHBondContact O-ND2 3.1Å; V364-N423 HydrophobicContact CG2-CB 4.3Å; N423-V425 PolarHBondContact O-N 3.39Å; N423-V425 WeakPolarHBondContact OD1-CG2 3.26Å; N423-V425 PolarHBondContact OD1-N 3.3Å; N423-S426 PolarHBondContact N-OG 3.25Å; N423-S426 WeakPolarHBondContact O-CB 3.13Å; N423-S426 PolarHBondContact O-N 2.73Å; N423-S426 PolarHBondContact O-OG 3.34Å; N423-S426 PolarHBondContact OD1-N 3.26Å; N423-S426 VanDerWaalsContact OD1-N 3.16Å; N423-S426 PolarHBondContact OD1-OG 2.94Å
424	G	87.4	Confident	83.2	Confident	34 Å²	34	38.7 Å²	38.7	35%	0.351	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-15.3	-176.4	0	0	0	0	0	116.4	D363	D363-G424 WeakPolarHBondContact OD2-CA 3.28Å; D363-G424 PolarHBondContact OD2-N 3.4Å; D363-G424 VanDerWaalsContact OD2-N 3.16Å
425	V	90	Very high	83.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-4.1	179	-63.8	0	0	0	0	114.1	A320 N423 G427 L428	A320-V425 HydrophobicContact CB-CG1 4.34Å; N423-V425 PolarHBondContact O-N 3.39Å; N423-V425 WeakPolarHBondContact OD1-CG2 3.26Å; N423-V425 PolarHBondContact OD1-N 3.3Å; V425-G427 PolarHBondContact O-N 2.85Å; V425-G427 VanDerWaalsContact O-N 3.1Å; V425-L428 HydrophobicContact CG1-CD1 4.48Å; V425-L428 PolarHBondContact O-N 2.88Å
426	S	87.9	Confident	83.7	Confident	10 Å²	10	41 Å²	41	7%	0.07	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-16	-175.7	-64	0	0	0	0	114.3	P333 N423	P333-S426 WeakPolarHBondContact CD-OG 3.35Å; N423-S426 PolarHBondContact N-OG 3.25Å; N423-S426 WeakPolarHBondContact O-CB 3.13Å; N423-S426 PolarHBondContact O-N 2.73Å; N423-S426 PolarHBondContact O-OG 3.34Å; N423-S426 PolarHBondContact OD1-N 3.26Å; N423-S426 VanDerWaalsContact OD1-N 3.16Å; N423-S426 PolarHBondContact OD1-OG 2.94Å
427	G	84.4	Confident	83.8	Confident	73 Å²	73	43.5 Å²	43.5	75%	0.753	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-4	174.9	0	0	0	0	0	115.3	V425	V425-G427 PolarHBondContact O-N 2.85Å; V425-G427 VanDerWaalsContact O-N 3.1Å
428	L	83.5	Confident	83.6	Confident	85 Å²	85	44.8 Å²	44.8	45%	0.445	31%	0.314	S	S	.	.	S	Bend	trans	-99.5	-13.8	-175.4	-61	173.9	0	0	0	113.4	Y318 R319 V425	Y318-L428 HydrophobicContact CD1-CB 3.88Å; Y318-L428 HydrophobicContact CE1-CB 4.4Å; Y318-L428 HydrophobicContact CG-CB 3.96Å; Y318-L428 HydrophobicContact CG-CD1 4.49Å; R319-L428 VanDerWaalsContact O-CD1 3.25Å; R319-L428 WeakPolarHBondContact O-CD1 3.35Å; V425-L428 HydrophobicContact CG1-CD1 4.48Å; V425-L428 PolarHBondContact O-N 2.88Å
429	G	73.8	Confident	83.3	Confident	21 Å²	21	46.4 Å²	46.4	22%	0.216	33%	0.329	C	S	.	.	S	Bend	trans	-97.5	158.2	-179.8	0	0	0	0	0	113.9	Y318	Y318-G429 WeakPolarHBondContact OH-CA 3.3Å
430	S	65.1	Low	82.7	Confident	129 Å²	129	47.3 Å²	47.3	90%	0.902	33%	0.334	S	S	*	.	S	Bend	trans	-87.6	-11.3	176.9	54	0	0	0	0	114
431	S	64.7	Low	81.8	Confident	80 Å²	80	50.3 Å²	50.3	56%	0.559	36%	0.356	S	S	*	.	S	Bend	trans	-73.8	127	174.5	57.3	0	0	0	0	110.1
432	G	63.9	Low	80.6	Confident	69 Å²	69	51 Å²	51	71%	0.711	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-54.5	156.1	173.9	0	0	0	0	0	112.6	A434	G432-A434 PolarHBondContact O-N 3.46Å
433	H	76.1	Confident	79	Confident	82 Å²	82	51.3 Å²	51.3	38%	0.38	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-58.3	130.8	-177	-57.2	-58.4	0	0	0	111.6	E420 S435	E420-H433 HydrophobicContact CB-CB 4.31Å; E420-H433 HydrophobicContact CG-CB 4.07Å; E420-H433 IonicContact OE2-CD2 3.4Å; E420-H433 IonicContact OE2-CG 3.49Å; H433-S435 PolarHBondContact O-N 2.96Å
434	A	80.4	Confident	76.9	Confident	33 Å²	33	59.8 Å²	59.8	27%	0.273	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-67.9	121.7	177.4	0	0	0	0	0	109.6	P333 A335 E420 A421 G432	P333-A434 WeakPolarHBondContact O-CB 3.45Å; A335-A434 HydrophobicContact CB-CB 4.2Å; E420-A434 WeakPolarHBondContact CA-O 3.46Å; A421-A434 PolarHBondContact N-O 3.2Å; A421-A434 VanDerWaalsContact N-O 3.12Å; G432-A434 PolarHBondContact O-N 3.46Å
435	S	87	Confident	74.6	Confident	51 Å²	51	62.8 Å²	62.8	36%	0.357	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	140.4	-166.3	80.6	0	0	0	0	111.9	N418 V419 H433	N418-S435 WeakPolarHBondContact ND2-CB 3.49Å; N418-S435 PolarHBondContact ND2-OG 3.1Å; N418-S435 WeakPolarHBondContact OD1-CB 3.37Å; N418-S435 PolarHBondContact OD1-OG 3.19Å; N418-S435 VanDerWaalsContact OD1-OG 3.05Å; V419-S435 CarbonylContact O-C 3.59Å; V419-S435 VanDerWaalsContact O-CA 3.28Å; V419-S435 WeakPolarHBondContact O-CA 3.44Å; H433-S435 PolarHBondContact O-N 2.96Å
436	T	88.8	Confident	72.1	Confident	36 Å²	36	72 Å²	72	22%	0.221	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	135	175.2	-171.8	0	0	0	0	110.2	P336 L339 N418 V419	P336-T436 HydrophobicContact CB-CG2 3.84Å; P336-T436 HydrophobicContact CG-CG2 4.11Å; P336-T436 WeakPolarHBondContact O-CG2 3.4Å; L339-T436 HydrophobicContact CB-CG2 3.85Å; L339-T436 HydrophobicContact CD2-CG2 3.87Å; L339-T436 HydrophobicContact CG-CG2 4.41Å; N418-T436 WeakPolarHBondContact CA-O 3.4Å; N418-T436 PolarHBondContact OD1-N 3.42Å; N418-T436 PolarHBondContact OD1-O 3.07Å; N418-T436 VanDerWaalsContact OD1-O 3.08Å; V419-T436 HydrophobicContact CB-CG2 4.24Å; V419-T436 PolarHBondContact N-O 2.91Å; V419-T436 PolarHBondContact O-N 2.84Å
437	S	88.5	Confident	69.8	Low	79 Å²	79	77 Å²	77	55%	0.552	52%	0.515	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	138.9	-173.3	63.1	0	0	0	0	112.7	F417	F417-S437 CarbonylContact O-C 3.49Å; F417-S437 WeakPolarHBondContact O-CA 3.23Å
438	V	87.4	Confident	67.8	Low	26 Å²	26	81.1 Å²	81.1	16%	0.158	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	132.5	170.9	69	0	0	0	0	109.9	L339 L350 T416 F417 I440	L339-V438 HydrophobicContact CD2-CB 3.77Å; L339-V438 HydrophobicContact CD2-CG1 3.68Å; L339-V438 HydrophobicContact CG-CB 4.15Å; L339-V438 HydrophobicContact CG-CG1 4.07Å; L350-V438 HydrophobicContact CD2-CG1 3.82Å; T416-V438 CarbonylContact C-O 3.51Å; T416-V438 WeakPolarHBondContact CA-O 3.07Å; F417-V438 HydrophobicContact CB-CG1 4.19Å; F417-V438 PolarHBondContact N-O 2.81Å; F417-V438 PolarHBondContact O-N 2.54Å; V438-I440 HydrophobicContact CG1-CD1 4.02Å; V438-I440 HydrophobicContact CG1-CG1 4.42Å; V438-I440 HydrophobicContact CG2-CD1 4.44Å; V438-I440 HydrophobicContact CG2-CG1 4.09Å
439	S	83.6	Confident	66.2	Low	74 Å²	74	82.2 Å²	82.2	52%	0.517	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	129	176.5	-64.3	0	0	0	0	109.9	Y415 T416	Y415-S439 CarbonylContact O-C 3.55Å; Y415-S439 WeakPolarHBondContact O-CA 3.29Å; T416-S439 PolarHBondContact OG1-OG 2.81Å
440	I	79.5	Confident	65.5	Low	19 Å²	19	83.5 Å²	83.5	10%	0.097	55%	0.547	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	130.6	-169.9	-55.6	158.8	0	0	0	109.3	L348 L350 N414 Y415 F417 V438 M442	L348-I440 HydrophobicContact CD1-CD1 3.62Å; L348-I440 HydrophobicContact CD2-CD1 3.43Å; L348-I440 VanDerWaalsContact CD2-CD1 3.43Å; L348-I440 HydrophobicContact CG-CD1 4.15Å; L350-I440 HydrophobicContact CD2-CD1 4.31Å; N414-I440 WeakPolarHBondContact CA-O 3.35Å; Y415-I440 PolarHBondContact N-O 2.62Å; Y415-I440 PolarHBondContact O-N 2.91Å; F417-I440 HydrophobicContact CD2-CD1 4.12Å; F417-I440 HydrophobicContact CE2-CD1 4.34Å; V438-I440 HydrophobicContact CG1-CD1 4.02Å; V438-I440 HydrophobicContact CG1-CG1 4.42Å; V438-I440 HydrophobicContact CG2-CD1 4.44Å; V438-I440 HydrophobicContact CG2-CG1 4.09Å; I440-M442 HydrophobicContact CG2-SD 4.16Å
441	S	72.4	Confident	65.6	Low	77 Å²	77	78.5 Å²	78.5	54%	0.538	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	123.3	171	-58.8	0	0	0	0	109.3	N414 G443	N414-S441 WeakPolarHBondContact OD1-CA 3.49Å; N414-S441 WeakPolarHBondContact OD1-CB 3.32Å; N414-S441 PolarHBondContact OD1-OG 2.91Å; S441-G443 PolarHBondContact O-N 2.79Å
442	M	67.9	Low	65.9	Low	15 Å²	15	77.6 Å²	77.6	7%	0.074	50%	0.503	C	S	.	.			trans	-78.9	109.5	-175.9	-57.5	-63.3	-77.8	0	0	110.8	A343 G345 L409 Y412 A413 I440	A343-M442 HydrophobicContact CB-CE 4.48Å; A343-M442 HydrophobicContact CB-SD 4.35Å; G345-M442 WeakPolarHBondContact O-CE 3.46Å; L409-M442 HydrophobicContact CB-CE 4.14Å; L409-M442 HydrophobicContact CD1-CE 4.08Å; L409-M442 HydrophobicContact CD1-SD 4.24Å; Y412-M442 PolarHBondContact N-O 3.23Å; A413-M442 PolarHBondContact O-N 3.37Å; I440-M442 HydrophobicContact CG2-SD 4.16Å
443	G	56.7	Low	66.8	Low	69 Å²	69	74.7 Å²	74.7	71%	0.711	47%	0.472	S	S	*	.			trans	-147.6	153.3	-175.5	0	0	0	0	0	116.5	S441	S441-G443 PolarHBondContact O-N 2.79Å
444	H	45.8	Very low	67	Low	193 Å²	193	79.3 Å²	79.3	89%	0.894	49%	0.486	S	S	*	.			trans	-83.5	148.8	-175.6	-132.1	71.9	0	0	0	112.6
445	A	40.3	Very low	67.2	Low	98 Å²	98	81.2 Å²	81.2	81%	0.81	49%	0.491	S	S	*	.			trans	-129.9	135.2	-177.7	0	0	0	0	0	114.2
446	E	36.8	Very low	67.1	Low	194 Å²	194	82.7 Å²	82.7	91%	0.907	50%	0.497	S	S	*	.			trans	-130.4	151.3	166.5	-104.9	-167.7	164.1	0	0	110.5
447	P	38.8	Very low	66.7	Low	114 Å²	114	86.1 Å²	86.1	74%	0.74	51%	0.51	S	S	*	.			trans	-102	149.1	-167.7	29.6	-16.8	0	0	0	116.2
448	L	43.3	Very low	66.4	Low	160 Å²	160	87 Å²	87	84%	0.838	50%	0.504	S	S	*	.			trans	-128.2	137	173.1	-79.7	162.2	0	0	0	111.6
449	S	49.3	Very low	66.2	Low	108 Å²	108	88.9 Å²	88.9	76%	0.755	51%	0.51	S	S	*	.			trans	-111.8	141.9	-177.6	-57	0	0	0	0	112.6
450	G	58.8	Low	66	Low	47 Å²	47	87 Å²	87	49%	0.485	50%	0.496	S	S	.	.			trans	165.1	33.8	170.6	0	0	0	0	0	121.5	G469	G450-G469 WeakPolarHBondContact O-CA 3.46Å
451	L	68	Low	66.2	Low	24 Å²	24	93.8 Å²	93.8	13%	0.126	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	131.7	175.9	-68.2	161.9	0	0	0	111.9	Y481 V516 M518 S528	L451-Y481 HydrophobicContact CD2-CE1 4.09Å; L451-V516 HydrophobicContact CB-CG1 4.03Å; L451-V516 HydrophobicContact CD1-CG1 4.27Å; L451-M518 HydrophobicContact CD1-CB 4Å; L451-M518 HydrophobicContact CD2-CE 4.37Å; L451-S528 WeakPolarHBondContact O-CB 3.49Å
452	S	71.4	Confident	66.8	Low	61 Å²	61	93.2 Å²	93.2	43%	0.427	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	128.5	177.5	177.4	0	0	0	0	111.6	W467 A468	S452-W467 VanDerWaalsContact O-CA 3.27Å; S452-W467 WeakPolarHBondContact O-CA 3.48Å; S452-W467 VanDerWaalsContact O-CB 3.25Å; S452-W467 WeakPolarHBondContact O-CB 3.13Å; S452-A468 PolarHBondContact N-O 3.22Å; S452-A468 PolarHBondContact O-N 2.84Å
453	L	81.1	Confident	67.8	Low	9 Å²	9	92.5 Å²	92.5	5%	0.047	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	148.4	-177.5	-73.4	73.2	0	0	0	112.9	T466 W467 V514 V516 S528 H531 F533	L453-T466 CarbonylContact C-O 3.6Å; L453-W467 HydrophobicContact CG-CB 4.29Å; L453-V514 HydrophobicContact CD2-CB 4.03Å; L453-V514 HydrophobicContact CD2-CG1 3.61Å; L453-V516 HydrophobicContact CD1-CB 4.02Å; L453-V516 HydrophobicContact CD1-CG1 3.31Å; L453-V516 HydrophobicContact CG-CG1 4.18Å; L453-S528 VanDerWaalsContact CD1-OG 3.32Å; L453-S528 WeakPolarHBondContact CD1-OG 3.39Å; L453-H531 HydrophobicContact CB-CB 4.49Å; L453-F533 HydrophobicContact CB-CZ 4.38Å; L453-F533 HydrophobicContact CD2-CE2 4.48Å
454	R	80.6	Confident	69.3	Low	178 Å²	178	92.1 Å²	92.1	67%	0.672	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.6	141	176.1	-63.6	-174.8	177.7	-168.8	-1.5	110.9	L465 T466	R454-L465 WeakPolarHBondContact O-CA 3.43Å; R454-T466 HydrophobicContact CB-CG2 4.19Å; R454-T466 PolarHBondContact N-O 2.87Å; R454-T466 PolarHBondContact O-N 3.34Å
455	L	84.6	Confident	71.4	Confident	73 Å²	73	82.9 Å²	82.9	38%	0.382	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	129	175	-178.2	69	0	0	0	110.8	K458 L463 L465 F533	L455-K458 HydrophobicContact CD2-CB 4.33Å; L455-L463 HydrophobicContact CD1-CB 4.34Å; L455-L463 HydrophobicContact CD1-CD2 3.92Å; L455-L465 HydrophobicContact CB-CD2 4.21Å; L455-L465 HydrophobicContact CD1-CD2 3.62Å; L455-F533 HydrophobicContact CB-CD1 3.88Å; L455-F533 HydrophobicContact CB-CE1 3.68Å; L455-F533 HydrophobicContact CD1-CD1 4.23Å; L455-F533 HydrophobicContact CD2-CD1 4.17Å; L455-F533 HydrophobicContact CG-CD1 4.33Å
456	V	85.9	Confident	73.7	Confident	82 Å²	82	80.5 Å²	80.5	50%	0.497	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-48.3	179.8	-177.3	0	0	0	0	111	E464 T466	V456-E464 HydrophobicContact CB-CB 4.12Å; V456-E464 HydrophobicContact CB-CG 3.99Å; V456-E464 WeakPolarHBondContact CB-O 3.27Å; V456-E464 HydrophobicContact CG1-CG 4.32Å; V456-E464 PolarHBondContact N-O 3.37Å; V456-T466 HydrophobicContact CG2-CG2 3.46Å; V456-T466 VanDerWaalsContact CG2-CG2 3.46Å
457	K	80.6	Confident	76	Confident	109 Å²	109	71.6 Å²	71.6	47%	0.474	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	142.9	-177	-158.3	-174.9	-174.2	-162.7	0	111.5	E459 E464	K457-E459 WeakPolarHBondContact CE-OE1 3.45Å; K457-E459 IonicContact NZ-OE1 2.88Å; K457-E459 PolarHBondContact NZ-OE1 2.96Å; K457-E464 HydrophobicContact CB-CB 3.81Å; K457-E464 WeakPolarHBondContact CB-OE2 3.31Å; K457-E464 PolarHBondContact N-O 3.32Å; K457-E464 PolarHBondContact O-N 3.27Å
458	K	82.6	Confident	77.4	Confident	98 Å²	98	69.7 Å²	69.7	43%	0.426	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	116.8	-178.4	175.2	175.2	165.3	155.6	0	111	L455 L463 R534 T535	L455-K458 HydrophobicContact CD2-CB 4.33Å; K458-L463 HydrophobicContact CB-CD2 4.29Å; K458-L463 HydrophobicContact CG-CD2 4.12Å; K458-R534 WeakPolarHBondContact CD-O 3.2Å; K458-R534 WeakPolarHBondContact CE-O 3.29Å; K458-R534 PolarHBondContact NZ-O 2.77Å; K458-T535 VanDerWaalsContact CE-C 3.43Å; K458-T535 VanDerWaalsContact CE-O 3.31Å; K458-T535 WeakPolarHBondContact CE-O 3.09Å; K458-T535 PolarHBondContact NZ-O 3.3Å
459	E	81.5	Confident	78.4	Confident	64 Å²	64	63.7 Å²	63.7	30%	0.299	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	168.6	177.7	-69.9	-168.4	-169.8	0	0	111.5	K457 R461 Q462 S536	K457-E459 WeakPolarHBondContact CE-OE1 3.45Å; K457-E459 IonicContact NZ-OE1 2.88Å; K457-E459 PolarHBondContact NZ-OE1 2.96Å; E459-R461 PolarHBondContact O-N 2.97Å; E459-Q462 HydrophobicContact CB-CB 4.17Å; E459-Q462 PolarHBondContact N-O 2.74Å; E459-Q462 PolarHBondContact O-N 3.45Å; E459-Q462 VanDerWaalsContact O-O 3.12Å; E459-S536 VanDerWaalsContact CA-OG 3.29Å; E459-S536 WeakPolarHBondContact CA-OG 3.22Å; E459-S536 PolarHBondContact O-N 3.47Å; E459-S536 PolarHBondContact O-OG 2.73Å
460	P	80.4	Confident	78.7	Confident	35 Å²	35	63.1 Å²	63.1	23%	0.227	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-24.4	-172.2	-25.2	35.3	0	0	0	114.2	P508 S536 P537	P460-P508 HydrophobicContact CB-CB 4.27Å; P460-P508 WeakPolarHBondContact O-CA 3.42Å; P460-P508 VanDerWaalsContact O-CB 3.26Å; P460-P508 WeakPolarHBondContact O-CB 3.47Å; P460-S536 WeakPolarHBondContact CA-O 3.29Å; P460-S536 WeakPolarHBondContact CA-OG 3.1Å; P460-S536 WeakPolarHBondContact CB-O 2.86Å; P460-S536 VanDerWaalsContact CD-OG 3.25Å; P460-S536 WeakPolarHBondContact CD-OG 3.48Å; P460-S536 WeakPolarHBondContact CG-OG 3.42Å; P460-P537 WeakPolarHBondContact CG-O 3.32Å
461	R	82.5	Confident	78.6	Confident	162 Å²	162	70.8 Å²	70.8	61%	0.611	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129	13.1	176.8	-62.2	-166.8	171.7	168.4	-4.2	113.4	E459 T504 E505 L506	E459-R461 PolarHBondContact O-N 2.97Å; R461-T504 CarbonylContact O-C 3.59Å; R461-E505 PolarHBondContact O-N 3.42Å; R461-E505 VanDerWaalsContact O-N 3.08Å; R461-L506 VanDerWaalsContact CA-O 3.28Å; R461-L506 WeakPolarHBondContact CA-O 3.37Å; R461-L506 WeakPolarHBondContact CB-O 3.3Å; R461-L506 VanDerWaalsContact CG-O 3.32Å; R461-L506 WeakPolarHBondContact CG-O 3.49Å; R461-L506 PolarHBondContact O-N 3.16Å
462	Q	86.6	Confident	77.9	Confident	64 Å²	64	73.5 Å²	73.5	30%	0.299	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	141.8	-174.7	-48	-174.8	-13.9	0	0	112.5	E459 L502 L503 T504	E459-Q462 HydrophobicContact CB-CB 4.17Å; E459-Q462 PolarHBondContact N-O 2.74Å; E459-Q462 PolarHBondContact O-N 3.45Å; E459-Q462 VanDerWaalsContact O-O 3.12Å; Q462-L502 HydrophobicContact CB-CD1 4.24Å; Q462-L503 CarbonylContact C-O 3.51Å; Q462-L503 WeakPolarHBondContact CA-O 3.4Å; Q462-L503 WeakPolarHBondContact CB-O 3.45Å; Q462-T504 HydrophobicContact CG-CG2 4.05Å
463	L	87.6	Confident	76.9	Confident	0 Å²	0	82.3 Å²	82.3	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	126.5	171.5	-66.9	173.9	0	0	0	109.1	L455 K458 L503 L506 F533 T535	L455-L463 HydrophobicContact CD1-CB 4.34Å; L455-L463 HydrophobicContact CD1-CD2 3.92Å; K458-L463 HydrophobicContact CB-CD2 4.29Å; K458-L463 HydrophobicContact CG-CD2 4.12Å; L463-L503 HydrophobicContact CB-CB 4.48Å; L463-L503 PolarHBondContact N-O 3.32Å; L463-L503 PolarHBondContact O-N 3.03Å; L463-L506 HydrophobicContact CB-CD1 3.91Å; L463-L506 HydrophobicContact CD1-CD1 3.69Å; L463-L506 HydrophobicContact CG-CD1 3.6Å; L463-F533 HydrophobicContact CD1-CB 3.68Å; L463-T535 HydrophobicContact CD1-CG2 4.21Å; L463-T535 HydrophobicContact CD2-CG2 4.27Å; L463-T535 HydrophobicContact CG-CG2 3.99Å
464	E	89	Confident	75.1	Confident	61 Å²	61	87.2 Å²	87.2	29%	0.285	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	121.2	173.9	-168	-179.4	-179.2	0	0	109.4	V456 K457 V501 L502	V456-E464 HydrophobicContact CB-CB 4.12Å; V456-E464 HydrophobicContact CB-CG 3.99Å; V456-E464 WeakPolarHBondContact CB-O 3.27Å; V456-E464 HydrophobicContact CG1-CG 4.32Å; V456-E464 PolarHBondContact N-O 3.37Å; K457-E464 HydrophobicContact CB-CB 3.81Å; K457-E464 WeakPolarHBondContact CB-OE2 3.31Å; K457-E464 PolarHBondContact N-O 3.32Å; K457-E464 PolarHBondContact O-N 3.27Å; E464-V501 CarbonylContact C-O 3.58Å; E464-V501 WeakPolarHBondContact CA-O 3.49Å; E464-L502 HydrophobicContact CB-CD1 3.91Å; E464-L502 HydrophobicContact CG-CD1 4.33Å
465	L	90.1	Very high	73.5	Confident	0 Å²	0	84.8 Å²	84.8	0%	0	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	148.4	-175.1	-58	176.6	0	0	0	111	R454 L455 R500 V501 L503 V514 F533	R454-L465 WeakPolarHBondContact O-CA 3.43Å; L455-L465 HydrophobicContact CB-CD2 4.21Å; L455-L465 HydrophobicContact CD1-CD2 3.62Å; L465-R500 CarbonylContact O-C 3.5Å; L465-R500 VanDerWaalsContact O-CA 3.28Å; L465-R500 WeakPolarHBondContact O-CA 3.2Å; L465-V501 HydrophobicContact CB-CG1 4.14Å; L465-V501 PolarHBondContact N-O 3.29Å; L465-V501 PolarHBondContact O-N 3.24Å; L465-L503 HydrophobicContact CD1-CD1 3.81Å; L465-V514 HydrophobicContact CD1-CB 4.18Å; L465-V514 HydrophobicContact CD1-CG1 3.9Å; L465-V514 HydrophobicContact CD1-CG2 3.97Å; L465-F533 HydrophobicContact CD1-CD2 4.09Å; L465-F533 HydrophobicContact CD1-CE2 3.95Å; L465-F533 HydrophobicContact CD2-CD1 4.18Å; L465-F533 HydrophobicContact CD2-CD2 3.75Å; L465-F533 HydrophobicContact CD2-CE1 4.01Å; L465-F533 HydrophobicContact CD2-CE2 3.55Å; L465-F533 HydrophobicContact CD2-CG 4.06Å; L465-F533 HydrophobicContact CD2-CZ 3.69Å; L465-F533 HydrophobicContact CG-CE2 4.42Å
466	T	87.8	Confident	72	Confident	47 Å²	47	85.7 Å²	85.7	29%	0.288	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	152.6	172.4	-172.5	0	0	0	0	110.5	L453 R454 V456 P499	L453-T466 CarbonylContact C-O 3.6Å; R454-T466 HydrophobicContact CB-CG2 4.19Å; R454-T466 PolarHBondContact N-O 2.87Å; R454-T466 PolarHBondContact O-N 3.34Å; V456-T466 HydrophobicContact CG2-CG2 3.46Å; V456-T466 VanDerWaalsContact CG2-CG2 3.46Å; T466-P499 VanDerWaalsContact CA-O 3.32Å; T466-P499 WeakPolarHBondContact CA-O 3.23Å; T466-P499 WeakPolarHBondContact CB-O 3.45Å; T466-P499 PolarHBondContact OG1-O 2.69Å
467	W	85.8	Confident	70.5	Confident	7 Å²	7	84.4 Å²	84.4	3%	0.027	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	149.9	176.7	52.3	91.8	0	0	0	111.5	S452 L453 Y481 L483 V496 E498 P499 V501 V516	S452-W467 VanDerWaalsContact O-CA 3.27Å; S452-W467 WeakPolarHBondContact O-CA 3.48Å; S452-W467 VanDerWaalsContact O-CB 3.25Å; S452-W467 WeakPolarHBondContact O-CB 3.13Å; L453-W467 HydrophobicContact CG-CB 4.29Å; W467-Y481 AromaticContact CE2-CG 3.9Å; W467-Y481 HydrophobicContact CZ2-CD1 4.41Å; W467-Y481 HydrophobicContact CZ2-CD2 4.08Å; W467-Y481 AromaticContact CZ2-CG 3.8Å; W467-Y481 HydrophobicContact CZ2-CG 3.8Å; W467-Y481 AromaticContact NE1-CD1 3.16Å; W467-Y481 AromaticContact NE1-CD2 3.88Å; W467-Y481 AromaticContact NE1-CE1 3.42Å; W467-Y481 AromaticContact NE1-CG 3.41Å; W467-Y481 AromaticContact NE1-CZ 3.91Å; W467-L483 HydrophobicContact CE3-CD1 4.42Å; W467-L483 HydrophobicContact CH2-CD1 3.22Å; W467-L483 HydrophobicContact CH2-CD2 4.2Å; W467-L483 HydrophobicContact CH2-CG 4.3Å; W467-L483 HydrophobicContact CZ2-CD1 3.62Å; W467-L483 HydrophobicContact CZ3-CD1 3.67Å; W467-L483 HydrophobicContact CZ3-CD2 3.87Å; W467-L483 HydrophobicContact CZ3-CG 4.32Å; W467-V496 HydrophobicContact CH2-CB 4.31Å; W467-V496 HydrophobicContact CH2-CG1 4.38Å; W467-V496 HydrophobicContact CH2-CG2 4.4Å; W467-E498 WeakPolarHBondContact CZ2-O 3.2Å; W467-P499 PolarHBondContact N-O 3.38Å; W467-P499 VanDerWaalsContact N-O 3.13Å; W467-P499 WeakPolarHBondContact O-CB 3.45Å; W467-V501 HydrophobicContact CH2-CB 4.3Å; W467-V501 HydrophobicContact CH2-CG1 4.39Å; W467-V501 HydrophobicContact CZ3-CB 4.34Å; W467-V501 HydrophobicContact CZ3-CG1 4.02Å; W467-V516 HydrophobicContact CB-CG1 4.5Å; W467-V516 HydrophobicContact CD2-CG1 4.33Å; W467-V516 HydrophobicContact CD2-CG2 4.21Å; W467-V516 HydrophobicContact CG-CG1 4.11Å; W467-V516 HydrophobicContact CZ2-CG2 4.14Å
468	A	68.8	Low	69.3	Low	74 Å²	74	87.1 Å²	87.1	61%	0.612	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	140.3	173.5	0	0	0	0	0	109.3	S452	S452-A468 PolarHBondContact N-O 3.22Å; S452-A468 PolarHBondContact O-N 2.84Å
469	G	63.2	Low	68.6	Low	35 Å²	35	84.9 Å²	84.9	36%	0.361	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	153.6	174.3	0	0	0	0	0	111.8	G450 R471	G450-G469 WeakPolarHBondContact O-CA 3.46Å; G469-R471 PolarHBondContact O-N 2.93Å; G469-R471 VanDerWaalsContact O-N 3.14Å
470	S	55.1	Low	68.2	Low	95 Å²	95	83.1 Å²	83.1	66%	0.664	48%	0.48	S	S	*	.			trans	-62.6	109.2	171	25.1	0	0	0	0	109.2
471	R	56.9	Low	68.4	Low	209 Å²	209	82.4 Å²	82.4	79%	0.789	47%	0.473	S	S	*	.			trans	-64.8	129.6	175.9	-67.6	-176.7	-177.4	-170.2	-0.2	109.4	G469	G469-R471 PolarHBondContact O-N 2.93Å; G469-R471 VanDerWaalsContact O-N 3.14Å
472	P	53	Low	68.5	Low	80 Å²	80	76.1 Å²	76.1	52%	0.519	45%	0.45	S	S	.	.			trans	-61.7	139.1	167.6	5.2	-0.8	0	0	0	109.8	S474	P472-S474 PolarHBondContact O-N 2.89Å
473	R	51	Low	68.5	Low	247 Å²	247	73 Å²	73	93%	0.932	44%	0.436	S	S	*	.	S	Bend	trans	-81.6	106.5	172.4	-84.2	179.2	170.5	162.3	-2.7	109
474	S	44	Very low	68.5	Low	111 Å²	111	73.1 Å²	73.1	78%	0.776	44%	0.436	S	S	*	.	S	Bend	trans	154.9	166.7	151.2	62.1	0	0	0	0	110.9	P472	P472-S474 PolarHBondContact O-N 2.89Å
475	P	47.6	Very low	68.3	Low	127 Å²	127	70.6 Å²	70.6	83%	0.825	43%	0.425	S	S	*	.	S	Bend		-107.3	133.1	-113.9	16.8	7	0	0	0	113.1
476	G	51.1	Low	67.9	Low	93 Å²	93	72.6 Å²	72.6	96%	0.959	44%	0.436	S	S	*	.			trans	84.8	29.1	153.3	0	0	0	0	0	119.2
477	G	55	Low	67.7	Low	54 Å²	54	72 Å²	72	56%	0.557	43%	0.43	S	S	*	.			trans	-113.8	134	170	0	0	0	0	0	112.9	L479	G477-L479 PolarHBondContact O-N 2.78Å
478	N	56.8	Low	67.2	Low	166 Å²	166	80.4 Å²	80.4	89%	0.888	47%	0.47	S	S	*	.			trans	-66.8	114.8	168.2	-85.3	-5.7	0	0	0	109
479	L	66.6	Low	67.2	Low	52 Å²	52	83.3 Å²	83.3	27%	0.272	48%	0.475	S	S	.	.			trans	-74.1	132.8	173.7	-64.3	167.2	0	0	0	109	G477 Y481 M518	G477-L479 PolarHBondContact O-N 2.78Å; L479-Y481 HydrophobicContact CB-CE2 4.4Å; L479-M518 HydrophobicContact CD2-CG 4.28Å; L479-M518 HydrophobicContact CD2-SD 3.79Å
480	S	73.4	Confident	67.4	Low	26 Å²	26	86.1 Å²	86.1	18%	0.182	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	152.9	169.1	62.7	0	0	0	0	110.3	L519	S480-L519 PolarHBondContact O-N 3.33Å
481	Y	83.6	Confident	68.8	Low	20 Å²	20	87.3 Å²	87.3	8%	0.078	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	140.8	-177.1	-57.9	-87.5	0	0	0	108.9	L451 W467 L479 M495 V496 P499 V516 R517 M518	L451-Y481 HydrophobicContact CD2-CE1 4.09Å; W467-Y481 AromaticContact CE2-CG 3.9Å; W467-Y481 HydrophobicContact CZ2-CD1 4.41Å; W467-Y481 HydrophobicContact CZ2-CD2 4.08Å; W467-Y481 AromaticContact CZ2-CG 3.8Å; W467-Y481 HydrophobicContact CZ2-CG 3.8Å; W467-Y481 AromaticContact NE1-CD1 3.16Å; W467-Y481 AromaticContact NE1-CD2 3.88Å; W467-Y481 AromaticContact NE1-CE1 3.42Å; W467-Y481 AromaticContact NE1-CG 3.41Å; W467-Y481 AromaticContact NE1-CZ 3.91Å; L479-Y481 HydrophobicContact CB-CE2 4.4Å; Y481-M495 WeakPolarHBondContact O-CA 3.39Å; Y481-V496 PolarHBondContact N-O 2.7Å; Y481-V496 PolarHBondContact O-N 3.24Å; Y481-P499 HydrophobicContact CE2-CB 4.4Å; Y481-V516 HydrophobicContact CD1-CG2 4.36Å; Y481-R517 WeakPolarHBondContact CA-O 3.31Å; Y481-M518 HydrophobicContact CD1-CB 4.3Å; Y481-M518 HydrophobicContact CE1-CB 4.28Å; Y481-M518 HydrophobicContact CE1-CE 3.81Å; Y481-M518 HydrophobicContact CE1-CG 4.26Å
482	E	85.3	Confident	69.9	Low	30 Å²	30	82 Å²	82	14%	0.14	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	121.2	171.6	-169.2	-168.5	-104.2	0	0	108.4	M495 V516 R517 L519 F527	E482-M495 HydrophobicContact CB-SD 3.67Å; E482-M495 HydrophobicContact CG-SD 3.76Å; E482-V516 WeakPolarHBondContact O-CA 3.32Å; E482-R517 HydrophobicContact CB-CG 4.04Å; E482-R517 PolarHBondContact N-O 3.24Å; E482-R517 PolarHBondContact O-N 3.1Å; E482-R517 IonicContact OE1-NH2 3.8Å; E482-R517 PolarHBondContact OE1-NH2 3.03Å; E482-R517 IonicContact OE2-CZ 3.94Å; E482-R517 IonicContact OE2-NE 3.07Å; E482-R517 PolarHBondContact OE2-NE 3.11Å; E482-R517 IonicContact OE2-NH2 2.75Å; E482-R517 PolarHBondContact OE2-NH2 2.86Å; E482-L519 HydrophobicContact CB-CD1 4.27Å; E482-L519 HydrophobicContact CB-CG 4.39Å; E482-F527 WeakPolarHBondContact OE2-CZ 3.41Å
483	L	86.8	Confident	71.4	Confident	0 Å²	0	83.7 Å²	83.7	0%	0	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	141.7	173.6	-90.6	78.2	0	0	0	109.7	W467 Y493 Q494 V496 V501 V514 R515 V516	W467-L483 HydrophobicContact CE3-CD1 4.42Å; W467-L483 HydrophobicContact CH2-CD1 3.22Å; W467-L483 HydrophobicContact CH2-CD2 4.2Å; W467-L483 HydrophobicContact CH2-CG 4.3Å; W467-L483 HydrophobicContact CZ2-CD1 3.62Å; W467-L483 HydrophobicContact CZ3-CD1 3.67Å; W467-L483 HydrophobicContact CZ3-CD2 3.87Å; W467-L483 HydrophobicContact CZ3-CG 4.32Å; L483-Y493 CarbonylContact O-C 3.54Å; L483-Y493 VanDerWaalsContact O-CA 3.29Å; L483-Y493 WeakPolarHBondContact O-CA 3.28Å; L483-Q494 PolarHBondContact N-O 3.4Å; L483-Q494 PolarHBondContact O-N 3.02Å; L483-V496 HydrophobicContact CD1-CG2 3.99Å; L483-V501 HydrophobicContact CD2-CG1 3.57Å; L483-V514 HydrophobicContact CD2-CG1 3.88Å; L483-V514 HydrophobicContact CG-CG1 4.43Å; L483-R515 WeakPolarHBondContact CA-O 3.44Å; L483-V516 HydrophobicContact CD1-CB 4.13Å; L483-V516 HydrophobicContact CD1-CG2 3.44Å; L483-V516 VanDerWaalsContact CD1-CG2 3.44Å; L483-V516 HydrophobicContact CG-CB 4.18Å; L483-V516 HydrophobicContact CG-CG2 4.03Å
484	H	87.4	Confident	72.8	Confident	1 Å²	1	74.6 Å²	74.6	1%	0.005	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	117.6	172.3	-178.5	-142.9	0	0	0	108.8	L486 E491 Y493 V514 R515 F527	H484-L486 WeakPolarHBondContact CE1-CD1 3.18Å; H484-L486 WeakPolarHBondContact ND1-CD1 3.5Å; H484-E491 IonicContact CE1-OE1 2.82Å; H484-E491 PolarHBondContact CE1-OE1 2.85Å; H484-E491 WeakPolarHBondContact NE2-CG 3.45Å; H484-E491 IonicContact NE2-OE1 2.95Å; H484-E491 PolarHBondContact NE2-OE1 3.41Å; H484-Y493 HydrophobicContact CB-CD1 3.92Å; H484-Y493 HydrophobicContact CB-CE1 3.79Å; H484-Y493 AromaticContact CD2-CD1 3.69Å; H484-Y493 AromaticContact CD2-CD2 3.84Å; H484-Y493 AromaticContact CD2-CE1 3.32Å; H484-Y493 WeakPolarHBondContact CD2-CE1 3.47Å; H484-Y493 AromaticContact CD2-CE2 3.46Å; H484-Y493 VanDerWaalsContact CD2-CE2 3.46Å; H484-Y493 WeakPolarHBondContact CD2-CE2 3.31Å; H484-Y493 AromaticContact CD2-CG 3.93Å; H484-Y493 AromaticContact CD2-CZ 3.18Å; H484-Y493 AromaticContact CE1-CZ 3.62Å; H484-Y493 PolarHBondContact CE1-OH 3.36Å; H484-Y493 AromaticContact CG-CD1 3.93Å; H484-Y493 AromaticContact CG-CE1 3.44Å; H484-Y493 VanDerWaalsContact CG-CE1 3.44Å; H484-Y493 AromaticContact CG-CZ 3.67Å; H484-Y493 AromaticContact ND1-CE1 3.98Å; H484-Y493 AromaticContact ND1-CZ 3.96Å; H484-Y493 AromaticContact NE2-CE1 3.81Å; H484-Y493 AromaticContact NE2-CE2 3.44Å; H484-Y493 WeakPolarHBondContact NE2-CE2 3.17Å; H484-Y493 AromaticContact NE2-CZ 3.18Å; H484-Y493 PolarHBondContact NE2-OH 3.24Å; H484-Y493 VanDerWaalsContact NE2-OH 3.1Å; H484-V514 WeakPolarHBondContact O-CA 3.37Å; H484-R515 HydrophobicContact CB-CG 3.77Å; H484-R515 PolarHBondContact CE1-NH2 3.41Å; H484-R515 VanDerWaalsContact CE1-NH2 3.28Å; H484-R515 PolarHBondContact N-O 3.33Å; H484-R515 PolarHBondContact ND1-NE 3.03Å; H484-R515 PolarHBondContact ND1-NH2 3Å; H484-R515 PolarHBondContact O-N 3.03Å; H484-F527 HydrophobicContact CB-CE1 4Å; H484-F527 HydrophobicContact CB-CZ 4.41Å
485	V	85.8	Confident	74.5	Confident	9 Å²	9	74.2 Å²	74.2	6%	0.055	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	122.4	-176.4	-178.4	0	0	0	0	108	R492 L503 Y512 I513 V514	V485-R492 PolarHBondContact N-O 3.12Å; V485-R492 PolarHBondContact O-N 3.47Å; V485-L503 HydrophobicContact CG1-CD1 4.44Å; V485-L503 HydrophobicContact CG2-CD1 3.87Å; V485-L503 HydrophobicContact CG2-CD2 4.04Å; V485-Y512 HydrophobicContact CG1-CD1 3.81Å; V485-Y512 HydrophobicContact CG1-CG 4.44Å; V485-I513 CarbonylContact C-O 3.56Å; V485-I513 WeakPolarHBondContact CA-O 3.43Å; V485-V514 HydrophobicContact CG1-CG2 4.2Å; V485-V514 HydrophobicContact CG2-CG1 4.1Å; V485-V514 HydrophobicContact CG2-CG2 4.13Å
486	L	82.2	Confident	76.2	Confident	42 Å²	42	69 Å²	69	22%	0.22	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	143	178.2	-55.9	105	0	0	0	111.3	H484 E490 E491 Y512 I513	H484-L486 WeakPolarHBondContact CE1-CD1 3.18Å; H484-L486 WeakPolarHBondContact ND1-CD1 3.5Å; L486-E490 CarbonylContact C-O 3.52Å; L486-E490 WeakPolarHBondContact CA-O 3.37Å; L486-E491 HydrophobicContact CD2-CG 4.07Å; L486-E491 HydrophobicContact CG-CG 4.3Å; L486-Y512 CarbonylContact O-C 3.46Å; L486-Y512 WeakPolarHBondContact O-CA 3.47Å; L486-I513 HydrophobicContact CB-CB 4.38Å; L486-I513 HydrophobicContact CD1-CB 4.47Å; L486-I513 HydrophobicContact CD1-CG2 4.3Å; L486-I513 PolarHBondContact N-O 3.33Å; L486-I513 PolarHBondContact O-N 2.81Å
487	N	81.7	Confident	77.5	Confident	33 Å²	33	71 Å²	71	18%	0.176	36%	0.36	C	S	.	.			trans	-133.9	177	161.5	-176.5	17.4	0	0	0	108.2	D489 E490 T510 T511 Y512	N487-D489 PolarHBondContact O-N 3.31Å; N487-E490 PolarHBondContact N-O 2.86Å; N487-T510 WeakPolarHBondContact ND2-CG2 3.14Å; N487-T511 PolarHBondContact OD1-O 2.97Å; N487-T511 VanDerWaalsContact OD1-O 3.11Å; N487-Y512 HydrophobicContact CB-CD1 3.63Å; N487-Y512 HydrophobicContact CB-CE1 3.59Å; N487-Y512 HydrophobicContact CB-CG 4.41Å
488	Q	75.1	Confident	78.6	Confident	185 Å²	185	73.4 Å²	73.4	86%	0.864	36%	0.357	S	S	*	.	S	Bend	trans	-58	-28.5	178	-64.6	-175.7	-9.3	0	0	113.4
489	D	68.8	Low	79.8	Confident	134 Å²	134	67.9 Å²	67.9	72%	0.717	33%	0.33	S	S	*	.	S	Bend	trans	-115.9	-6.3	-175.1	-57.1	-50.3	0	0	0	114.5	N487	N487-D489 PolarHBondContact O-N 3.31Å
490	E	69.2	Low	80.5	Confident	94 Å²	94	72.6 Å²	72.6	44%	0.439	34%	0.344	S	S	.	.			trans	-147.1	130.4	-170.6	-160	179.6	175.6	0	0	112.3	L486 N487	L486-E490 CarbonylContact C-O 3.52Å; L486-E490 WeakPolarHBondContact CA-O 3.37Å; N487-E490 PolarHBondContact N-O 2.86Å
491	E	82.8	Confident	81.2	Confident	121 Å²	121	71.9 Å²	71.9	57%	0.565	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.8	120.1	173.6	-169.9	-178.3	171.6	0	0	108.9	H484 L486 Y493	H484-E491 IonicContact CE1-OE1 2.82Å; H484-E491 PolarHBondContact CE1-OE1 2.85Å; H484-E491 WeakPolarHBondContact NE2-CG 3.45Å; H484-E491 IonicContact NE2-OE1 2.95Å; H484-E491 PolarHBondContact NE2-OE1 3.41Å; L486-E491 HydrophobicContact CD2-CG 4.07Å; L486-E491 HydrophobicContact CG-CG 4.3Å; E491-Y493 HydrophobicContact CG-CE2 4.12Å; E491-Y493 WeakPolarHBondContact OE1-CE2 3.05Å; E491-Y493 PolarHBondContact OE1-OH 3.3Å
492	R	80.4	Confident	81.4	Confident	98 Å²	98	75 Å²	75	37%	0.37	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	131.2	-173.1	-176.1	177.3	178.3	175.8	1.6	112.2	V485	V485-R492 PolarHBondContact N-O 3.12Å; V485-R492 PolarHBondContact O-N 3.47Å
493	Y	84.2	Confident	81.4	Confident	115 Å²	115	73.9 Å²	73.9	45%	0.451	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	137	171.8	-64.4	-97.7	0	0	0	110.5	L483 H484 E491 F527	L483-Y493 CarbonylContact O-C 3.54Å; L483-Y493 VanDerWaalsContact O-CA 3.29Å; L483-Y493 WeakPolarHBondContact O-CA 3.28Å; H484-Y493 HydrophobicContact CB-CD1 3.92Å; H484-Y493 HydrophobicContact CB-CE1 3.79Å; H484-Y493 AromaticContact CD2-CD1 3.69Å; H484-Y493 AromaticContact CD2-CD2 3.84Å; H484-Y493 AromaticContact CD2-CE1 3.32Å; H484-Y493 WeakPolarHBondContact CD2-CE1 3.47Å; H484-Y493 AromaticContact CD2-CE2 3.46Å; H484-Y493 VanDerWaalsContact CD2-CE2 3.46Å; H484-Y493 WeakPolarHBondContact CD2-CE2 3.31Å; H484-Y493 AromaticContact CD2-CG 3.93Å; H484-Y493 AromaticContact CD2-CZ 3.18Å; H484-Y493 AromaticContact CE1-CZ 3.62Å; H484-Y493 PolarHBondContact CE1-OH 3.36Å; H484-Y493 AromaticContact CG-CD1 3.93Å; H484-Y493 AromaticContact CG-CE1 3.44Å; H484-Y493 VanDerWaalsContact CG-CE1 3.44Å; H484-Y493 AromaticContact CG-CZ 3.67Å; H484-Y493 AromaticContact ND1-CE1 3.98Å; H484-Y493 AromaticContact ND1-CZ 3.96Å; H484-Y493 AromaticContact NE2-CE1 3.81Å; H484-Y493 AromaticContact NE2-CE2 3.44Å; H484-Y493 WeakPolarHBondContact NE2-CE2 3.17Å; H484-Y493 AromaticContact NE2-CZ 3.18Å; H484-Y493 PolarHBondContact NE2-OH 3.24Å; H484-Y493 VanDerWaalsContact NE2-OH 3.1Å; E491-Y493 HydrophobicContact CG-CE2 4.12Å; E491-Y493 WeakPolarHBondContact OE1-CE2 3.05Å; E491-Y493 PolarHBondContact OE1-OH 3.3Å; Y493-F527 HydrophobicContact CE1-CZ 4.38Å
494	Q	81.1	Confident	81.2	Confident	55 Å²	55	76.1 Å²	76.1	26%	0.257	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	131.8	179.7	-174.6	172.4	4.6	0	0	112	L483 V496	L483-Q494 PolarHBondContact N-O 3.4Å; L483-Q494 PolarHBondContact O-N 3.02Å; Q494-V496 HydrophobicContact CG-CG2 4.35Å
495	M	80.8	Confident	80.9	Confident	104 Å²	104	83.9 Å²	83.9	51%	0.512	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	134.6	177.2	-70.6	-67	-66.9	0	0	111.4	Y481 E482 L519	Y481-M495 WeakPolarHBondContact O-CA 3.39Å; E482-M495 HydrophobicContact CB-SD 3.67Å; E482-M495 HydrophobicContact CG-SD 3.76Å; M495-L519 HydrophobicContact CE-CD1 3.16Å; M495-L519 HydrophobicContact SD-CD1 3.56Å; M495-L519 VanDerWaalsContact SD-CD1 3.56Å
496	V	81.7	Confident	80.8	Confident	18 Å²	18	84 Å²	84	11%	0.109	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	133.5	-177	-162.2	0	0	0	0	110.3	W467 Y481 L483 Q494 E498 R500 V501	W467-V496 HydrophobicContact CH2-CB 4.31Å; W467-V496 HydrophobicContact CH2-CG1 4.38Å; W467-V496 HydrophobicContact CH2-CG2 4.4Å; Y481-V496 PolarHBondContact N-O 2.7Å; Y481-V496 PolarHBondContact O-N 3.24Å; L483-V496 HydrophobicContact CD1-CG2 3.99Å; Q494-V496 HydrophobicContact CG-CG2 4.35Å; V496-E498 WeakPolarHBondContact CG1-O 3.48Å; V496-R500 VanDerWaalsContact CG1-O 3.27Å; V496-R500 WeakPolarHBondContact CG1-O 3.38Å; V496-V501 HydrophobicContact CG1-CB 4.39Å; V496-V501 HydrophobicContact CG2-CB 4.13Å; V496-V501 HydrophobicContact CG2-CG2 3.84Å
497	L	78.4	Confident	80.8	Confident	133 Å²	133	86.5 Å²	86.5	70%	0.696	41%	0.412	S	S	*	.	S	Bend	trans	-88.3	-19.9	-179.9	-64.2	171.1	0	0	0	112.7
498	E	78.2	Confident	80.8	Confident	106 Å²	106	86.9 Å²	86.9	50%	0.495	42%	0.416	S	S	.	.	S	Bend	trans	-111.1	154.6	177.4	-66.3	-167	-172.6	0	0	111.3	W467 V496 R500	W467-E498 WeakPolarHBondContact CZ2-O 3.2Å; V496-E498 WeakPolarHBondContact CG1-O 3.48Å; E498-R500 HydrophobicContact CB-CG 4.04Å; E498-R500 PolarHBondContact O-N 3.1Å; E498-R500 WeakPolarHBondContact OE2-CD 3.48Å; E498-R500 IonicContact OE2-CZ 3.99Å; E498-R500 IonicContact OE2-NE 2.82Å; E498-R500 PolarHBondContact OE2-NE 2.86Å
499	P	82.1	Confident	81.1	Confident	50 Å²	50	81.8 Å²	81.8	33%	0.325	40%	0.395	S	S	.	.	S	Bend	trans	-76	37	175.6	33.6	-36.6	0	0	0	113.1	T466 W467 Y481	T466-P499 VanDerWaalsContact CA-O 3.32Å; T466-P499 WeakPolarHBondContact CA-O 3.23Å; T466-P499 WeakPolarHBondContact CB-O 3.45Å; T466-P499 PolarHBondContact OG1-O 2.69Å; W467-P499 PolarHBondContact N-O 3.38Å; W467-P499 VanDerWaalsContact N-O 3.13Å; W467-P499 WeakPolarHBondContact O-CB 3.45Å; Y481-P499 HydrophobicContact CE2-CB 4.4Å
500	R	82.6	Confident	81.8	Confident	150 Å²	150	76.7 Å²	76.7	57%	0.566	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.9	143.1	178.9	73.1	178.6	83.8	-156.4	-1.6	109.8	L465 V496 E498	L465-R500 CarbonylContact O-C 3.5Å; L465-R500 VanDerWaalsContact O-CA 3.28Å; L465-R500 WeakPolarHBondContact O-CA 3.2Å; V496-R500 VanDerWaalsContact CG1-O 3.27Å; V496-R500 WeakPolarHBondContact CG1-O 3.38Å; E498-R500 HydrophobicContact CB-CG 4.04Å; E498-R500 PolarHBondContact O-N 3.1Å; E498-R500 WeakPolarHBondContact OE2-CD 3.48Å; E498-R500 IonicContact OE2-CZ 3.99Å; E498-R500 IonicContact OE2-NE 2.82Å; E498-R500 PolarHBondContact OE2-NE 2.86Å
501	V	87.8	Confident	82.7	Confident	12 Å²	12	75 Å²	75	7%	0.073	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	146	174.8	75.1	0	0	0	0	111.2	E464 L465 W467 L483 V496 L503	E464-V501 CarbonylContact C-O 3.58Å; E464-V501 WeakPolarHBondContact CA-O 3.49Å; L465-V501 HydrophobicContact CB-CG1 4.14Å; L465-V501 PolarHBondContact N-O 3.29Å; L465-V501 PolarHBondContact O-N 3.24Å; W467-V501 HydrophobicContact CH2-CB 4.3Å; W467-V501 HydrophobicContact CH2-CG1 4.39Å; W467-V501 HydrophobicContact CZ3-CB 4.34Å; W467-V501 HydrophobicContact CZ3-CG1 4.02Å; L483-V501 HydrophobicContact CD2-CG1 3.57Å; V496-V501 HydrophobicContact CG1-CB 4.39Å; V496-V501 HydrophobicContact CG2-CB 4.13Å; V496-V501 HydrophobicContact CG2-CG2 3.84Å; V501-L503 HydrophobicContact CG1-CD2 4.28Å; V501-L503 HydrophobicContact CG1-CG 4.24Å; V501-L503 HydrophobicContact CG2-CD2 4.41Å
502	L	87.6	Confident	82.9	Confident	86 Å²	86	69.4 Å²	69.4	45%	0.45	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	109	166.6	-178.6	68	0	0	0	108.4	Q462 E464 T504	Q462-L502 HydrophobicContact CB-CD1 4.24Å; E464-L502 HydrophobicContact CB-CD1 3.91Å; E464-L502 HydrophobicContact CG-CD1 4.33Å; L502-T504 HydrophobicContact CD2-CG2 3.97Å; L502-T504 HydrophobicContact CG-CG2 3.89Å
503	L	85.4	Confident	83.4	Confident	5 Å²	5	67.2 Å²	67.2	3%	0.026	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	121.1	171.8	-61.3	176.7	0	0	0	108.3	Q462 L463 L465 V485 V501 L506 V514	Q462-L503 CarbonylContact C-O 3.51Å; Q462-L503 WeakPolarHBondContact CA-O 3.4Å; Q462-L503 WeakPolarHBondContact CB-O 3.45Å; L463-L503 HydrophobicContact CB-CB 4.48Å; L463-L503 PolarHBondContact N-O 3.32Å; L463-L503 PolarHBondContact O-N 3.03Å; L465-L503 HydrophobicContact CD1-CD1 3.81Å; V485-L503 HydrophobicContact CG1-CD1 4.44Å; V485-L503 HydrophobicContact CG2-CD1 3.87Å; V485-L503 HydrophobicContact CG2-CD2 4.04Å; V501-L503 HydrophobicContact CG1-CD2 4.28Å; V501-L503 HydrophobicContact CG1-CG 4.24Å; V501-L503 HydrophobicContact CG2-CD2 4.41Å; L503-L506 HydrophobicContact CB-CD1 3.95Å; L503-L506 HydrophobicContact CB-CG 4.42Å; L503-V514 HydrophobicContact CD1-CG2 4.35Å
504	T	82.6	Confident	83.6	Confident	48 Å²	48	61.8 Å²	61.8	29%	0.294	31%	0.312	S	S	.	.			trans	-115.4	167.4	179.8	59.1	0	0	0	0	111.3	R461 Q462 L502 L506	R461-T504 CarbonylContact O-C 3.59Å; Q462-T504 HydrophobicContact CG-CG2 4.05Å; L502-T504 HydrophobicContact CD2-CG2 3.97Å; L502-T504 HydrophobicContact CG-CG2 3.89Å; T504-L506 VanDerWaalsContact C-N 3.25Å; T504-L506 PolarHBondContact O-N 2.88Å
505	E	81.1	Confident	83.9	Confident	164 Å²	164	62.3 Å²	62.3	77%	0.766	31%	0.312	S	S	*	.	S	Bend	trans	67.6	19.1	179.2	-51.5	-178.3	162.8	0	0	114.9	R461	R461-E505 PolarHBondContact O-N 3.42Å; R461-E505 VanDerWaalsContact O-N 3.08Å
506	L	83.9	Confident	84.2	Confident	11 Å²	11	57.3 Å²	57.3	6%	0.058	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-72	152.1	177.3	-57	176.7	0	0	0	111.2	R461 L463 L503 T504 Y512 T535	R461-L506 VanDerWaalsContact CA-O 3.28Å; R461-L506 WeakPolarHBondContact CA-O 3.37Å; R461-L506 WeakPolarHBondContact CB-O 3.3Å; R461-L506 VanDerWaalsContact CG-O 3.32Å; R461-L506 WeakPolarHBondContact CG-O 3.49Å; R461-L506 PolarHBondContact O-N 3.16Å; L463-L506 HydrophobicContact CB-CD1 3.91Å; L463-L506 HydrophobicContact CD1-CD1 3.69Å; L463-L506 HydrophobicContact CG-CD1 3.6Å; L503-L506 HydrophobicContact CB-CD1 3.95Å; L503-L506 HydrophobicContact CB-CG 4.42Å; T504-L506 VanDerWaalsContact C-N 3.25Å; T504-L506 PolarHBondContact O-N 2.88Å; L506-Y512 HydrophobicContact CB-CE2 3.88Å; L506-Y512 HydrophobicContact CD1-CD2 4.49Å; L506-Y512 HydrophobicContact CD1-CE2 4.43Å; L506-Y512 HydrophobicContact CD2-CD1 4.22Å; L506-Y512 HydrophobicContact CD2-CD2 4.41Å; L506-Y512 HydrophobicContact CD2-CE1 3.78Å; L506-Y512 HydrophobicContact CD2-CE2 3.99Å; L506-Y512 HydrophobicContact CG-CE2 4.32Å; L506-T535 HydrophobicContact CB-CG2 3.76Å; L506-T535 HydrophobicContact CD1-CG2 3.89Å
507	Q	81.6	Confident	84.2	Confident	95 Å²	95	59.2 Å²	59.2	44%	0.444	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-70.5	138.2	173.5	-65.8	-172.1	21.5	0	0	110.2	T510 Y512 T535	Q507-T510 HydrophobicContact CB-CG2 4.33Å; Q507-T510 WeakPolarHBondContact CB-OG1 3.49Å; Q507-T510 WeakPolarHBondContact O-CB 3.37Å; Q507-Y512 PolarHBondContact N-OH 2.87Å; Q507-T535 WeakPolarHBondContact O-CB 3.32Å; Q507-T535 PolarHBondContact O-OG1 3.29Å
508	P	81.1	Confident	84.1	Confident	40 Å²	40	54 Å²	54	26%	0.26	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	148.7	175.8	26.8	-31.5	0	0	0	112.4	P460 T510 P538	P460-P508 HydrophobicContact CB-CB 4.27Å; P460-P508 WeakPolarHBondContact O-CA 3.42Å; P460-P508 VanDerWaalsContact O-CB 3.26Å; P460-P508 WeakPolarHBondContact O-CB 3.47Å; P508-T510 PolarHBondContact O-N 2.87Å; P508-T510 PolarHBondContact O-OG1 3.43Å; P508-P538 HydrophobicContact CB-CG 4.38Å; P508-P538 HydrophobicContact CG-CG 4.44Å
509	D	81.3	Confident	83.7	Confident	78 Å²	78	50.7 Å²	50.7	42%	0.417	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	33.9	-176.1	-162.5	32.7	0	0	0	116.1	R534 T535 S536	D509-R534 PolarHBondContact O-NE 3.21Å; D509-R534 IonicContact OD1-CZ 3.94Å; D509-R534 IonicContact OD1-NE 3.92Å; D509-R534 PolarHBondContact OD1-NE 3.29Å; D509-R534 IonicContact OD1-NH2 3.64Å; D509-R534 PolarHBondContact OD1-NH2 3.24Å; D509-R534 IonicContact OD2-CZ 3.81Å; D509-R534 IonicContact OD2-NH2 2.76Å; D509-R534 PolarHBondContact OD2-NH2 2.99Å; D509-T535 PolarHBondContact N-OG1 2.86Å; D509-S536 PolarHBondContact N-O 3.16Å
510	T	84.4	Confident	82.9	Confident	27 Å²	27	50.9 Å²	50.9	17%	0.166	25%	0.251	C	S	.	.			trans	-119.5	142.3	-173.9	-55.2	0	0	0	0	111.9	N487 Q507 P508 Y512 R534 T535	N487-T510 WeakPolarHBondContact ND2-CG2 3.14Å; Q507-T510 HydrophobicContact CB-CG2 4.33Å; Q507-T510 WeakPolarHBondContact CB-OG1 3.49Å; Q507-T510 WeakPolarHBondContact O-CB 3.37Å; P508-T510 PolarHBondContact O-N 2.87Å; P508-T510 PolarHBondContact O-OG1 3.43Å; T510-Y512 HydrophobicContact CG2-CE2 3.98Å; T510-R534 CarbonylContact O-C 3.57Å; T510-R534 VanDerWaalsContact O-CA 3.28Å; T510-R534 WeakPolarHBondContact O-CA 3.44Å; T510-T535 PolarHBondContact N-OG1 2.68Å; T510-T535 PolarHBondContact O-N 2.9Å; T510-T535 PolarHBondContact O-OG1 3.21Å
511	T	87.6	Confident	81.6	Confident	58 Å²	58	50.2 Å²	50.2	36%	0.356	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	132.2	-179.3	-57.1	0	0	0	0	111.5	N487 E532 F533	N487-T511 PolarHBondContact OD1-O 2.97Å; N487-T511 VanDerWaalsContact OD1-O 3.11Å; T511-E532 HydrophobicContact CG2-CB 4.29Å; T511-E532 HydrophobicContact CG2-CG 4.48Å; T511-F533 CarbonylContact C-O 3.56Å; T511-F533 WeakPolarHBondContact CA-O 3.49Å
512	Y	88.1	Confident	80.1	Confident	4 Å²	4	57.7 Å²	57.7	2%	0.016	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	138.6	177.6	-70	-93.5	0	0	0	110.5	V485 L486 N487 L506 Q507 T510 E532 F533 T535	V485-Y512 HydrophobicContact CG1-CD1 3.81Å; V485-Y512 HydrophobicContact CG1-CG 4.44Å; L486-Y512 CarbonylContact O-C 3.46Å; L486-Y512 WeakPolarHBondContact O-CA 3.47Å; N487-Y512 HydrophobicContact CB-CD1 3.63Å; N487-Y512 HydrophobicContact CB-CE1 3.59Å; N487-Y512 HydrophobicContact CB-CG 4.41Å; L506-Y512 HydrophobicContact CB-CE2 3.88Å; L506-Y512 HydrophobicContact CD1-CD2 4.49Å; L506-Y512 HydrophobicContact CD1-CE2 4.43Å; L506-Y512 HydrophobicContact CD2-CD1 4.22Å; L506-Y512 HydrophobicContact CD2-CD2 4.41Å; L506-Y512 HydrophobicContact CD2-CE1 3.78Å; L506-Y512 HydrophobicContact CD2-CE2 3.99Å; L506-Y512 HydrophobicContact CG-CE2 4.32Å; Q507-Y512 PolarHBondContact N-OH 2.87Å; T510-Y512 HydrophobicContact CG2-CE2 3.98Å; Y512-E532 CarbonylContact O-C 3.6Å; Y512-E532 WeakPolarHBondContact O-CA 3.5Å; Y512-F533 PolarHBondContact N-O 3.44Å; Y512-F533 PolarHBondContact O-N 3.28Å; Y512-T535 HydrophobicContact CE2-CG2 4.35Å
513	I	89.6	Confident	78.6	Confident	53 Å²	53	55 Å²	55	27%	0.272	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	129.6	170.5	-63.2	169.1	0	0	0	108.6	V485 L486 D530 H531 E532	V485-I513 CarbonylContact C-O 3.56Å; V485-I513 WeakPolarHBondContact CA-O 3.43Å; L486-I513 HydrophobicContact CB-CB 4.38Å; L486-I513 HydrophobicContact CD1-CB 4.47Å; L486-I513 HydrophobicContact CD1-CG2 4.3Å; L486-I513 PolarHBondContact N-O 3.33Å; L486-I513 PolarHBondContact O-N 2.81Å; I513-D530 HydrophobicContact CG2-CB 3.7Å; I513-H531 CarbonylContact C-O 3.56Å; I513-H531 WeakPolarHBondContact CA-O 3.42Å; I513-E532 HydrophobicContact CG1-CG 3.75Å
514	V	88.9	Confident	77.8	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	129.7	-179.3	-170.6	0	0	0	0	110.9	L453 L465 L483 H484 V485 L503 H531 F533	L453-V514 HydrophobicContact CD2-CB 4.03Å; L453-V514 HydrophobicContact CD2-CG1 3.61Å; L465-V514 HydrophobicContact CD1-CB 4.18Å; L465-V514 HydrophobicContact CD1-CG1 3.9Å; L465-V514 HydrophobicContact CD1-CG2 3.97Å; L483-V514 HydrophobicContact CD2-CG1 3.88Å; L483-V514 HydrophobicContact CG-CG1 4.43Å; H484-V514 WeakPolarHBondContact O-CA 3.37Å; V485-V514 HydrophobicContact CG1-CG2 4.2Å; V485-V514 HydrophobicContact CG2-CG1 4.1Å; V485-V514 HydrophobicContact CG2-CG2 4.13Å; L503-V514 HydrophobicContact CD1-CG2 4.35Å; V514-H531 PolarHBondContact N-O 3.42Å; V514-H531 PolarHBondContact O-N 3.27Å; V514-F533 HydrophobicContact CB-CD2 4.27Å; V514-F533 HydrophobicContact CB-CE2 4.19Å; V514-F533 HydrophobicContact CG2-CD2 3.95Å; V514-F533 HydrophobicContact CG2-CE2 4.36Å
515	R	88.3	Confident	77.1	Confident	66 Å²	66	57.4 Å²	57.4	25%	0.249	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	146.8	172.2	64.1	-175.5	-170.6	-158.8	-4.5	111.2	L483 H484 F527 S528 D530	L483-R515 WeakPolarHBondContact CA-O 3.44Å; H484-R515 HydrophobicContact CB-CG 3.77Å; H484-R515 PolarHBondContact CE1-NH2 3.41Å; H484-R515 VanDerWaalsContact CE1-NH2 3.28Å; H484-R515 PolarHBondContact N-O 3.33Å; H484-R515 PolarHBondContact ND1-NE 3.03Å; H484-R515 PolarHBondContact ND1-NH2 3Å; H484-R515 PolarHBondContact O-N 3.03Å; R515-F527 HydrophobicContact CB-CB 4.49Å; R515-F527 HydrophobicContact CB-CD1 4.31Å; R515-F527 HydrophobicContact CG-CB 4.39Å; R515-F527 HydrophobicContact CG-CD1 3.73Å; R515-F527 HydrophobicContact CG-CE1 4.26Å; R515-F527 HydrophobicContact CG-CG 4.18Å; R515-S528 WeakPolarHBondContact CA-OG 3.33Å; R515-D530 WeakPolarHBondContact CD-OD1 3.45Å
516	V	86.2	Confident	76.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	140.5	-177.9	72.3	0	0	0	0	111.7	L451 L453 W467 Y481 E482 L483 F527 S528	L451-V516 HydrophobicContact CB-CG1 4.03Å; L451-V516 HydrophobicContact CD1-CG1 4.27Å; L453-V516 HydrophobicContact CD1-CB 4.02Å; L453-V516 HydrophobicContact CD1-CG1 3.31Å; L453-V516 HydrophobicContact CG-CG1 4.18Å; W467-V516 HydrophobicContact CB-CG1 4.5Å; W467-V516 HydrophobicContact CD2-CG1 4.33Å; W467-V516 HydrophobicContact CD2-CG2 4.21Å; W467-V516 HydrophobicContact CG-CG1 4.11Å; W467-V516 HydrophobicContact CZ2-CG2 4.14Å; Y481-V516 HydrophobicContact CD1-CG2 4.36Å; E482-V516 WeakPolarHBondContact O-CA 3.32Å; L483-V516 HydrophobicContact CD1-CB 4.13Å; L483-V516 HydrophobicContact CD1-CG2 3.44Å; L483-V516 VanDerWaalsContact CD1-CG2 3.44Å; L483-V516 HydrophobicContact CG-CB 4.18Å; L483-V516 HydrophobicContact CG-CG2 4.03Å; V516-F527 CarbonylContact O-C 3.57Å; V516-S528 PolarHBondContact N-OG 3.28Å; V516-S528 WeakPolarHBondContact O-CB 3.42Å; V516-S528 PolarHBondContact O-N 3.5Å; V516-S528 PolarHBondContact O-OG 3.5Å
517	R	81.9	Confident	76.3	Confident	57 Å²	57	55.8 Å²	55.8	22%	0.215	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	153.2	167.1	64.2	179.9	174.4	180	0.3	111.5	Y481 E482 L519 G525 P526 F527	Y481-R517 WeakPolarHBondContact CA-O 3.31Å; E482-R517 HydrophobicContact CB-CG 4.04Å; E482-R517 PolarHBondContact N-O 3.24Å; E482-R517 PolarHBondContact O-N 3.1Å; E482-R517 IonicContact OE1-NH2 3.8Å; E482-R517 PolarHBondContact OE1-NH2 3.03Å; E482-R517 IonicContact OE2-CZ 3.94Å; E482-R517 IonicContact OE2-NE 3.07Å; E482-R517 PolarHBondContact OE2-NE 3.11Å; E482-R517 IonicContact OE2-NH2 2.75Å; E482-R517 PolarHBondContact OE2-NH2 2.86Å; R517-L519 HydrophobicContact CG-CD2 4.47Å; R517-G525 WeakPolarHBondContact CB-O 3.34Å; R517-G525 VanDerWaalsContact CD-O 3.29Å; R517-G525 WeakPolarHBondContact CD-O 3.34Å; R517-P526 WeakPolarHBondContact CB-O 3.16Å; R517-F527 HydrophobicContact CB-CD1 3.77Å; R517-F527 HydrophobicContact CB-CE1 4.08Å; R517-F527 HydrophobicContact CB-CG 4.12Å; R517-F527 HydrophobicContact CG-CD1 3.85Å; R517-F527 HydrophobicContact CG-CE1 3.6Å; R517-F527 HydrophobicContact CG-CE2 4.47Å; R517-F527 HydrophobicContact CG-CG 4.39Å; R517-F527 HydrophobicContact CG-CZ 3.94Å
518	M	75.2	Confident	76.3	Confident	25 Å²	25	51.9 Å²	51.9	12%	0.123	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	134.7	172.4	-176.8	-177.3	-64.9	0	0	109.6	L451 L479 Y481 T520 G525	L451-M518 HydrophobicContact CD1-CB 4Å; L451-M518 HydrophobicContact CD2-CE 4.37Å; L479-M518 HydrophobicContact CD2-CG 4.28Å; L479-M518 HydrophobicContact CD2-SD 3.79Å; Y481-M518 HydrophobicContact CD1-CB 4.3Å; Y481-M518 HydrophobicContact CE1-CB 4.28Å; Y481-M518 HydrophobicContact CE1-CE 3.81Å; Y481-M518 HydrophobicContact CE1-CG 4.26Å; M518-T520 HydrophobicContact CG-CG2 4.35Å; M518-T520 HydrophobicContact SD-CG2 4.41Å; M518-G525 PolarHBondContact O-N 3.46Å
519	L	70.8	Confident	76.2	Confident	35 Å²	35	54.3 Å²	54.3	18%	0.183	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	125.9	172.7	-58.5	179.4	0	0	0	108.8	S480 E482 M495 R517 P524	S480-L519 PolarHBondContact O-N 3.33Å; E482-L519 HydrophobicContact CB-CD1 4.27Å; E482-L519 HydrophobicContact CB-CG 4.39Å; M495-L519 HydrophobicContact CE-CD1 3.16Å; M495-L519 HydrophobicContact SD-CD1 3.56Å; M495-L519 VanDerWaalsContact SD-CD1 3.56Å; R517-L519 HydrophobicContact CG-CD2 4.47Å; L519-P524 HydrophobicContact CD2-CB 3.47Å; L519-P524 VanDerWaalsContact CD2-CB 3.47Å
520	T	65.4	Low	76.2	Confident	55 Å²	55	55.3 Å²	55.3	34%	0.337	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	162.8	178.1	70.5	0	0	0	0	110.1	M518 L522 G523	M518-T520 HydrophobicContact CG-CG2 4.35Å; M518-T520 HydrophobicContact SD-CG2 4.41Å; T520-L522 PolarHBondContact O-N 3.24Å; T520-L522 PolarHBondContact OG1-N 3.11Å; T520-G523 PolarHBondContact N-O 3.21Å; T520-G523 VanDerWaalsContact N-O 3.08Å; T520-G523 PolarHBondContact O-N 3.17Å; T520-G523 PolarHBondContact OG1-O 2.73Å
521	P	55.8	Low	76.3	Confident	136 Å²	136	56.2 Å²	56.2	88%	0.883	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-15.4	173.8	-23.9	34.2	0	0	0	114.4
522	L	55.4	Low	76.3	Confident	169 Å²	169	60.3 Å²	60.3	89%	0.885	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-1.2	178.4	-65	168.6	0	0	0	113.2	T520	T520-L522 PolarHBondContact O-N 3.24Å; T520-L522 PolarHBondContact OG1-N 3.11Å
523	G	57.2	Low	76.2	Confident	29 Å²	29	61.2 Å²	61.2	30%	0.299	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	126.5	174.9	-179.8	0	0	0	0	0	114.1	T520	T520-G523 PolarHBondContact N-O 3.21Å; T520-G523 VanDerWaalsContact N-O 3.08Å; T520-G523 PolarHBondContact O-N 3.17Å; T520-G523 PolarHBondContact OG1-O 2.73Å
524	P	66.5	Low	76	Confident	80 Å²	80	64.4 Å²	64.4	52%	0.519	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	128.3	176.9	25.9	-31.2	0	0	0	111.6	L519	L519-P524 HydrophobicContact CD2-CB 3.47Å; L519-P524 VanDerWaalsContact CD2-CB 3.47Å
525	G	68.3	Low	75.8	Confident	24 Å²	24	64.4 Å²	64.4	25%	0.247	35%	0.351	C	S	.	.			trans	-73.1	174.8	169.3	0	0	0	0	0	112.9	R517 M518	R517-G525 WeakPolarHBondContact CB-O 3.34Å; R517-G525 VanDerWaalsContact CD-O 3.29Å; R517-G525 WeakPolarHBondContact CD-O 3.34Å; M518-G525 PolarHBondContact O-N 3.46Å
526	P	71.8	Confident	75.4	Confident	78 Å²	78	62.5 Å²	62.5	51%	0.506	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-66.7	151.8	176.7	28.2	-34	0	0	0	112.1	R517	R517-P526 WeakPolarHBondContact CB-O 3.16Å
527	F	77.9	Confident	74.9	Confident	63 Å²	63	66.5 Å²	66.5	28%	0.276	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-69.9	149.6	172.3	-77.1	-76.6	0	0	0	111.9	E482 H484 Y493 R515 V516 R517	E482-F527 WeakPolarHBondContact OE2-CZ 3.41Å; H484-F527 HydrophobicContact CB-CE1 4Å; H484-F527 HydrophobicContact CB-CZ 4.41Å; Y493-F527 HydrophobicContact CE1-CZ 4.38Å; R515-F527 HydrophobicContact CB-CB 4.49Å; R515-F527 HydrophobicContact CB-CD1 4.31Å; R515-F527 HydrophobicContact CG-CB 4.39Å; R515-F527 HydrophobicContact CG-CD1 3.73Å; R515-F527 HydrophobicContact CG-CE1 4.26Å; R515-F527 HydrophobicContact CG-CG 4.18Å; V516-F527 CarbonylContact O-C 3.57Å; R517-F527 HydrophobicContact CB-CD1 3.77Å; R517-F527 HydrophobicContact CB-CE1 4.08Å; R517-F527 HydrophobicContact CB-CG 4.12Å; R517-F527 HydrophobicContact CG-CD1 3.85Å; R517-F527 HydrophobicContact CG-CE1 3.6Å; R517-F527 HydrophobicContact CG-CE2 4.47Å; R517-F527 HydrophobicContact CG-CG 4.39Å; R517-F527 HydrophobicContact CG-CZ 3.94Å
528	S	80.3	Confident	74.1	Confident	12 Å²	12	68.3 Å²	68.3	8%	0.084	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-62	164.6	165.7	71.4	0	0	0	0	110.9	L451 L453 R515 V516	L451-S528 WeakPolarHBondContact O-CB 3.49Å; L453-S528 VanDerWaalsContact CD1-OG 3.32Å; L453-S528 WeakPolarHBondContact CD1-OG 3.39Å; R515-S528 WeakPolarHBondContact CA-OG 3.33Å; V516-S528 PolarHBondContact N-OG 3.28Å; V516-S528 WeakPolarHBondContact O-CB 3.42Å; V516-S528 PolarHBondContact O-N 3.5Å; V516-S528 PolarHBondContact O-OG 3.5Å
529	P	79.2	Confident	73.3	Confident	92 Å²	92	73.7 Å²	73.7	60%	0.597	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-54.7	155.7	164.4	-21.6	33.4	0	0	0	111.7	H531	P529-H531 PolarHBondContact O-CD2 2.65Å
530	D	82.4	Confident	72.2	Confident	99 Å²	99	77.2 Å²	77.2	53%	0.529	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-70.8	130.9	177.5	-68.7	-16.3	0	0	0	110.4	I513 R515	I513-D530 HydrophobicContact CG2-CB 3.7Å; R515-D530 WeakPolarHBondContact CD-OD1 3.45Å
531	H	85.4	Confident	71	Confident	46 Å²	46	86.8 Å²	86.8	21%	0.213	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	126.3	178.2	-69.6	-83.9	0	0	0	111.8	L453 I513 V514 P529 F533	L453-H531 HydrophobicContact CB-CB 4.49Å; I513-H531 CarbonylContact C-O 3.56Å; I513-H531 WeakPolarHBondContact CA-O 3.42Å; V514-H531 PolarHBondContact N-O 3.42Å; V514-H531 PolarHBondContact O-N 3.27Å; P529-H531 PolarHBondContact O-CD2 2.65Å; H531-F533 HydrophobicContact CB-CE2 3.75Å; H531-F533 HydrophobicContact CB-CZ 3.88Å
532	E	87	Confident	70.1	Confident	143 Å²	143	84.2 Å²	84.2	67%	0.668	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	130.3	-178.6	-74.7	176.1	-160.1	0	0	113	T511 Y512 I513	T511-E532 HydrophobicContact CG2-CB 4.29Å; T511-E532 HydrophobicContact CG2-CG 4.48Å; Y512-E532 CarbonylContact O-C 3.6Å; Y512-E532 WeakPolarHBondContact O-CA 3.5Å; I513-E532 HydrophobicContact CG1-CG 3.75Å
533	F	87.4	Confident	69.1	Low	23 Å²	23	85.1 Å²	85.1	10%	0.101	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	132.6	177.3	-56.7	-69.2	0	0	0	111.4	L453 L455 L463 L465 T511 Y512 V514 H531	L453-F533 HydrophobicContact CB-CZ 4.38Å; L453-F533 HydrophobicContact CD2-CE2 4.48Å; L455-F533 HydrophobicContact CB-CD1 3.88Å; L455-F533 HydrophobicContact CB-CE1 3.68Å; L455-F533 HydrophobicContact CD1-CD1 4.23Å; L455-F533 HydrophobicContact CD2-CD1 4.17Å; L455-F533 HydrophobicContact CG-CD1 4.33Å; L463-F533 HydrophobicContact CD1-CB 3.68Å; L465-F533 HydrophobicContact CD1-CD2 4.09Å; L465-F533 HydrophobicContact CD1-CE2 3.95Å; L465-F533 HydrophobicContact CD2-CD1 4.18Å; L465-F533 HydrophobicContact CD2-CD2 3.75Å; L465-F533 HydrophobicContact CD2-CE1 4.01Å; L465-F533 HydrophobicContact CD2-CE2 3.55Å; L465-F533 HydrophobicContact CD2-CG 4.06Å; L465-F533 HydrophobicContact CD2-CZ 3.69Å; L465-F533 HydrophobicContact CG-CE2 4.42Å; T511-F533 CarbonylContact C-O 3.56Å; T511-F533 WeakPolarHBondContact CA-O 3.49Å; Y512-F533 PolarHBondContact N-O 3.44Å; Y512-F533 PolarHBondContact O-N 3.28Å; V514-F533 HydrophobicContact CB-CD2 4.27Å; V514-F533 HydrophobicContact CB-CE2 4.19Å; V514-F533 HydrophobicContact CG2-CD2 3.95Å; V514-F533 HydrophobicContact CG2-CE2 4.36Å; H531-F533 HydrophobicContact CB-CE2 3.75Å; H531-F533 HydrophobicContact CB-CZ 3.88Å
534	R	84.8	Confident	68.1	Low	121 Å²	121	89.4 Å²	89.4	46%	0.457	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	134.7	177.7	-173.4	172.8	175.3	166	2.7	111.5	K458 D509 T510	K458-R534 WeakPolarHBondContact CD-O 3.2Å; K458-R534 WeakPolarHBondContact CE-O 3.29Å; K458-R534 PolarHBondContact NZ-O 2.77Å; D509-R534 PolarHBondContact O-NE 3.21Å; D509-R534 IonicContact OD1-CZ 3.94Å; D509-R534 IonicContact OD1-NE 3.92Å; D509-R534 PolarHBondContact OD1-NE 3.29Å; D509-R534 IonicContact OD1-NH2 3.64Å; D509-R534 PolarHBondContact OD1-NH2 3.24Å; D509-R534 IonicContact OD2-CZ 3.81Å; D509-R534 IonicContact OD2-NH2 2.76Å; D509-R534 PolarHBondContact OD2-NH2 2.99Å; T510-R534 CarbonylContact O-C 3.57Å; T510-R534 VanDerWaalsContact O-CA 3.28Å; T510-R534 WeakPolarHBondContact O-CA 3.44Å
535	T	85.3	Confident	66.9	Low	0 Å²	0	89.2 Å²	89.2	0%	0	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-72.4	168.3	175	52.3	0	0	0	0	112.4	K458 L463 L506 Q507 D509 T510 Y512	K458-T535 VanDerWaalsContact CE-C 3.43Å; K458-T535 VanDerWaalsContact CE-O 3.31Å; K458-T535 WeakPolarHBondContact CE-O 3.09Å; K458-T535 PolarHBondContact NZ-O 3.3Å; L463-T535 HydrophobicContact CD1-CG2 4.21Å; L463-T535 HydrophobicContact CD2-CG2 4.27Å; L463-T535 HydrophobicContact CG-CG2 3.99Å; L506-T535 HydrophobicContact CB-CG2 3.76Å; L506-T535 HydrophobicContact CD1-CG2 3.89Å; Q507-T535 WeakPolarHBondContact O-CB 3.32Å; Q507-T535 PolarHBondContact O-OG1 3.29Å; D509-T535 PolarHBondContact N-OG1 2.86Å; T510-T535 PolarHBondContact N-OG1 2.68Å; T510-T535 PolarHBondContact O-N 2.9Å; T510-T535 PolarHBondContact O-OG1 3.21Å; Y512-T535 HydrophobicContact CE2-CG2 4.35Å
536	S	79.1	Confident	65.7	Low	26 Å²	26	91.9 Å²	91.9	18%	0.182	55%	0.553	C	S	.	*	P	Polyproline II helix	trans	-92.8	163.4	179	50.5	0	0	0	0	113.1	E459 P460 D509	E459-S536 VanDerWaalsContact CA-OG 3.29Å; E459-S536 WeakPolarHBondContact CA-OG 3.22Å; E459-S536 PolarHBondContact O-N 3.47Å; E459-S536 PolarHBondContact O-OG 2.73Å; P460-S536 WeakPolarHBondContact CA-O 3.29Å; P460-S536 WeakPolarHBondContact CA-OG 3.1Å; P460-S536 WeakPolarHBondContact CB-O 2.86Å; P460-S536 VanDerWaalsContact CD-OG 3.25Å; P460-S536 WeakPolarHBondContact CD-OG 3.48Å; P460-S536 WeakPolarHBondContact CG-OG 3.42Å; D509-S536 PolarHBondContact N-O 3.16Å
537	P	74.9	Confident	64.5	Low	84 Å²	84	97.3 Å²	97.3	55%	0.545	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-75.7	152.8	178.7	27	-33.5	0	0	0	113.1	P460	P460-P537 WeakPolarHBondContact CG-O 3.32Å
538	P	66.6	Low	63	Low	94 Å²	94	102 Å²	102	61%	0.61	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-77.3	132.9	-171.9	30	-30.3	0	0	0	112.6	P508	P508-P538 HydrophobicContact CB-CG 4.38Å; P508-P538 HydrophobicContact CG-CG 4.44Å
539	V	58.1	Low	61.6	Low	139 Å²	139	107.6 Å²	107.6	84%	0.842	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-96.5	125.3	172.2	178.8	0	0	0	0	109
540	S	48.4	Very low	60.2	Low	109 Å²	109	108 Å²	108	76%	0.762	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-91.7	126.1	-177.2	31	0	0	0	0	112.3
541	R	39.2	Very low	58.7	Low	255 Å²	255	108.8 Å²	108.8	96%	0.962	65%	0.65	S	S	*	*			trans	-168	119.2	154	-109.1	164.4	-175.5	175.2	2.1	113.8
542	G	37.9	Very low	57.1	Low	83 Å²	83	113.2 Å²	113.2	86%	0.856	67%	0.674	S	S	*	*			trans	48.5	111.6	138.6	0	0	0	0	0	121.4
543	L	33.6	Very low	55.3	Low	187 Å²	187	114.6 Å²	114.6	98%	0.979	68%	0.678	S	S	*	*			trans	-80.1	143.7	163.8	-87.3	101.7	0	0	0	112.5
544	S	36.4	Very low	53.6	Low	119 Å²	119	116.4 Å²	116.4	83%	0.832	70%	0.703	S	S	*	*			trans	-130.4	125.5	168.3	175.8	0	0	0	0	110.2
545	G	40.8	Very low	52.1	Low	76 Å²	76	117.2 Å²	117.2	78%	0.784	72%	0.716	S	S	*	*			trans	56.8	79.4	135	0	0	0	0	0	119.8
546	G	42.3	Very low	50.6	Low	80 Å²	80	123.9 Å²	123.9	83%	0.825	75%	0.751	S	S	*	*			trans	-121.1	31.3	166.5	0	0	0	0	0	113.8
547	E	47.7	Very low	49.4	Very low	192 Å²	192	129.1 Å²	129.1	90%	0.897	78%	0.776	S	S	*	*			trans	-101.1	42.4	-175.8	-73	-169	132.2	0	0	114.4
548	I	46.5	Very low	48.4	Very low	162 Å²	162	127.1 Å²	127.1	83%	0.831	77%	0.771	S	S	*	*			trans	-137.3	55.1	175.7	-43.8	177.8	0	0	0	113
549	V	50.9	Low	47.9	Very low	130 Å²	130	125.5 Å²	125.5	79%	0.788	77%	0.766	S	S	*	*	S	Bend	trans	-132.8	-10.7	165.4	-171.7	0	0	0	0	114.2	V551	V549-V551 PolarHBondContact O-N 3.45Å
550	A	49.8	Very low	47.9	Very low	100 Å²	100	122.3 Å²	122.3	83%	0.826	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-7.4	-174.9	0	0	0	0	0	116.2
551	V	50.8	Low	48.5	Very low	115 Å²	115	123.2 Å²	123.2	70%	0.697	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-16.7	-169.8	179.2	0	0	0	0	114.1	V549	V549-V551 PolarHBondContact O-N 3.45Å
552	I	51.9	Low	49.4	Very low	139 Å²	139	116.7 Å²	116.7	71%	0.713	73%	0.733	S	S	*	*	S	Bend	trans	-84.2	-25.4	-170.6	-59.9	179.6	0	0	0	113.2
553	F	48.8	Very low	50.6	Low	173 Å²	173	118.4 Å²	118.4	76%	0.759	72%	0.722	S	S	*	*	S	Bend	trans	-84.4	-16.1	-175.5	-122	-95.1	0	0	0	114.9
554	G	51.3	Low	52	Low	60 Å²	60	111.7 Å²	111.7	62%	0.619	70%	0.698	S	S	*	*	S	Bend	trans	-78	-21.2	-178.3	0	0	0	0	0	115
555	L	53.8	Low	53.4	Low	139 Å²	139	110.1 Å²	110.1	73%	0.728	68%	0.679	S	S	*	*	H	α-helix	trans	-83.1	-17.5	-173.7	-78.9	163.5	0	0	0	114.1
556	L	53.9	Low	54.5	Low	139 Å²	139	112 Å²	112	73%	0.728	67%	0.67	S	S	*	*	H	α-helix	trans	-88.2	-23.3	-176.9	-72	170.1	0	0	0	114.1
557	L	53.8	Low	55.6	Low	136 Å²	136	111.2 Å²	111.2	71%	0.712	65%	0.65	S	S	*	*	H	α-helix	trans	-83	-24.7	178.7	-85.8	156.5	0	0	0	113.5
558	G	53	Low	56.3	Low	42 Å²	42	108.4 Å²	108.4	43%	0.433	64%	0.635	S	S	.	*	H	α-helix	trans	-72.4	-30.9	179.6	0	0	0	0	0	114.4
559	A	57.5	Low	56.9	Low	61 Å²	61	109.2 Å²	109.2	50%	0.504	63%	0.627	S	S	.	*	H	α-helix	trans	-74.3	-32.1	-177.8	0	0	0	0	0	113
560	A	58.1	Low	57.3	Low	71 Å²	71	105.6 Å²	105.6	59%	0.587	61%	0.607	S	S	*	*	H	α-helix	trans	-72.8	-33.6	-179.8	0	0	0	0	0	112.7	G564	A560-G564 PolarHBondContact O-N 3.29Å
561	L	60.1	Low	57.6	Low	128 Å²	128	108.9 Å²	108.9	67%	0.67	60%	0.598	S	S	*	*	H	α-helix	trans	-71.6	-34.2	-179.3	-150.3	85.7	0	0	0	112.3	I565	L561-I565 WeakPolarHBondContact O-CG1 3.43Å; L561-I565 PolarHBondContact O-N 3.25Å
562	L	59.2	Low	57.9	Low	118 Å²	118	111.7 Å²	111.7	62%	0.618	60%	0.597	S	S	*	*	H	α-helix	trans	-72	-35.4	178.3	-83.1	162.9	0	0	0	112.9	L566	L562-L566 WeakPolarHBondContact O-CG 3.42Å; L562-L566 PolarHBondContact O-N 2.98Å; L562-L566 VanDerWaalsContact O-N 3.14Å
563	L	63.2	Low	58.1	Low	120 Å²	120	108.6 Å²	108.6	63%	0.628	58%	0.584	S	S	*	*	H	α-helix	trans	-68.6	-37.5	174.1	-96.2	148.4	0	0	0	112.2	L566 V567	L563-L566 PolarHBondContact O-N 2.93Å; L563-V567 WeakPolarHBondContact O-CG2 3.36Å; L563-V567 PolarHBondContact O-N 3.3Å
564	G	63.2	Low	58.4	Low	46 Å²	46	105.7 Å²	105.7	47%	0.474	57%	0.573	S	S	.	*	H	α-helix	trans	-64.2	-40.5	175.4	0	0	0	0	0	113.6	A560 F568	A560-G564 PolarHBondContact O-N 3.29Å; G564-F568 WeakPolarHBondContact O-CB 3.36Å; G564-F568 PolarHBondContact O-N 3.22Å
565	I	65.3	Low	58.5	Low	85 Å²	85	112.2 Å²	112.2	44%	0.436	58%	0.579	S	S	.	*	H	α-helix	trans	-71.8	-35	178.3	-65.9	169.8	0	0	0	111.4	L561 F568 R569	L561-I565 WeakPolarHBondContact O-CG1 3.43Å; L561-I565 PolarHBondContact O-N 3.25Å; I565-F568 PolarHBondContact O-N 3.3Å; I565-R569 WeakPolarHBondContact O-CB 3.21Å; I565-R569 WeakPolarHBondContact O-CG 3.48Å; I565-R569 PolarHBondContact O-N 2.93Å
566	L	63.6	Low	58.5	Low	115 Å²	115	111.6 Å²	111.6	60%	0.602	57%	0.572	S	S	*	*	H	α-helix	trans	-68.9	-38.6	175.1	-76.7	168.9	0	0	0	112.4	L562 L563 R569 S570	L562-L566 WeakPolarHBondContact O-CG 3.42Å; L562-L566 PolarHBondContact O-N 2.98Å; L562-L566 VanDerWaalsContact O-N 3.14Å; L563-L566 PolarHBondContact O-N 2.93Å; L566-R569 PolarHBondContact O-N 3.41Å; L566-S570 WeakPolarHBondContact O-CB 3.37Å; L566-S570 PolarHBondContact O-N 3.07Å; L566-S570 PolarHBondContact O-OG 3.43Å
567	V	65.8	Low	58.4	Low	65 Å²	65	113.8 Å²	113.8	39%	0.394	57%	0.571	S	S	.	*	H	α-helix	trans	-70.6	-33.4	174.5	173.9	0	0	0	0	111.8	L563 S570 R571	L563-V567 WeakPolarHBondContact O-CG2 3.36Å; L563-V567 PolarHBondContact O-N 3.3Å; V567-S570 WeakPolarHBondContact CA-OG 3.44Å; V567-S570 PolarHBondContact O-OG 2.69Å; V567-S570 VanDerWaalsContact O-OG 3.09Å; V567-R571 HydrophobicContact CG1-CG 4.45Å; V567-R571 VanDerWaalsContact O-CB 3.31Å; V567-R571 WeakPolarHBondContact O-CB 3.31Å; V567-R571 WeakPolarHBondContact O-CG 3.41Å; V567-R571 PolarHBondContact O-N 3.42Å
568	F	61.1	Low	58.1	Low	132 Å²	132	113.3 Å²	113.3	58%	0.579	57%	0.565	S	S	*	*	H	α-helix	trans	-70.4	-40.3	174.4	-170.9	-103.3	0	0	0	112.2	G564 I565 R572	G564-F568 WeakPolarHBondContact O-CB 3.36Å; G564-F568 PolarHBondContact O-N 3.22Å; I565-F568 PolarHBondContact O-N 3.3Å; F568-R572 WeakPolarHBondContact O-CB 3.46Å; F568-R572 PolarHBondContact O-N 2.76Å
569	R	59.6	Low	58	Low	180 Å²	180	117.9 Å²	117.9	68%	0.679	58%	0.575	S	S	*	*	H	α-helix	trans	-68.9	-36.3	173.8	-75.8	-172.8	125.8	115	-0.9	112.5	I565 L566 T573	I565-R569 WeakPolarHBondContact O-CB 3.21Å; I565-R569 WeakPolarHBondContact O-CG 3.48Å; I565-R569 PolarHBondContact O-N 2.93Å; L566-R569 PolarHBondContact O-N 3.41Å; R569-T573 PolarHBondContact O-N 3.15Å; R569-T573 PolarHBondContact O-OG1 3.11Å
570	S	58.9	Low	57.5	Low	53 Å²	53	123.9 Å²	123.9	37%	0.371	59%	0.585	S	S	.	*	H	α-helix	trans	-70.7	-38.1	175.5	76.4	0	0	0	0	112.2	L566 V567 T573 Q574	L566-S570 WeakPolarHBondContact O-CB 3.37Å; L566-S570 PolarHBondContact O-N 3.07Å; L566-S570 PolarHBondContact O-OG 3.43Å; V567-S570 WeakPolarHBondContact CA-OG 3.44Å; V567-S570 PolarHBondContact O-OG 2.69Å; V567-S570 VanDerWaalsContact O-OG 3.09Å; S570-T573 WeakPolarHBondContact CA-OG1 3.11Å; S570-T573 PolarHBondContact O-N 3.31Å; S570-T573 PolarHBondContact O-OG1 3.43Å; S570-Q574 WeakPolarHBondContact O-CB 3.43Å; S570-Q574 PolarHBondContact O-N 3.36Å
571	R	57	Low	57	Low	169 Å²	169	127 Å²	127	64%	0.638	59%	0.587	S	S	*	*	H	α-helix	trans	-69.7	-32.1	174.1	-76.5	-177.6	168.7	171.4	-1.6	113.2	V567 R575	V567-R571 HydrophobicContact CG1-CG 4.45Å; V567-R571 VanDerWaalsContact O-CB 3.31Å; V567-R571 WeakPolarHBondContact O-CB 3.31Å; V567-R571 WeakPolarHBondContact O-CG 3.41Å; V567-R571 PolarHBondContact O-N 3.42Å; R571-R575 WeakPolarHBondContact O-CB 3.44Å; R571-R575 WeakPolarHBondContact O-CG 3.41Å; R571-R575 PolarHBondContact O-N 2.99Å
572	R	55.9	Low	56.1	Low	174 Å²	174	131 Å²	131	66%	0.657	59%	0.593	S	S	*	*	H	α-helix	trans	-70.9	-40.4	173	-127.1	179.6	179.8	178.9	0.2	112	F568 Q576	F568-R572 WeakPolarHBondContact O-CB 3.46Å; F568-R572 PolarHBondContact O-N 2.76Å; R572-Q576 WeakPolarHBondContact O-CB 3.32Å; R572-Q576 WeakPolarHBondContact O-CG 3.35Å; R572-Q576 PolarHBondContact O-N 3.23Å
573	T	56.4	Low	55.4	Low	74 Å²	74	130.7 Å²	130.7	45%	0.454	59%	0.592	S	S	.	*	H	α-helix	trans	-73.1	-28.5	173.4	36.5	0	0	0	0	112.9	R569 S570 R577	R569-T573 PolarHBondContact O-N 3.15Å; R569-T573 PolarHBondContact O-OG1 3.11Å; S570-T573 WeakPolarHBondContact CA-OG1 3.11Å; S570-T573 PolarHBondContact O-N 3.31Å; S570-T573 PolarHBondContact O-OG1 3.43Å; T573-R577 VanDerWaalsContact O-CB 3.31Å; T573-R577 WeakPolarHBondContact O-CB 3.2Å; T573-R577 VanDerWaalsContact O-CG 3.29Å; T573-R577 WeakPolarHBondContact O-CG 3.17Å; T573-R577 PolarHBondContact O-N 3.05Å
574	Q	55.4	Low	54.3	Low	113 Å²	113	133.8 Å²	133.8	53%	0.528	60%	0.596	S	S	.	*	H	α-helix	trans	-77.1	-35.6	175	-167.9	174.5	-4.9	0	0	112.3	S570 R577 Q578	S570-Q574 WeakPolarHBondContact O-CB 3.43Å; S570-Q574 PolarHBondContact O-N 3.36Å; Q574-R577 PolarHBondContact O-N 2.7Å; Q574-Q578 PolarHBondContact O-N 3.14Å
575	R	53	Low	53.2	Low	196 Å²	196	135.5 Å²	135.5	74%	0.74	61%	0.605	S	S	*	*	H	α-helix	trans	-66	-38.8	168	-79	-177.9	174.4	-177.3	-1.9	111.9	R571 R577 Q578 Q579	R571-R575 WeakPolarHBondContact O-CB 3.44Å; R571-R575 WeakPolarHBondContact O-CG 3.41Å; R571-R575 PolarHBondContact O-N 2.99Å; R575-R577 VanDerWaalsContact C-N 3.35Å; R575-Q578 PolarHBondContact O-N 2.96Å; R575-Q579 PolarHBondContact O-N 3.03Å; R575-Q579 VanDerWaalsContact O-N 3.09Å
576	Q	54	Low	52	Low	126 Å²	126	136.8 Å²	136.8	59%	0.589	62%	0.617	S	S	*	*	H	α-helix	trans	-68.1	-31.1	170.8	-78.9	-179.4	-23.7	0	0	113	R572 R580	R572-Q576 WeakPolarHBondContact O-CB 3.32Å; R572-Q576 WeakPolarHBondContact O-CG 3.35Å; R572-Q576 PolarHBondContact O-N 3.23Å; Q576-R580 WeakPolarHBondContact O-CG 3.26Å; Q576-R580 PolarHBondContact O-N 3.12Å; Q576-R580 VanDerWaalsContact O-N 3.09Å
577	R	51.6	Low	50.7	Low	185 Å²	185	136.4 Å²	136.4	70%	0.698	62%	0.616	S	S	*	*	H	α-helix	trans	-74.6	-34.6	173.5	-82	176.4	169.8	177.9	-3.2	112.9	T573 Q574 R575 R580 Q581	T573-R577 VanDerWaalsContact O-CB 3.31Å; T573-R577 WeakPolarHBondContact O-CB 3.2Å; T573-R577 VanDerWaalsContact O-CG 3.29Å; T573-R577 WeakPolarHBondContact O-CG 3.17Å; T573-R577 PolarHBondContact O-N 3.05Å; Q574-R577 PolarHBondContact O-N 2.7Å; R575-R577 VanDerWaalsContact C-N 3.35Å; R577-R580 CarbonylContact O-C 3.51Å; R577-R580 PolarHBondContact O-N 3.23Å; R577-Q581 WeakPolarHBondContact O-CB 3.26Å; R577-Q581 PolarHBondContact O-N 3.32Å
578	Q	49.1	Very low	49.4	Very low	126 Å²	126	139.5 Å²	139.5	59%	0.589	64%	0.635	S	S	*	*	H	α-helix	trans	-69.5	-33.1	172.6	-92.3	179.8	-21.3	0	0	112.4	Q574 R575 Q581 R582	Q574-Q578 PolarHBondContact O-N 3.14Å; R575-Q578 PolarHBondContact O-N 2.96Å; Q578-Q581 PolarHBondContact O-N 3.07Å; Q578-R582 PolarHBondContact O-N 3.31Å; Q578-R582 VanDerWaalsContact O-N 3.09Å
579	Q	50.5	Low	48.2	Very low	139 Å²	139	141 Å²	141	65%	0.65	65%	0.649	S	S	*	*	H	α-helix	trans	-62.7	-48.8	168.1	-151	86.7	4.8	0	0	110.2	R575 Q581 R582 D583	R575-Q579 PolarHBondContact O-N 3.03Å; R575-Q579 VanDerWaalsContact O-N 3.09Å; Q579-Q581 PolarHBondContact O-N 3.24Å; Q579-R582 PolarHBondContact O-N 3.37Å; Q579-R582 VanDerWaalsContact O-N 3.16Å; Q579-D583 PolarHBondContact O-N 3.39Å; Q579-D583 VanDerWaalsContact O-N 3.15Å
580	R	47.4	Very low	47.1	Very low	187 Å²	187	141.2 Å²	141.2	71%	0.706	65%	0.65	S	S	*	*	H	α-helix	trans	-66.3	-16.2	175.7	-74.2	-179.3	175.1	-166.9	-1.6	115.2	Q576 R577 R584	Q576-R580 WeakPolarHBondContact O-CG 3.26Å; Q576-R580 PolarHBondContact O-N 3.12Å; Q576-R580 VanDerWaalsContact O-N 3.09Å; R577-R580 CarbonylContact O-C 3.51Å; R577-R580 PolarHBondContact O-N 3.23Å; R580-R584 PolarHBondContact O-N 3.39Å
581	Q	45.8	Very low	45.8	Very low	135 Å²	135	148 Å²	148	63%	0.631	68%	0.676	S	S	*	*	H	α-helix	trans	-92.4	-23.8	176.1	-133.3	172.4	-5.2	0	0	111.9	R577 Q578 Q579 D583 R584 A585	R577-Q581 WeakPolarHBondContact O-CB 3.26Å; R577-Q581 PolarHBondContact O-N 3.32Å; Q578-Q581 PolarHBondContact O-N 3.07Å; Q579-Q581 PolarHBondContact O-N 3.24Å; Q581-D583 VanDerWaalsContact C-N 3.32Å; Q581-R584 PolarHBondContact O-N 3.41Å; Q581-A585 PolarHBondContact O-N 2.96Å
582	R	42.5	Very low	44.9	Very low	213 Å²	213	147.8 Å²	147.8	80%	0.804	69%	0.687	S	S	*	*	H	α-helix	trans	-71.3	-32.2	166.1	-135.4	174.4	179.2	173.5	-2.6	111	Q578 Q579 R584	Q578-R582 PolarHBondContact O-N 3.31Å; Q578-R582 VanDerWaalsContact O-N 3.09Å; Q579-R582 PolarHBondContact O-N 3.37Å; Q579-R582 VanDerWaalsContact O-N 3.16Å; R582-R584 VanDerWaalsContact C-N 3.28Å; R582-R584 PolarHBondContact O-N 3.05Å
583	D	43.2	Very low	44	Very low	111 Å²	111	145.7 Å²	145.7	59%	0.594	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-10.6	170.9	-58.8	-24.5	0	0	0	113.8	Q579 Q581	Q579-D583 PolarHBondContact O-N 3.39Å; Q579-D583 VanDerWaalsContact O-N 3.15Å; Q581-D583 VanDerWaalsContact C-N 3.32Å
584	R	41.7	Very low	43	Very low	186 Å²	186	149.8 Å²	149.8	70%	0.702	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	-5.8	178.1	-103.7	179.6	173.1	175.3	-2.3	114.5	R580 Q581 R582 T586	R580-R584 PolarHBondContact O-N 3.39Å; Q581-R584 PolarHBondContact O-N 3.41Å; R582-R584 VanDerWaalsContact C-N 3.28Å; R582-R584 PolarHBondContact O-N 3.05Å; R584-T586 VanDerWaalsContact C-N 3.32Å
585	A	38.9	Very low	42	Very low	82 Å²	82	156.4 Å²	156.4	68%	0.678	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-2.7	173.1	0	0	0	0	0	112.8	Q581	Q581-A585 PolarHBondContact O-N 2.96Å
586	T	40.3	Very low	41.6	Very low	111 Å²	111	150 Å²	150	68%	0.681	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	8.5	168.7	43.4	0	0	0	0	112.8	R584	R584-T586 VanDerWaalsContact C-N 3.32Å
587	D	37.1	Very low	41.2	Very low	107 Å²	107	149.7 Å²	149.7	57%	0.572	70%	0.698	S	S	*	*	S	Bend	trans	-104.3	21	-174.1	-158.9	29.2	0	0	0	112.9
588	V	38.6	Very low	41.1	Very low	130 Å²	130	146.2 Å²	146.2	79%	0.788	70%	0.699	S	S	*	*	S	Bend	trans	-124.5	18	179.6	-164.8	0	0	0	0	112.2
589	D	36.3	Very low	41.1	Very low	165 Å²	165	143.2 Å²	143.2	88%	0.882	68%	0.683	S	S	*	*	S	Bend	trans	-136.3	29.7	171	-144.6	24	0	0	0	112.3
590	R	34.7	Very low	41.3	Very low	184 Å²	184	138 Å²	138	69%	0.694	66%	0.661	S	S	*	*			trans	-126.1	41.1	-177.7	-159.4	175.3	163.1	156.2	-4.9	112	K593	R590-K593 HydrophobicContact CG-CB 4.38Å
591	E	33.5	Very low	41.7	Very low	196 Å²	196	132.8 Å²	132.8	92%	0.916	65%	0.647	S	S	*	*	S	Bend	trans	-103.5	27.1	166.1	-75.4	-137.3	139.9	0	0	113
592	D	38.2	Very low	42.2	Very low	163 Å²	163	126.7 Å²	126.7	87%	0.872	62%	0.619	S	S	*	*	S	Bend	trans	-143.9	18.3	169.1	-101.3	-20.9	0	0	0	115.1
593	K	35.9	Very low	42.9	Very low	130 Å²	130	123.5 Å²	123.5	57%	0.565	61%	0.613	S	S	*	*			trans	-99.3	97	171.4	-80.6	-175	177.1	-177.4	0	110.7	R590 W595	R590-K593 HydrophobicContact CG-CB 4.38Å; K593-W595 PolarHBondContact O-N 2.96Å
594	L	35.6	Very low	43.4	Very low	161 Å²	161	122.2 Å²	122.2	84%	0.843	62%	0.617	S	S	*	*			trans	-40.5	130.9	168.2	-110.7	75.3	0	0	0	111.4	L596	L594-L596 PolarHBondContact O-N 3.19Å; L594-L596 VanDerWaalsContact O-N 3.17Å
595	W	35.1	Very low	44.1	Very low	252 Å²	252	117 Å²	117	96%	0.955	60%	0.598	S	S	*	*			trans	-57.7	110.2	-177.5	-71.2	76.5	0	0	0	112.7	K593	K593-W595 PolarHBondContact O-N 2.96Å
596	L	44.5	Very low	45	Very low	62 Å²	62	122.8 Å²	122.8	33%	0.325	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-86	127.4	155.2	-82	157.6	0	0	0	108.9	L594 Q679 H743	L594-L596 PolarHBondContact O-N 3.19Å; L594-L596 VanDerWaalsContact O-N 3.17Å; L596-Q679 HydrophobicContact CD2-CB 3.87Å; L596-Q679 HydrophobicContact CD2-CG 4.49Å; L596-Q679 WeakPolarHBondContact CD2-O 3.5Å; L596-H743 HydrophobicContact CD1-CB 4.45Å; L596-H743 WeakPolarHBondContact CD1-CD2 3.41Å
597	K	44.9	Very low	46.2	Very low	118 Å²	118	120.4 Å²	120.4	51%	0.513	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-59.9	144.1	176.7	-77.1	179.8	-176.3	-174.8	0	109.6	D614 F615	K597-D614 PolarHBondContact NZ-O 2.81Å; K597-F615 HydrophobicContact CB-CD1 4.02Å; K597-F615 HydrophobicContact CB-CE1 3.21Å; K597-F615 HydrophobicContact CB-CZ 3.8Å; K597-F615 HydrophobicContact CD-CD1 4.13Å; K597-F615 HydrophobicContact CD-CE1 3.91Å; K597-F615 HydrophobicContact CD-CZ 4.27Å; K597-F615 HydrophobicContact CG-CE1 4.2Å
598	P	50.2	Low	47.5	Very low	112 Å²	112	115.3 Å²	115.3	73%	0.727	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-56.6	141.9	-179.8	-14.6	23.1	0	0	0	111.7	V600 F615	P598-V600 PolarHBondContact O-N 2.9Å; P598-F615 WeakPolarHBondContact O-CZ 3.46Å
599	Y	49.5	Very low	49	Very low	64 Å²	64	109.7 Å²	109.7	25%	0.251	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-51.5	121.3	176.7	172.2	-91	0	0	0	110.9	R672 R772 L773	Y599-R672 PolarHBondContact OH-NE 3.26Å; Y599-R672 PolarHBondContact OH-NH2 3.13Å; Y599-R772 PolarHBondContact OH-NH1 2.91Å; Y599-L773 HydrophobicContact CD2-CB 4.03Å; Y599-L773 HydrophobicContact CG-CB 4.12Å; Y599-L773 HydrophobicContact CG-CD2 4.2Å
600	V	53.7	Low	50.7	Low	30 Å²	30	107.9 Å²	107.9	18%	0.182	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-92.7	119.7	178.9	162.9	0	0	0	0	110.1	P598 L602 Y605 F615	P598-V600 PolarHBondContact O-N 2.9Å; V600-L602 HydrophobicContact CG1-CD2 4.43Å; V600-L602 PolarHBondContact O-N 2.94Å; V600-L602 VanDerWaalsContact O-N 3.13Å; V600-Y605 HydrophobicContact CG1-CD2 4.21Å; V600-Y605 HydrophobicContact CG1-CE2 3.47Å; V600-Y605 VanDerWaalsContact CG1-CE2 3.47Å; V600-F615 HydrophobicContact CB-CE2 3.68Å; V600-F615 HydrophobicContact CB-CZ 4.04Å; V600-F615 HydrophobicContact CG2-CE2 3.41Å; V600-F615 VanDerWaalsContact CG2-CE2 3.41Å; V600-F615 HydrophobicContact CG2-CZ 3.54Å
601	D	55.3	Low	52.4	Low	77 Å²	77	99.1 Å²	99.1	41%	0.412	49%	0.487	S	S	.	.			trans	-73.5	100.3	166.4	-172.3	6.4	0	0	0	109.2	Q603 A604	D601-Q603 PolarHBondContact O-N 2.83Å; D601-Q603 VanDerWaalsContact O-N 3.16Å; D601-Q603 WeakPolarHBondContact OD1-CB 3.28Å; D601-Q603 PolarHBondContact OD1-N 2.82Å; D601-A604 WeakPolarHBondContact O-CB 3.33Å; D601-A604 PolarHBondContact O-N 2.69Å; D601-A604 VanDerWaalsContact O-N 3.07Å
602	L	56	Low	54.2	Low	7 Å²	7	89.8 Å²	89.8	4%	0.037	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-55.3	-31	176.9	-73.7	174	0	0	0	111.1	V600 A604 Y605 W668 R672	V600-L602 HydrophobicContact CG1-CD2 4.43Å; V600-L602 PolarHBondContact O-N 2.94Å; V600-L602 VanDerWaalsContact O-N 3.13Å; L602-A604 PolarHBondContact O-N 2.87Å; L602-Y605 PolarHBondContact O-N 2.84Å; L602-W668 HydrophobicContact CB-CE3 3.66Å; L602-W668 HydrophobicContact CB-CZ3 3.59Å; L602-W668 WeakPolarHBondContact O-CH2 3.07Å; L602-W668 WeakPolarHBondContact O-CZ3 3.36Å; L602-R672 HydrophobicContact CD1-CB 3.84Å; L602-R672 HydrophobicContact CD1-CG 4.37Å
603	Q	57.6	Low	56.1	Low	146 Å²	146	84.5 Å²	84.5	68%	0.682	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-63.9	-15.6	179.6	-61.7	-174.5	-15.8	0	0	114.1	D601 Y605	D601-Q603 PolarHBondContact O-N 2.83Å; D601-Q603 VanDerWaalsContact O-N 3.16Å; D601-Q603 WeakPolarHBondContact OD1-CB 3.28Å; D601-Q603 PolarHBondContact OD1-N 2.82Å; Q603-Y605 VanDerWaalsContact C-N 3.32Å
604	A	54.9	Low	57.9	Low	83 Å²	83	81.7 Å²	81.7	69%	0.686	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-80.6	-10.9	175.2	0	0	0	0	0	113.7	D601 L602	D601-A604 WeakPolarHBondContact O-CB 3.33Å; D601-A604 PolarHBondContact O-N 2.69Å; D601-A604 VanDerWaalsContact O-N 3.07Å; L602-A604 PolarHBondContact O-N 2.87Å
605	Y	55.4	Low	59.8	Low	78 Å²	78	75.3 Å²	75.3	31%	0.306	37%	0.372	S	S	.	.	S	Bend	trans	-94.1	143.7	179	-72.3	-111.3	0	0	0	110.4	V600 L602 Q603 D607 D614 W668	V600-Y605 HydrophobicContact CG1-CD2 4.21Å; V600-Y605 HydrophobicContact CG1-CE2 3.47Å; V600-Y605 VanDerWaalsContact CG1-CE2 3.47Å; L602-Y605 PolarHBondContact O-N 2.84Å; Q603-Y605 VanDerWaalsContact C-N 3.32Å; Y605-D607 VanDerWaalsContact C-N 3.28Å; Y605-D614 PolarHBondContact OH-OD2 2.83Å; Y605-D614 VanDerWaalsContact OH-OD2 3.06Å; Y605-W668 VanDerWaalsContact O-CH2 3.26Å; Y605-W668 WeakPolarHBondContact O-CH2 3.08Å
606	E	57.2	Low	62.2	Low	202 Å²	202	64.2 Å²	64.2	94%	0.944	33%	0.332	S	S	*	.	S	Bend	trans	-69.8	-28.5	172.1	-70.9	-173.8	159	0	0	111.8
607	D	66.8	Low	64.3	Low	62 Å²	62	66.8 Å²	66.8	33%	0.332	34%	0.337	S	S	.	.	S	Bend	trans	-128.3	112	175.6	-178.3	4.1	0	0	0	111	Y605 A609 Q610	Y605-D607 VanDerWaalsContact C-N 3.28Å; D607-A609 PolarHBondContact O-N 2.85Å; D607-A609 WeakPolarHBondContact OD1-CB 3.39Å; D607-A609 PolarHBondContact OD1-N 2.69Å; D607-Q610 HydrophobicContact CB-CG 4.24Å; D607-Q610 PolarHBondContact O-N 3.43Å; D607-Q610 VanDerWaalsContact O-N 3.15Å
608	P	64.2	Low	66.5	Low	0 Å²	0	63 Å²	63	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-56.8	-30.4	178.2	-3.3	1.2	0	0	0	114.2	Q610 G611 A612 W667 W668 L671	P608-Q610 PolarHBondContact O-N 3.17Å; P608-G611 PolarHBondContact O-N 3.4Å; P608-A612 WeakPolarHBondContact O-CB 3.43Å; P608-A612 PolarHBondContact O-N 2.96Å; P608-W667 VanDerWaalsContact CD-CZ3 3.42Å; P608-W667 HydrophobicContact CG-CD2 3.78Å; P608-W667 HydrophobicContact CG-CE3 3.54Å; P608-W667 HydrophobicContact CG-CH2 3.61Å; P608-W667 HydrophobicContact CG-CZ2 3.86Å; P608-W667 HydrophobicContact CG-CZ3 3.46Å; P608-W667 VanDerWaalsContact CG-CZ3 3.46Å; P608-W668 VanDerWaalsContact CA-CZ3 3.41Å; P608-W668 HydrophobicContact CB-CD2 4.11Å; P608-W668 HydrophobicContact CB-CE3 3.41Å; P608-W668 VanDerWaalsContact CB-CE3 3.41Å; P608-W668 HydrophobicContact CB-CH2 3.71Å; P608-W668 HydrophobicContact CB-CZ2 4.39Å; P608-W668 HydrophobicContact CB-CZ3 3.14Å; P608-W668 HydrophobicContact CG-CD2 3.78Å; P608-W668 HydrophobicContact CG-CE3 3.59Å; P608-W668 HydrophobicContact CG-CH2 3.44Å; P608-W668 VanDerWaalsContact CG-CH2 3.44Å; P608-W668 HydrophobicContact CG-CZ2 3.67Å; P608-W668 HydrophobicContact CG-CZ3 3.38Å; P608-L671 HydrophobicContact CB-CD1 3.89Å
609	A	68.8	Low	68.4	Low	12 Å²	12	57.8 Å²	57.8	10%	0.099	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-36.5	-179	0	0	0	0	0	110.9	D607 L613 T693	D607-A609 PolarHBondContact O-N 2.85Å; D607-A609 WeakPolarHBondContact OD1-CB 3.39Å; D607-A609 PolarHBondContact OD1-N 2.69Å; A609-L613 VanDerWaalsContact O-CG 3.29Å; A609-L613 WeakPolarHBondContact O-CG 3.42Å; A609-L613 PolarHBondContact O-N 2.89Å; A609-T693 HydrophobicContact CB-CG2 4.28Å
610	Q	71.9	Confident	70.2	Confident	126 Å²	126	57.9 Å²	57.9	59%	0.589	29%	0.292	S	S	*	.	H	α-helix	trans	-67.6	-46.1	177.7	-65.3	-175	6	0	0	111.8	D607 P608 A612 L613	D607-Q610 HydrophobicContact CB-CG 4.24Å; D607-Q610 PolarHBondContact O-N 3.43Å; D607-Q610 VanDerWaalsContact O-N 3.15Å; P608-Q610 PolarHBondContact O-N 3.17Å; Q610-A612 VanDerWaalsContact C-N 3.33Å; Q610-A612 PolarHBondContact O-N 3.47Å; Q610-L613 PolarHBondContact O-N 2.85Å
611	G	70.4	Confident	71.7	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-66.8	-31.5	178.3	0	0	0	0	0	113.5	P608 L613 D614	P608-G611 PolarHBondContact O-N 3.4Å; G611-L613 VanDerWaalsContact C-N 3.32Å; G611-L613 PolarHBondContact O-N 2.93Å; G611-D614 PolarHBondContact O-N 3.47Å
612	A	71.8	Confident	73.2	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-66.2	-34.1	175	0	0	0	0	0	112.5	P608 Q610 D614 F615 T616 L671	P608-A612 WeakPolarHBondContact O-CB 3.43Å; P608-A612 PolarHBondContact O-N 2.96Å; Q610-A612 VanDerWaalsContact C-N 3.33Å; Q610-A612 PolarHBondContact O-N 3.47Å; A612-D614 PolarHBondContact O-N 3.28Å; A612-F615 PolarHBondContact O-N 2.89Å; A612-T616 WeakPolarHBondContact O-CB 3.5Å; A612-T616 VanDerWaalsContact O-CG2 3.31Å; A612-T616 WeakPolarHBondContact O-CG2 3.34Å; A612-T616 PolarHBondContact O-N 3.14Å; A612-T616 VanDerWaalsContact O-N 3.13Å; A612-T616 PolarHBondContact O-OG1 3.43Å; A612-L671 HydrophobicContact CB-CB 4.32Å; A612-L671 HydrophobicContact CB-CD2 4.45Å
613	L	78.3	Confident	74.8	Confident	52 Å²	52	62 Å²	62	27%	0.272	32%	0.321	S	S	.	.	H	α-helix	trans	-71.6	-13.6	-179.6	-69.1	176.2	0	0	0	114.4	A609 Q610 G611 F615 E618 V691	A609-L613 VanDerWaalsContact O-CG 3.29Å; A609-L613 WeakPolarHBondContact O-CG 3.42Å; A609-L613 PolarHBondContact O-N 2.89Å; Q610-L613 PolarHBondContact O-N 2.85Å; G611-L613 VanDerWaalsContact C-N 3.32Å; G611-L613 PolarHBondContact O-N 2.93Å; L613-F615 PolarHBondContact O-N 2.98Å; L613-E618 HydrophobicContact CD2-CB 3.57Å; L613-E618 HydrophobicContact CD2-CG 4.45Å; L613-V691 HydrophobicContact CD2-CG2 3.96Å
614	D	74.8	Confident	76.4	Confident	71 Å²	71	55.9 Å²	55.9	38%	0.38	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-22	172.7	-74.9	-27.3	0	0	0	112.3	K597 Y605 G611 A612	K597-D614 PolarHBondContact NZ-O 2.81Å; Y605-D614 PolarHBondContact OH-OD2 2.83Å; Y605-D614 VanDerWaalsContact OH-OD2 3.06Å; G611-D614 PolarHBondContact O-N 3.47Å; A612-D614 PolarHBondContact O-N 3.28Å
615	F	75.3	Confident	78.1	Confident	27 Å²	27	55.5 Å²	55.5	12%	0.118	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.7	-3.6	-174.3	-58.3	-97.2	0	0	0	113.5	K597 P598 V600 A612 L613 T675 G678 Q679	K597-F615 HydrophobicContact CB-CD1 4.02Å; K597-F615 HydrophobicContact CB-CE1 3.21Å; K597-F615 HydrophobicContact CB-CZ 3.8Å; K597-F615 HydrophobicContact CD-CD1 4.13Å; K597-F615 HydrophobicContact CD-CE1 3.91Å; K597-F615 HydrophobicContact CD-CZ 4.27Å; K597-F615 HydrophobicContact CG-CE1 4.2Å; P598-F615 WeakPolarHBondContact O-CZ 3.46Å; V600-F615 HydrophobicContact CB-CE2 3.68Å; V600-F615 HydrophobicContact CB-CZ 4.04Å; V600-F615 HydrophobicContact CG2-CE2 3.41Å; V600-F615 VanDerWaalsContact CG2-CE2 3.41Å; V600-F615 HydrophobicContact CG2-CZ 3.54Å; A612-F615 PolarHBondContact O-N 2.89Å; L613-F615 PolarHBondContact O-N 2.98Å; F615-T675 HydrophobicContact CB-CG2 4.1Å; F615-T675 HydrophobicContact CD2-CG2 3.69Å; F615-T675 HydrophobicContact CE2-CG2 4.35Å; F615-T675 HydrophobicContact CG-CG2 3.98Å; F615-G678 CarbonylContact O-C 3.52Å; F615-G678 WeakPolarHBondContact O-CA 3.43Å; F615-Q679 HydrophobicContact CB-CG 4.38Å; F615-Q679 HydrophobicContact CD1-CG 3.41Å; F615-Q679 VanDerWaalsContact CD1-CG 3.41Å; F615-Q679 HydrophobicContact CE1-CG 3.96Å; F615-Q679 HydrophobicContact CG-CG 4.21Å
616	T	84.6	Confident	79.7	Confident	19 Å²	19	55.1 Å²	55.1	12%	0.117	28%	0.284	C	S	.	.	S	Bend	trans	-130.5	165.6	-175.9	68.5	0	0	0	0	110.4	A612 A674 L688 V691	A612-T616 WeakPolarHBondContact O-CB 3.5Å; A612-T616 VanDerWaalsContact O-CG2 3.31Å; A612-T616 WeakPolarHBondContact O-CG2 3.34Å; A612-T616 PolarHBondContact O-N 3.14Å; A612-T616 VanDerWaalsContact O-N 3.13Å; A612-T616 PolarHBondContact O-OG1 3.43Å; T616-A674 HydrophobicContact CG2-CB 4.26Å; T616-A674 WeakPolarHBondContact CG2-O 3.1Å; T616-L688 HydrophobicContact CG2-CD2 3.48Å; T616-L688 VanDerWaalsContact CG2-CD2 3.48Å; T616-V691 HydrophobicContact CG2-CG1 4.31Å; T616-V691 VanDerWaalsContact OG1-CG2 3.27Å; T616-V691 WeakPolarHBondContact OG1-CG2 3.47Å
617	R	88	Confident	81.2	Confident	117 Å²	117	48.9 Å²	48.9	44%	0.442	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-101.6	120.4	177.2	-177.6	-178.4	-179.7	179.4	2.3	109.9	L619 G690 V691	R617-L619 HydrophobicContact CG-CD2 4.22Å; R617-L619 PolarHBondContact O-N 3.11Å; R617-G690 CarbonylContact O-C 3.52Å; R617-G690 WeakPolarHBondContact O-CA 3.33Å; R617-V691 PolarHBondContact O-N 2.89Å
618	E	91.1	Very high	82.3	Confident	39 Å²	39	49.8 Å²	49.8	18%	0.182	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-67	126.4	167.9	-171.6	68.1	-178.4	0	0	109.5	L613 V691 T693 K694	L613-E618 HydrophobicContact CD2-CB 3.57Å; L613-E618 HydrophobicContact CD2-CG 4.45Å; E618-V691 CarbonylContact C-O 3.57Å; E618-V691 WeakPolarHBondContact CA-O 3.34Å; E618-T693 PolarHBondContact OE1-N 2.78Å; E618-T693 PolarHBondContact OE1-OG1 3.45Å; E618-T693 PolarHBondContact OE2-N 3.24Å; E618-T693 VanDerWaalsContact OE2-N 3.15Å; E618-T693 PolarHBondContact OE2-OG1 3.28Å; E618-K694 HydrophobicContact CG-CD 3.98Å; E618-K694 HydrophobicContact CG-CG 4.4Å; E618-K694 WeakPolarHBondContact OE1-CB 3.25Å; E618-K694 VanDerWaalsContact OE1-CG 3.28Å; E618-K694 WeakPolarHBondContact OE1-CG 3.47Å; E618-K694 PolarHBondContact OE1-N 3.07Å
619	L	90.3	Very high	83.4	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.01	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-101.8	143.7	175.1	-61.6	178.1	0	0	0	110.4	R617 P621 W623 L643 L645 V691 V692 I701	R617-L619 HydrophobicContact CG-CD2 4.22Å; R617-L619 PolarHBondContact O-N 3.11Å; L619-P621 WeakPolarHBondContact O-CD 3.34Å; L619-W623 HydrophobicContact CD2-CE3 4.39Å; L619-L643 HydrophobicContact CD1-CD1 4.08Å; L619-L643 HydrophobicContact CD1-CD2 4.21Å; L619-L643 HydrophobicContact CD2-CD1 4.46Å; L619-L645 HydrophobicContact CD2-CD2 4.17Å; L619-V691 PolarHBondContact N-O 2.79Å; L619-V692 HydrophobicContact CB-CG2 4.25Å; L619-I701 HydrophobicContact CD1-CB 4.01Å; L619-I701 HydrophobicContact CD1-CD1 4.09Å; L619-I701 HydrophobicContact CD1-CG1 4.02Å; L619-I701 HydrophobicContact CD1-CG2 4.29Å
620	D	87.9	Confident	84.2	Confident	66 Å²	66	57 Å²	57	35%	0.353	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-74.5	125.5	167.9	-167.3	-34.6	0	0	0	108.7	A622 W623	D620-A622 PolarHBondContact O-N 2.71Å; D620-A622 VanDerWaalsContact O-N 3.07Å; D620-A622 WeakPolarHBondContact OD1-CB 3.42Å; D620-A622 PolarHBondContact OD1-N 2.96Å; D620-W623 HydrophobicContact CB-CD2 3.75Å; D620-W623 HydrophobicContact CB-CE3 4.12Å; D620-W623 HydrophobicContact CB-CG 4.06Å; D620-W623 HydrophobicContact CB-CZ2 4.18Å; D620-W623 HydrophobicContact CB-CZ3 4.49Å; D620-W623 WeakPolarHBondContact O-CB 3.45Å; D620-W623 PolarHBondContact O-N 2.75Å
621	P	86.1	Confident	84.6	Confident	38 Å²	38	52.3 Å²	52.3	25%	0.247	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-54.6	-26	175	-29.1	38.6	0	0	0	113.9	L619 W623 L624 V692 R695	L619-P621 WeakPolarHBondContact O-CD 3.34Å; P621-W623 PolarHBondContact O-N 2.85Å; P621-L624 PolarHBondContact O-N 3.45Å; P621-L624 VanDerWaalsContact O-N 3.09Å; P621-V692 HydrophobicContact CG-CG1 3.64Å; P621-V692 HydrophobicContact CG-CG2 4.26Å; P621-R695 HydrophobicContact CG-CB 4.31Å; P621-R695 HydrophobicContact CG-CG 4.46Å
622	A	86.6	Confident	84.9	Confident	84 Å²	84	59.1 Å²	59.1	69%	0.694	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-64.6	-18.9	174.9	0	0	0	0	0	113.4	D620	D620-A622 PolarHBondContact O-N 2.71Å; D620-A622 VanDerWaalsContact O-N 3.07Å; D620-A622 WeakPolarHBondContact OD1-CB 3.42Å; D620-A622 PolarHBondContact OD1-N 2.96Å
623	W	89.5	Confident	84.5	Confident	77 Å²	77	60.6 Å²	60.6	29%	0.292	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-85.8	-9.7	175.8	-58.5	-14.8	0	0	0	113	L619 D620 P621 L643 R644 L645 P646	L619-W623 HydrophobicContact CD2-CE3 4.39Å; D620-W623 HydrophobicContact CB-CD2 3.75Å; D620-W623 HydrophobicContact CB-CE3 4.12Å; D620-W623 HydrophobicContact CB-CG 4.06Å; D620-W623 HydrophobicContact CB-CZ2 4.18Å; D620-W623 HydrophobicContact CB-CZ3 4.49Å; D620-W623 WeakPolarHBondContact O-CB 3.45Å; D620-W623 PolarHBondContact O-N 2.75Å; P621-W623 PolarHBondContact O-N 2.85Å; W623-L643 HydrophobicContact CB-CD1 4.1Å; W623-R644 WeakPolarHBondContact CB-O 3.25Å; W623-R644 PolarHBondContact O-N 3.38Å; W623-L645 HydrophobicContact CE3-CD2 3.88Å; W623-L645 HydrophobicContact CZ3-CD2 4.14Å; W623-P646 HydrophobicContact CD2-CG 4.47Å; W623-P646 HydrophobicContact CH2-CG 4.08Å; W623-P646 HydrophobicContact CZ2-CG 3.52Å
624	L	90.5	Very high	83.9	Confident	19 Å²	19	65.8 Å²	65.8	10%	0.099	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.6	-178.3	-68	168.3	0	0	0	110.1	P621 L643 V653 I655 V692 M699 I701	P621-L624 PolarHBondContact O-N 3.45Å; P621-L624 VanDerWaalsContact O-N 3.09Å; L624-L643 HydrophobicContact CD2-CB 4.13Å; L624-L643 HydrophobicContact CD2-CD1 3.71Å; L624-L643 HydrophobicContact CD2-CG 4.45Å; L624-L643 HydrophobicContact CG-CD1 4.3Å; L624-V653 HydrophobicContact CD2-CG2 4.33Å; L624-I655 HydrophobicContact CB-CD1 4.49Å; L624-I655 HydrophobicContact CD2-CD1 4.15Å; L624-V692 HydrophobicContact CD1-CG2 3.69Å; L624-M699 HydrophobicContact CD1-SD 4.4Å; L624-I701 HydrophobicContact CD1-CD1 3.94Å; L624-I701 HydrophobicContact CD1-CG1 3.87Å; L624-I701 HydrophobicContact CD2-CG1 4.01Å; L624-I701 HydrophobicContact CD2-CG2 4.26Å
625	M	90.2	Very high	83.4	Confident	74 Å²	74	62.9 Å²	62.9	37%	0.365	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	118.9	164.7	-60	-162.3	-48.9	0	0	108.3	G641 T642 R644	M625-G641 CarbonylContact O-C 3.57Å; M625-G641 WeakPolarHBondContact O-CA 3.04Å; M625-T642 PolarHBondContact N-O 3.26Å; M625-T642 PolarHBondContact O-N 2.87Å; M625-R644 VanDerWaalsContact CE-NH2 3.34Å
626	V	89.2	Confident	83.3	Confident	70 Å²	70	61.7 Å²	61.7	42%	0.424	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	124.6	176.4	-176.6	0	0	0	0	107.9	Y639 I655	V626-Y639 HydrophobicContact CG1-CD1 3.49Å; V626-Y639 VanDerWaalsContact CG1-CD1 3.49Å; V626-Y639 HydrophobicContact CG1-CD2 4.18Å; V626-Y639 HydrophobicContact CG1-CE1 4.22Å; V626-Y639 HydrophobicContact CG1-CG 3.47Å; V626-Y639 VanDerWaalsContact CG1-CG 3.47Å; V626-I655 HydrophobicContact CG2-CD1 3.93Å
627	D	88.5	Confident	83.3	Confident	72 Å²	72	63.8 Å²	63.8	39%	0.385	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-81.3	-176.2	-58	-31.6	0	0	0	111	R640	D627-R640 WeakPolarHBondContact CA-O 3.26Å; D627-R640 VanDerWaalsContact CB-O 3.32Å; D627-R640 WeakPolarHBondContact CB-O 3.45Å; D627-R640 PolarHBondContact N-O 3.41Å; D627-R640 IonicContact OD2-NH1 3.41Å; D627-R640 PolarHBondContact OD2-NH1 3.29Å
628	T	89.7	Confident	83.3	Confident	81 Å²	81	59.8 Å²	59.8	50%	0.497	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	148.4	-168.7	48.9	0	0	0	0	110.8	I630 Y639 R640	T628-I630 PolarHBondContact O-N 3.43Å; T628-Y639 CarbonylContact O-C 3.5Å; T628-Y639 VanDerWaalsContact O-CA 3.22Å; T628-Y639 WeakPolarHBondContact O-CA 3.39Å; T628-R640 PolarHBondContact N-O 2.93Å; T628-R640 PolarHBondContact O-N 2.96Å
629	V	88.7	Confident	83.3	Confident	82 Å²	82	60.3 Å²	60.3	50%	0.497	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	126.9	173.2	-178.1	0	0	0	0	108.7	Y639	V629-Y639 HydrophobicContact CB-CD1 4.42Å; V629-Y639 HydrophobicContact CG2-CD1 3.67Å; V629-Y639 HydrophobicContact CG2-CE1 3.41Å; V629-Y639 VanDerWaalsContact CG2-CE1 3.41Å
630	I	86	Confident	83.4	Confident	80 Å²	80	64 Å²	64	41%	0.41	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-13.5	178.2	58.2	175	0	0	0	113.1	T628 V638 R640 A654 F704	T628-I630 PolarHBondContact O-N 3.43Å; I630-V638 HydrophobicContact CD1-CG1 3.88Å; I630-V638 HydrophobicContact CG1-CB 4.1Å; I630-V638 HydrophobicContact CG1-CG1 3.84Å; I630-V638 VanDerWaalsContact CG1-O 3.27Å; I630-V638 WeakPolarHBondContact CG1-O 3.38Å; I630-V638 PolarHBondContact N-O 3.47Å; I630-R640 HydrophobicContact CD1-CB 4.41Å; I630-R640 HydrophobicContact CG2-CB 3.63Å; I630-A654 HydrophobicContact CD1-CB 4.27Å; I630-F704 HydrophobicContact CD1-CD2 4.14Å; I630-F704 HydrophobicContact CD1-CE2 3.73Å
631	G	78.8	Confident	83.7	Confident	29 Å²	29	60.8 Å²	60.8	30%	0.299	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.9	167.2	175.3	0	0	0	0	0	113.1	V638	G631-V638 PolarHBondContact N-O 2.84Å; G631-V638 PolarHBondContact O-N 3.4Å
632	E	76.3	Confident	84	Confident	142 Å²	142	60.1 Å²	60.1	66%	0.664	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	121.8	172.1	-171.1	173.4	-164.5	0	0	108.5	K659	E632-K659 IonicContact OE1-NZ 2.67Å; E632-K659 PolarHBondContact OE1-NZ 2.79Å
633	G	64.7	Low	84.3	Confident	32 Å²	32	56.1 Å²	56.1	33%	0.33	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	180	-179.5	0	0	0	0	0	112.9	F635 G636	G633-F635 PolarHBondContact O-N 3.38Å; G633-F635 VanDerWaalsContact O-N 3.15Å; G633-G636 PolarHBondContact N-O 2.85Å; G633-G636 PolarHBondContact O-N 2.88Å
634	E	65.1	Low	84.4	Confident	161 Å²	161	58.6 Å²	58.6	75%	0.752	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-34.9	-177.1	-174.4	179.2	-176.1	0	0	113.5
635	F	63.7	Low	84	Confident	10 Å²	10	58.4 Å²	58.4	4%	0.044	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-13.9	-173.6	-58.7	-72.3	0	0	0	114.2	G633 L658 K659 Q666 N669 F670	G633-F635 PolarHBondContact O-N 3.38Å; G633-F635 VanDerWaalsContact O-N 3.15Å; F635-L658 HydrophobicContact CB-CD1 3.91Å; F635-L658 HydrophobicContact CD1-CD1 4.24Å; F635-L658 HydrophobicContact CG-CD1 4.48Å; F635-K659 PolarHBondContact O-N 2.85Å; F635-Q666 HydrophobicContact CD1-CB 4.28Å; F635-Q666 HydrophobicContact CE1-CB 4.33Å; F635-N669 HydrophobicContact CE1-CB 4.07Å; F635-N669 HydrophobicContact CZ-CB 3.93Å; F635-F670 HydrophobicContact CB-CD2 3.52Å; F635-F670 HydrophobicContact CB-CE2 3.84Å; F635-F670 HydrophobicContact CD1-CB 4.33Å; F635-F670 HydrophobicContact CD1-CD2 4.3Å; F635-F670 AromaticContact CD2-CD2 3.84Å; F635-F670 HydrophobicContact CD2-CD2 3.84Å; F635-F670 HydrophobicContact CG-CB 4.44Å; F635-F670 AromaticContact CG-CD2 3.62Å; F635-F670 HydrophobicContact CG-CD2 3.62Å; F635-F670 HydrophobicContact CG-CE2 4.36Å; F635-F670 HydrophobicContact CG-CG 4.48Å
636	G	74	Confident	83.1	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.5	-165.3	-175.4	0	0	0	0	0	114.4	G633 T657	G633-G636 PolarHBondContact N-O 2.85Å; G633-G636 PolarHBondContact O-N 2.88Å; G636-T657 WeakPolarHBondContact CA-O 3.33Å
637	E	84.6	Confident	82.1	Confident	64 Å²	64	61.3 Å²	61.3	30%	0.299	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	145	-178.4	-69	173	-170.4	0	0	110.6	Y639 T657	E637-Y639 HydrophobicContact CB-CD2 4.43Å; E637-Y639 HydrophobicContact CB-CE1 4.48Å; E637-Y639 HydrophobicContact CB-CE2 3.65Å; E637-Y639 VanDerWaalsContact OE2-CZ 3.23Å; E637-Y639 PolarHBondContact OE2-OH 2.84Å; E637-T657 PolarHBondContact O-N 3.35Å; E637-T657 PolarHBondContact O-OG1 3.45Å
638	V	88.6	Confident	81.4	Confident	32 Å²	32	63.1 Å²	63.1	19%	0.194	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126.7	171.1	-169.5	0	0	0	0	107.5	I630 G631 A654 I655 K656	I630-V638 HydrophobicContact CD1-CG1 3.88Å; I630-V638 HydrophobicContact CG1-CB 4.1Å; I630-V638 HydrophobicContact CG1-CG1 3.84Å; I630-V638 VanDerWaalsContact CG1-O 3.27Å; I630-V638 WeakPolarHBondContact CG1-O 3.38Å; I630-V638 PolarHBondContact N-O 3.47Å; G631-V638 PolarHBondContact N-O 2.84Å; G631-V638 PolarHBondContact O-N 3.4Å; V638-A654 HydrophobicContact CG1-CB 4.32Å; V638-I655 CarbonylContact C-O 3.46Å; V638-I655 WeakPolarHBondContact CA-O 3.32Å; V638-K656 HydrophobicContact CG2-CB 4.46Å; V638-K656 HydrophobicContact CG2-CG 4.14Å
639	Y	90.7	Very high	80.7	Confident	50 Å²	50	66.3 Å²	66.3	20%	0.196	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	145.4	179.3	-54.4	-97.5	0	0	0	110.5	V626 T628 V629 E637 A654 I655 T657	V626-Y639 HydrophobicContact CG1-CD1 3.49Å; V626-Y639 VanDerWaalsContact CG1-CD1 3.49Å; V626-Y639 HydrophobicContact CG1-CD2 4.18Å; V626-Y639 HydrophobicContact CG1-CE1 4.22Å; V626-Y639 HydrophobicContact CG1-CG 3.47Å; V626-Y639 VanDerWaalsContact CG1-CG 3.47Å; T628-Y639 CarbonylContact O-C 3.5Å; T628-Y639 VanDerWaalsContact O-CA 3.22Å; T628-Y639 WeakPolarHBondContact O-CA 3.39Å; V629-Y639 HydrophobicContact CB-CD1 4.42Å; V629-Y639 HydrophobicContact CG2-CD1 3.67Å; V629-Y639 HydrophobicContact CG2-CE1 3.41Å; V629-Y639 VanDerWaalsContact CG2-CE1 3.41Å; E637-Y639 HydrophobicContact CB-CD2 4.43Å; E637-Y639 HydrophobicContact CB-CE1 4.48Å; E637-Y639 HydrophobicContact CB-CE2 3.65Å; E637-Y639 VanDerWaalsContact OE2-CZ 3.23Å; E637-Y639 PolarHBondContact OE2-OH 2.84Å; Y639-A654 CarbonylContact O-C 3.23Å; Y639-A654 WeakPolarHBondContact O-CA 3.35Å; Y639-I655 PolarHBondContact N-O 2.85Å; Y639-I655 PolarHBondContact O-N 2.98Å; Y639-T657 HydrophobicContact CD2-CG2 3.92Å; Y639-T657 HydrophobicContact CE2-CG2 3.62Å
640	R	92.9	Very high	80.5	Confident	79 Å²	79	66 Å²	66	30%	0.298	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	139.7	157.5	-175.6	179.7	-176.4	-73.6	-0.7	108.4	D627 T628 I630 T652 F704	D627-R640 WeakPolarHBondContact CA-O 3.26Å; D627-R640 VanDerWaalsContact CB-O 3.32Å; D627-R640 WeakPolarHBondContact CB-O 3.45Å; D627-R640 PolarHBondContact N-O 3.41Å; D627-R640 IonicContact OD2-NH1 3.41Å; D627-R640 PolarHBondContact OD2-NH1 3.29Å; T628-R640 PolarHBondContact N-O 2.93Å; T628-R640 PolarHBondContact O-N 2.96Å; I630-R640 HydrophobicContact CD1-CB 4.41Å; I630-R640 HydrophobicContact CG2-CB 3.63Å; R640-T652 HydrophobicContact CG-CG2 4.13Å; R640-F704 HydrophobicContact CB-CE2 4.16Å; R640-F704 HydrophobicContact CG-CD2 4.17Å; R640-F704 HydrophobicContact CG-CE2 3.92Å; R640-F704 HydrophobicContact CG-CZ 4.18Å
641	G	93.6	Very high	80.7	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	-177.4	175.9	0	0	0	0	0	113.2	M625 T652 V653	M625-G641 CarbonylContact O-C 3.57Å; M625-G641 WeakPolarHBondContact O-CA 3.04Å; G641-T652 WeakPolarHBondContact O-CA 3.28Å; G641-V653 PolarHBondContact N-O 3.14Å; G641-V653 PolarHBondContact O-N 2.86Å
642	T	93.2	Very high	81.3	Confident	23 Å²	23	66.7 Å²	66.7	14%	0.141	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	128.1	177.1	-54.7	0	0	0	0	110.1	M625 R644 C650 K651	M625-T642 PolarHBondContact N-O 3.26Å; M625-T642 PolarHBondContact O-N 2.87Å; T642-R644 HydrophobicContact CG2-CG 4.4Å; T642-C650 HydrophobicContact CG2-CB 3.79Å; T642-K651 CarbonylContact C-O 3.53Å; T642-K651 WeakPolarHBondContact CA-O 3.45Å
643	L	92.7	Very high	82.2	Confident	1 Å²	1	60 Å²	60	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	123.7	173.7	175.2	61.7	0	0	0	110.2	L619 W623 L624 L645 K651 V653 E689	L619-L643 HydrophobicContact CD1-CD1 4.08Å; L619-L643 HydrophobicContact CD1-CD2 4.21Å; L619-L643 HydrophobicContact CD2-CD1 4.46Å; W623-L643 HydrophobicContact CB-CD1 4.1Å; L624-L643 HydrophobicContact CD2-CB 4.13Å; L624-L643 HydrophobicContact CD2-CD1 3.71Å; L624-L643 HydrophobicContact CD2-CG 4.45Å; L624-L643 HydrophobicContact CG-CD1 4.3Å; L643-L645 HydrophobicContact CD1-CD2 4.12Å; L643-L645 HydrophobicContact CD1-CG 4.4Å; L643-L645 HydrophobicContact CD2-CD1 4.36Å; L643-L645 HydrophobicContact CD2-CD2 4.33Å; L643-L645 HydrophobicContact CD2-CG 4.19Å; L643-L645 HydrophobicContact CG-CD2 4.29Å; L643-L645 HydrophobicContact CG-CG 4.08Å; L643-K651 PolarHBondContact N-O 3.13Å; L643-K651 PolarHBondContact O-N 2.91Å; L643-V653 HydrophobicContact CB-CG1 3.7Å; L643-V653 HydrophobicContact CB-CG2 4.02Å; L643-V653 HydrophobicContact CD2-CG1 4.27Å; L643-E689 HydrophobicContact CD2-CB 4.07Å
644	R	90.1	Very high	83.6	Confident	129 Å²	129	59 Å²	59	49%	0.487	31%	0.307	S	S	.	.			trans	-112.3	92.2	178.8	-64	-168.5	171.3	157.3	-0.9	111.1	W623 M625 T642	W623-R644 WeakPolarHBondContact CB-O 3.25Å; W623-R644 PolarHBondContact O-N 3.38Å; M625-R644 VanDerWaalsContact CE-NH2 3.34Å; T642-R644 HydrophobicContact CG2-CG 4.4Å
645	L	82.2	Confident	84.9	Confident	14 Å²	14	51.3 Å²	51.3	7%	0.073	27%	0.271	C	S	.	.			trans	-79.6	145.3	176.6	-66.8	173.8	0	0	0	111	L619 W623 L643 S647 Q648	L619-L645 HydrophobicContact CD2-CD2 4.17Å; W623-L645 HydrophobicContact CE3-CD2 3.88Å; W623-L645 HydrophobicContact CZ3-CD2 4.14Å; L643-L645 HydrophobicContact CD1-CD2 4.12Å; L643-L645 HydrophobicContact CD1-CG 4.4Å; L643-L645 HydrophobicContact CD2-CD1 4.36Å; L643-L645 HydrophobicContact CD2-CD2 4.33Å; L643-L645 HydrophobicContact CD2-CG 4.19Å; L643-L645 HydrophobicContact CG-CD2 4.29Å; L643-L645 HydrophobicContact CG-CG 4.08Å; L645-S647 PolarHBondContact O-N 2.96Å; L645-Q648 HydrophobicContact CB-CB 4.29Å; L645-Q648 PolarHBondContact O-N 3.05Å
646	P	71.3	Confident	86.2	Confident	90 Å²	90	52.5 Å²	52.5	58%	0.584	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	16.9	-176.7	-24.5	34.3	0	0	0	117.7	W623	W623-P646 HydrophobicContact CD2-CG 4.47Å; W623-P646 HydrophobicContact CH2-CG 4.08Å; W623-P646 HydrophobicContact CZ2-CG 3.52Å
647	S	68.9	Low	86.9	Confident	116 Å²	116	53.1 Å²	53.1	81%	0.811	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-166.4	10.7	-175.5	-5.2	0	0	0	0	113.8	L645	L645-S647 PolarHBondContact O-N 2.96Å
648	Q	74.2	Confident	86.8	Confident	109 Å²	109	50.9 Å²	50.9	51%	0.509	27%	0.269	S	S	.	.	S	Bend	trans	-135.3	160	-178.2	-65	-175.6	2.9	0	0	110.3	L645	L645-Q648 HydrophobicContact CB-CB 4.29Å; L645-Q648 PolarHBondContact O-N 3.05Å
649	D	75.1	Confident	86.1	Confident	148 Å²	148	53 Å²	53	79%	0.791	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-59.8	153.6	171.8	-67.3	-40	0	0	0	111.4	K651	D649-K651 PolarHBondContact O-N 2.63Å
650	C	84.8	Confident	84.8	Confident	77 Å²	77	56.1 Å²	56.1	52%	0.52	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-59.9	121.7	176	-67.1	0	0	0	0	109.6	T642	T642-C650 HydrophobicContact CG2-CB 3.79Å
651	K	89.1	Confident	83	Confident	69 Å²	69	58.5 Å²	58.5	30%	0.3	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	138.9	176.8	-68.1	-176.2	177.4	-174	0	110.7	T642 L643 D649 V653 E689	T642-K651 CarbonylContact C-O 3.53Å; T642-K651 WeakPolarHBondContact CA-O 3.45Å; L643-K651 PolarHBondContact N-O 3.13Å; L643-K651 PolarHBondContact O-N 2.91Å; D649-K651 PolarHBondContact O-N 2.63Å; K651-V653 HydrophobicContact CB-CG1 4.4Å; K651-E689 WeakPolarHBondContact CD-OE1 3.35Å; K651-E689 VanDerWaalsContact NZ-CD 3.25Å; K651-E689 IonicContact NZ-OE1 3.17Å; K651-E689 PolarHBondContact NZ-OE1 2.81Å; K651-E689 IonicContact NZ-OE2 2.66Å; K651-E689 PolarHBondContact NZ-OE2 3.38Å
652	T	92.4	Very high	81.1	Confident	54 Å²	54	60.1 Å²	60.1	33%	0.331	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	131.7	167.3	-53.6	0	0	0	0	108.6	R640 G641 F704	R640-T652 HydrophobicContact CG-CG2 4.13Å; G641-T652 WeakPolarHBondContact O-CA 3.28Å; T652-F704 HydrophobicContact CG2-CB 3.73Å; T652-F704 HydrophobicContact CG2-CD1 3.65Å; T652-F704 HydrophobicContact CG2-CE1 4.41Å; T652-F704 HydrophobicContact CG2-CG 3.72Å
653	V	94.6	Very high	79.2	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	156.7	-174.9	-66.2	0	0	0	0	111.6	L624 G641 L643 K651 I655 E689 I701 T702	L624-V653 HydrophobicContact CD2-CG2 4.33Å; G641-V653 PolarHBondContact N-O 3.14Å; G641-V653 PolarHBondContact O-N 2.86Å; L643-V653 HydrophobicContact CB-CG1 3.7Å; L643-V653 HydrophobicContact CB-CG2 4.02Å; L643-V653 HydrophobicContact CD2-CG1 4.27Å; K651-V653 HydrophobicContact CB-CG1 4.4Å; V653-I655 HydrophobicContact CG2-CD1 4.23Å; V653-I655 HydrophobicContact CG2-CG1 3.96Å; V653-E689 HydrophobicContact CG1-CG 4.24Å; V653-I701 HydrophobicContact CB-CG2 3.64Å; V653-I701 HydrophobicContact CG1-CG2 3.86Å; V653-I701 HydrophobicContact CG2-CG2 3.84Å; V653-T702 WeakPolarHBondContact CA-O 3.45Å; V653-T702 WeakPolarHBondContact CB-O 3.37Å
654	A	94.4	Very high	77.3	Confident	11 Å²	11	66.9 Å²	66.9	9%	0.091	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	130.6	165.3	0	0	0	0	0	109.2	I630 V638 Y639 I701 T702 F704	I630-A654 HydrophobicContact CD1-CB 4.27Å; V638-A654 HydrophobicContact CG1-CB 4.32Å; Y639-A654 CarbonylContact O-C 3.23Å; Y639-A654 WeakPolarHBondContact O-CA 3.35Å; A654-I701 WeakPolarHBondContact O-CA 3.47Å; A654-T702 PolarHBondContact N-O 3.25Å; A654-T702 PolarHBondContact O-N 3.31Å; A654-F704 HydrophobicContact CB-CD2 4.42Å
655	I	92.9	Very high	75.7	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	105.8	-175.1	-54.5	172.7	0	0	0	107.6	L624 V626 V638 Y639 V653 T657 M699 I701	L624-I655 HydrophobicContact CB-CD1 4.49Å; L624-I655 HydrophobicContact CD2-CD1 4.15Å; V626-I655 HydrophobicContact CG2-CD1 3.93Å; V638-I655 CarbonylContact C-O 3.46Å; V638-I655 WeakPolarHBondContact CA-O 3.32Å; Y639-I655 PolarHBondContact N-O 2.85Å; Y639-I655 PolarHBondContact O-N 2.98Å; V653-I655 HydrophobicContact CG2-CD1 4.23Å; V653-I655 HydrophobicContact CG2-CG1 3.96Å; I655-T657 HydrophobicContact CG2-CG2 4.34Å; I655-M699 HydrophobicContact CG2-CB 4.07Å; I655-M699 HydrophobicContact CG2-CG 4.29Å; I655-M699 HydrophobicContact CG2-SD 3.75Å; I655-I701 HydrophobicContact CG1-CG1 4.36Å
656	K	90.5	Very high	74.8	Confident	36 Å²	36	65 Å²	65	16%	0.157	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125.9	175.5	-169.5	-178.8	-170.7	177.3	0	108.5	V638 F670 E673 M699 I700	V638-K656 HydrophobicContact CG2-CB 4.46Å; V638-K656 HydrophobicContact CG2-CG 4.14Å; K656-F670 HydrophobicContact CB-CZ 4.48Å; K656-F670 HydrophobicContact CD-CE2 3.87Å; K656-F670 HydrophobicContact CG-CE2 3.82Å; K656-F670 HydrophobicContact CG-CZ 4.2Å; K656-E673 VanDerWaalsContact NZ-CD 3.33Å; K656-E673 IonicContact NZ-OE1 3.77Å; K656-E673 PolarHBondContact NZ-OE1 3.43Å; K656-E673 VanDerWaalsContact NZ-OE1 3.14Å; K656-E673 IonicContact NZ-OE2 3.68Å; K656-E673 PolarHBondContact NZ-OE2 2.98Å; K656-M699 CarbonylContact O-C 3.59Å; K656-M699 WeakPolarHBondContact O-CA 3.24Å; K656-I700 HydrophobicContact CB-CB 4.4Å; K656-I700 PolarHBondContact N-O 2.87Å; K656-I700 PolarHBondContact O-N 2.96Å
657	T	88.2	Confident	74.7	Confident	13 Å²	13	64.7 Å²	64.7	8%	0.08	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	151.3	-179.7	67.5	0	0	0	0	112	G636 E637 Y639 I655 P697 I698 M699	G636-T657 WeakPolarHBondContact CA-O 3.33Å; E637-T657 PolarHBondContact O-N 3.35Å; E637-T657 PolarHBondContact O-OG1 3.45Å; Y639-T657 HydrophobicContact CD2-CG2 3.92Å; Y639-T657 HydrophobicContact CE2-CG2 3.62Å; I655-T657 HydrophobicContact CG2-CG2 4.34Å; T657-P697 HydrophobicContact CG2-CG 4.4Å; T657-I698 WeakPolarHBondContact CA-O 3.17Å; T657-M699 HydrophobicContact CG2-CG 4.14Å
658	L	83.5	Confident	74.8	Confident	17 Å²	17	61.6 Å²	61.6	9%	0.089	35%	0.354	C	S	.	.			trans	-96.5	121.9	172.9	-175.1	66.4	0	0	0	110.5	F635 W667 F670 I698	F635-L658 HydrophobicContact CB-CD1 3.91Å; F635-L658 HydrophobicContact CD1-CD1 4.24Å; F635-L658 HydrophobicContact CG-CD1 4.48Å; L658-W667 HydrophobicContact CD2-CB 4Å; L658-F670 HydrophobicContact CB-CD1 4Å; L658-F670 HydrophobicContact CB-CE1 3.89Å; L658-F670 HydrophobicContact CB-CG 4.37Å; L658-F670 HydrophobicContact CB-CZ 4.16Å; L658-F670 HydrophobicContact CD1-CB 4.15Å; L658-F670 HydrophobicContact CD1-CD1 4.44Å; L658-F670 HydrophobicContact CD1-CD2 4.22Å; L658-F670 HydrophobicContact CD1-CG 4.03Å; L658-F670 HydrophobicContact CD2-CD1 4.26Å; L658-F670 HydrophobicContact CG-CD1 4.47Å; L658-I698 HydrophobicContact CB-CB 4.27Å; L658-I698 HydrophobicContact CD2-CB 4.48Å; L658-I698 HydrophobicContact CD2-CD1 4.32Å; L658-I698 PolarHBondContact N-O 2.91Å
659	K	72.8	Confident	74.7	Confident	77 Å²	77	60 Å²	60	34%	0.335	35%	0.349	S	S	.	.			trans	-68.7	135.9	179.1	-74.3	175.2	178.2	172.9	0	112	E632 F635 T661 S662	E632-K659 IonicContact OE1-NZ 2.67Å; E632-K659 PolarHBondContact OE1-NZ 2.79Å; F635-K659 PolarHBondContact O-N 2.85Å; K659-T661 PolarHBondContact O-N 2.91Å; K659-T661 VanDerWaalsContact O-N 3.15Å; K659-S662 PolarHBondContact O-N 3.07Å; K659-S662 PolarHBondContact O-OG 3.37Å
660	D	63.4	Low	74.8	Confident	116 Å²	116	53 Å²	53	62%	0.62	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-11.9	-174.5	-107.5	-26.2	0	0	0	115.3	K696	D660-K696 WeakPolarHBondContact OD1-CD 3.45Å; D660-K696 WeakPolarHBondContact OD1-CE 3.23Å; D660-K696 IonicContact OD1-NZ 3.74Å; D660-K696 PolarHBondContact OD1-NZ 2.85Å
661	T	54.5	Low	74.6	Confident	128 Å²	128	49.4 Å²	49.4	79%	0.785	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	4.2	-176.7	50.9	0	0	0	0	114.5	K659	K659-T661 PolarHBondContact O-N 2.91Å; K659-T661 VanDerWaalsContact O-N 3.15Å
662	S	54	Low	74.1	Confident	34 Å²	34	47.1 Å²	47.1	24%	0.238	28%	0.277	C	S	.	.			trans	-78.9	126.2	-171.6	-52.1	0	0	0	0	111.3	K659 Q666	K659-S662 PolarHBondContact O-N 3.07Å; K659-S662 PolarHBondContact O-OG 3.37Å; S662-Q666 PolarHBondContact OG-OE1 3.3Å
663	P	53.8	Low	73.5	Confident	97 Å²	97	45.1 Å²	45.1	63%	0.63	26%	0.263	S	S	*	.			trans	-58.5	146.6	176.6	22.7	-30.7	0	0	0	110.3	G665 Q666	P663-G665 PolarHBondContact O-N 3.15Å; P663-Q666 PolarHBondContact O-N 3.42Å
664	G	52	Low	73.1	Confident	70 Å²	70	45.1 Å²	45.1	72%	0.722	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	23.7	-162.7	0	0	0	0	0	119.9	W667	G664-W667 PolarHBondContact O-NE1 3.06Å
665	G	56.3	Low	72.5	Confident	43 Å²	43	44.8 Å²	44.8	44%	0.443	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-18.3	171.7	0	0	0	0	0	115.5	P663	P663-G665 PolarHBondContact O-N 3.15Å
666	Q	63.7	Low	71.9	Confident	59 Å²	59	44.9 Å²	44.9	28%	0.276	26%	0.261	S	S	.	.	H	α-helix	trans	-73.5	-28.3	-175.9	-71.5	-170.5	14.6	0	0	114.4	F635 S662 P663 W668 N669 F670	F635-Q666 HydrophobicContact CD1-CB 4.28Å; F635-Q666 HydrophobicContact CE1-CB 4.33Å; S662-Q666 PolarHBondContact OG-OE1 3.3Å; P663-Q666 PolarHBondContact O-N 3.42Å; Q666-W668 VanDerWaalsContact C-N 3.3Å; Q666-W668 PolarHBondContact O-N 3.38Å; Q666-N669 PolarHBondContact O-N 3.03Å; Q666-F670 PolarHBondContact O-N 3.13Å; Q666-F670 VanDerWaalsContact O-N 3.07Å
667	W	70.8	Confident	71.6	Confident	85 Å²	85	43.3 Å²	43.3	32%	0.322	25%	0.254	S	S	.	.	H	α-helix	trans	-57.5	-36.1	176.3	68.7	-37	0	0	0	114.3	P608 L658 G664 L671	P608-W667 VanDerWaalsContact CD-CZ3 3.42Å; P608-W667 HydrophobicContact CG-CD2 3.78Å; P608-W667 HydrophobicContact CG-CE3 3.54Å; P608-W667 HydrophobicContact CG-CH2 3.61Å; P608-W667 HydrophobicContact CG-CZ2 3.86Å; P608-W667 HydrophobicContact CG-CZ3 3.46Å; P608-W667 VanDerWaalsContact CG-CZ3 3.46Å; L658-W667 HydrophobicContact CD2-CB 4Å; G664-W667 PolarHBondContact O-NE1 3.06Å; W667-L671 PolarHBondContact O-N 2.75Å; W667-L671 VanDerWaalsContact O-N 3.13Å
668	W	70.6	Confident	71.4	Confident	50 Å²	50	44.1 Å²	44.1	19%	0.189	27%	0.265	C	S	.	.	H	α-helix	trans	-64.2	-47.4	176.2	-74.8	114.6	0	0	0	112	L602 Y605 P608 Q666 F670 R672	L602-W668 HydrophobicContact CB-CE3 3.66Å; L602-W668 HydrophobicContact CB-CZ3 3.59Å; L602-W668 WeakPolarHBondContact O-CH2 3.07Å; L602-W668 WeakPolarHBondContact O-CZ3 3.36Å; Y605-W668 VanDerWaalsContact O-CH2 3.26Å; Y605-W668 WeakPolarHBondContact O-CH2 3.08Å; P608-W668 VanDerWaalsContact CA-CZ3 3.41Å; P608-W668 HydrophobicContact CB-CD2 4.11Å; P608-W668 HydrophobicContact CB-CE3 3.41Å; P608-W668 VanDerWaalsContact CB-CE3 3.41Å; P608-W668 HydrophobicContact CB-CH2 3.71Å; P608-W668 HydrophobicContact CB-CZ2 4.39Å; P608-W668 HydrophobicContact CB-CZ3 3.14Å; P608-W668 HydrophobicContact CG-CD2 3.78Å; P608-W668 HydrophobicContact CG-CE3 3.59Å; P608-W668 HydrophobicContact CG-CH2 3.44Å; P608-W668 VanDerWaalsContact CG-CH2 3.44Å; P608-W668 HydrophobicContact CG-CZ2 3.67Å; P608-W668 HydrophobicContact CG-CZ3 3.38Å; Q666-W668 VanDerWaalsContact C-N 3.3Å; Q666-W668 PolarHBondContact O-N 3.38Å; W668-F670 VanDerWaalsContact C-N 3.33Å; W668-R672 WeakPolarHBondContact O-CB 3Å; W668-R672 PolarHBondContact O-N 3.48Å
669	N	70.6	Confident	71.4	Confident	76 Å²	76	44 Å²	44	41%	0.406	26%	0.264	S	S	.	.	H	α-helix	trans	-67.6	-36.8	-179.6	-69.9	-21.8	0	0	0	111.5	F635 Q666 E673	F635-N669 HydrophobicContact CE1-CB 4.07Å; F635-N669 HydrophobicContact CZ-CB 3.93Å; Q666-N669 PolarHBondContact O-N 3.03Å; N669-E673 PolarHBondContact O-N 3.14Å
670	F	77.9	Confident	72.1	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-60.8	-55.5	176.5	-170.6	-109.8	0	0	0	111.9	F635 K656 L658 Q666 W668 R672 E673 I698 I700	F635-F670 HydrophobicContact CB-CD2 3.52Å; F635-F670 HydrophobicContact CB-CE2 3.84Å; F635-F670 HydrophobicContact CD1-CB 4.33Å; F635-F670 HydrophobicContact CD1-CD2 4.3Å; F635-F670 AromaticContact CD2-CD2 3.84Å; F635-F670 HydrophobicContact CD2-CD2 3.84Å; F635-F670 HydrophobicContact CG-CB 4.44Å; F635-F670 AromaticContact CG-CD2 3.62Å; F635-F670 HydrophobicContact CG-CD2 3.62Å; F635-F670 HydrophobicContact CG-CE2 4.36Å; F635-F670 HydrophobicContact CG-CG 4.48Å; K656-F670 HydrophobicContact CB-CZ 4.48Å; K656-F670 HydrophobicContact CD-CE2 3.87Å; K656-F670 HydrophobicContact CG-CE2 3.82Å; K656-F670 HydrophobicContact CG-CZ 4.2Å; L658-F670 HydrophobicContact CB-CD1 4Å; L658-F670 HydrophobicContact CB-CE1 3.89Å; L658-F670 HydrophobicContact CB-CG 4.37Å; L658-F670 HydrophobicContact CB-CZ 4.16Å; L658-F670 HydrophobicContact CD1-CB 4.15Å; L658-F670 HydrophobicContact CD1-CD1 4.44Å; L658-F670 HydrophobicContact CD1-CD2 4.22Å; L658-F670 HydrophobicContact CD1-CG 4.03Å; L658-F670 HydrophobicContact CD2-CD1 4.26Å; L658-F670 HydrophobicContact CG-CD1 4.47Å; Q666-F670 PolarHBondContact O-N 3.13Å; Q666-F670 VanDerWaalsContact O-N 3.07Å; W668-F670 VanDerWaalsContact C-N 3.33Å; F670-R672 VanDerWaalsContact C-N 3.3Å; F670-R672 PolarHBondContact O-N 3.31Å; F670-E673 WeakPolarHBondContact O-CB 3.05Å; F670-E673 PolarHBondContact O-N 2.97Å; F670-I698 HydrophobicContact CD1-CG2 4.1Å; F670-I698 HydrophobicContact CE1-CB 4.5Å; F670-I698 HydrophobicContact CE1-CG2 3.94Å; F670-I700 HydrophobicContact CD1-CD1 3.88Å; F670-I700 HydrophobicContact CD1-CG1 4.22Å; F670-I700 HydrophobicContact CD2-CD1 4.03Å; F670-I700 HydrophobicContact CE1-CD1 3.68Å; F670-I700 HydrophobicContact CE1-CG1 3.62Å; F670-I700 HydrophobicContact CE2-CD1 3.86Å; F670-I700 HydrophobicContact CE2-CG1 4.42Å; F670-I700 HydrophobicContact CG-CD1 4.06Å; F670-I700 HydrophobicContact CZ-CB 4.36Å; F670-I700 HydrophobicContact CZ-CD1 3.67Å; F670-I700 HydrophobicContact CZ-CG1 3.74Å; F670-I700 WeakPolarHBondContact O-CD1 3.21Å
671	L	81.1	Confident	73.3	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-70.6	-26	-178.7	-70.9	173.1	0	0	0	113.2	P608 A612 W667 E673 A674 T675 T693 I698	P608-L671 HydrophobicContact CB-CD1 3.89Å; A612-L671 HydrophobicContact CB-CB 4.32Å; A612-L671 HydrophobicContact CB-CD2 4.45Å; W667-L671 PolarHBondContact O-N 2.75Å; W667-L671 VanDerWaalsContact O-N 3.13Å; L671-E673 VanDerWaalsContact C-N 3.3Å; L671-E673 PolarHBondContact O-N 3.44Å; L671-A674 PolarHBondContact O-N 3.15Å; L671-T675 PolarHBondContact O-N 3.28Å; L671-T675 PolarHBondContact O-OG1 3.44Å; L671-T693 HydrophobicContact CD2-CG2 3.8Å; L671-I698 HydrophobicContact CD2-CG2 3.93Å
672	R	77.9	Confident	75.2	Confident	22 Å²	22	35.5 Å²	35.5	8%	0.083	22%	0.223	C	C	.	.	H	α-helix	trans	-61.4	-37.4	174.1	-173.8	164.9	-179.7	-90.8	-23	112.9	Y599 L602 W668 F670 A674 T675 I676 T771 R772	Y599-R672 PolarHBondContact OH-NE 3.26Å; Y599-R672 PolarHBondContact OH-NH2 3.13Å; L602-R672 HydrophobicContact CD1-CB 3.84Å; L602-R672 HydrophobicContact CD1-CG 4.37Å; W668-R672 WeakPolarHBondContact O-CB 3Å; W668-R672 PolarHBondContact O-N 3.48Å; F670-R672 VanDerWaalsContact C-N 3.3Å; F670-R672 PolarHBondContact O-N 3.31Å; R672-A674 VanDerWaalsContact C-N 3.33Å; R672-T675 PolarHBondContact O-N 2.68Å; R672-I676 HydrophobicContact CG-CD1 4.18Å; R672-I676 WeakPolarHBondContact O-CG1 3.38Å; R672-I676 PolarHBondContact O-N 3.34Å; R672-T771 PolarHBondContact NH2-O 3.01Å; R672-R772 VanDerWaalsContact CZ-NH1 3.31Å; R672-R772 VanDerWaalsContact NH2-NE 3.11Å
673	E	81.1	Confident	77.1	Confident	12 Å²	12	37.8 Å²	37.8	6%	0.056	24%	0.238	C	C	.	.	H	α-helix	trans	-58.7	-46.9	173.9	-164.7	-172.1	156.9	0	0	110.5	K656 N669 F670 L671 I676 M677 F768	K656-E673 VanDerWaalsContact NZ-CD 3.33Å; K656-E673 IonicContact NZ-OE1 3.77Å; K656-E673 PolarHBondContact NZ-OE1 3.43Å; K656-E673 VanDerWaalsContact NZ-OE1 3.14Å; K656-E673 IonicContact NZ-OE2 3.68Å; K656-E673 PolarHBondContact NZ-OE2 2.98Å; N669-E673 PolarHBondContact O-N 3.14Å; F670-E673 WeakPolarHBondContact O-CB 3.05Å; F670-E673 PolarHBondContact O-N 2.97Å; L671-E673 VanDerWaalsContact C-N 3.3Å; L671-E673 PolarHBondContact O-N 3.44Å; E673-I676 PolarHBondContact O-N 3.25Å; E673-M677 HydrophobicContact CG-CE 3.94Å; E673-M677 WeakPolarHBondContact O-CG 3.39Å; E673-M677 PolarHBondContact O-N 2.75Å; E673-F768 HydrophobicContact CG-CB 4.24Å
674	A	84.6	Confident	79.2	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-42.6	177.7	0	0	0	0	0	112.6	T616 L671 R672 I676 M677 G678 L688 V691 I700	T616-A674 HydrophobicContact CG2-CB 4.26Å; T616-A674 WeakPolarHBondContact CG2-O 3.1Å; L671-A674 PolarHBondContact O-N 3.15Å; R672-A674 VanDerWaalsContact C-N 3.33Å; A674-I676 VanDerWaalsContact C-N 3.3Å; A674-I676 PolarHBondContact O-N 3.39Å; A674-M677 PolarHBondContact O-N 2.82Å; A674-G678 PolarHBondContact O-N 3.15Å; A674-L688 HydrophobicContact CB-CD1 4.44Å; A674-L688 HydrophobicContact CB-CD2 4.23Å; A674-L688 WeakPolarHBondContact O-CD2 3.44Å; A674-V691 HydrophobicContact CB-CG1 3.62Å; A674-I700 HydrophobicContact CB-CD1 3.94Å; A674-I700 HydrophobicContact CB-CG1 3.99Å; A674-I700 HydrophobicContact CB-CG2 4.19Å
675	T	82.1	Confident	81.2	Confident	4 Å²	4	31.5 Å²	31.5	3%	0.025	18%	0.181	C	C	.	.	H	α-helix	trans	-61.2	-39.7	177.1	-56.1	0	0	0	0	111.8	F615 L671 R672 Q679	F615-T675 HydrophobicContact CB-CG2 4.1Å; F615-T675 HydrophobicContact CD2-CG2 3.69Å; F615-T675 HydrophobicContact CE2-CG2 4.35Å; F615-T675 HydrophobicContact CG-CG2 3.98Å; L671-T675 PolarHBondContact O-N 3.28Å; L671-T675 PolarHBondContact O-OG1 3.44Å; R672-T675 PolarHBondContact O-N 2.68Å; T675-Q679 WeakPolarHBondContact O-CG 3.1Å; T675-Q679 PolarHBondContact O-NE2 3.26Å
676	I	80.6	Confident	83.1	Confident	2 Å²	2	30 Å²	30	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-67.8	-48	176.4	-67.9	170.7	0	0	0	110.3	R672 E673 A674 G678 Q679 F680 Y745 F768 T771	R672-I676 HydrophobicContact CG-CD1 4.18Å; R672-I676 WeakPolarHBondContact O-CG1 3.38Å; R672-I676 PolarHBondContact O-N 3.34Å; E673-I676 PolarHBondContact O-N 3.25Å; A674-I676 VanDerWaalsContact C-N 3.3Å; A674-I676 PolarHBondContact O-N 3.39Å; I676-G678 VanDerWaalsContact C-N 3.34Å; I676-G678 PolarHBondContact O-N 3.45Å; I676-Q679 WeakPolarHBondContact O-CB 3.46Å; I676-Q679 PolarHBondContact O-N 2.83Å; I676-F680 HydrophobicContact CG2-CD2 4.36Å; I676-F680 HydrophobicContact CG2-CE2 3.43Å; I676-F680 VanDerWaalsContact CG2-CE2 3.43Å; I676-F680 HydrophobicContact CG2-CZ 3.89Å; I676-F680 WeakPolarHBondContact O-CD2 3.04Å; I676-F680 WeakPolarHBondContact O-CE2 3.39Å; I676-Y745 HydrophobicContact CG2-CE1 4.46Å; I676-F768 HydrophobicContact CB-CB 4.28Å; I676-F768 HydrophobicContact CG2-CB 3.87Å; I676-F768 HydrophobicContact CG2-CD1 3.89Å; I676-F768 HydrophobicContact CG2-CG 4.02Å; I676-T771 HydrophobicContact CD1-CG2 4.3Å; I676-T771 HydrophobicContact CG2-CG2 3.95Å
677	M	85	Confident	84.4	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.01	17%	0.166	C	C	.	.	H	α-helix	trans	-61.8	-39.7	178.5	-71.7	-173.7	-63.6	0	0	112.9	E673 A674 Q679 F680 L686 L688 I700 T702 F768	E673-M677 HydrophobicContact CG-CE 3.94Å; E673-M677 WeakPolarHBondContact O-CG 3.39Å; E673-M677 PolarHBondContact O-N 2.75Å; A674-M677 PolarHBondContact O-N 2.82Å; M677-Q679 PolarHBondContact O-N 3.04Å; M677-Q679 VanDerWaalsContact O-N 3.1Å; M677-F680 PolarHBondContact O-N 3.14Å; M677-L686 HydrophobicContact SD-CD2 4.48Å; M677-L688 HydrophobicContact CB-CB 4.03Å; M677-L688 HydrophobicContact CE-CD1 4.24Å; M677-I700 HydrophobicContact CE-CG2 3.83Å; M677-T702 HydrophobicContact CE-CG2 4.22Å; M677-T702 HydrophobicContact SD-CG2 4.34Å; M677-F768 HydrophobicContact CG-CB 4.49Å; M677-F768 HydrophobicContact CG-CD2 3.26Å; M677-F768 HydrophobicContact CG-CE2 3.72Å; M677-F768 HydrophobicContact CG-CG 4.09Å; M677-F768 HydrophobicContact SD-CD2 3.86Å; M677-F768 HydrophobicContact SD-CE2 4.27Å
678	G	84.3	Confident	85.5	Confident	31 Å²	31	27.6 Å²	27.6	32%	0.32	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.4	-180	0	0	0	0	0	114.4	F615 A674 I676	F615-G678 CarbonylContact O-C 3.52Å; F615-G678 WeakPolarHBondContact O-CA 3.43Å; A674-G678 PolarHBondContact O-N 3.15Å; I676-G678 VanDerWaalsContact C-N 3.34Å; I676-G678 PolarHBondContact O-N 3.45Å
679	Q	83	Confident	86.5	Confident	14 Å²	14	26.5 Å²	26.5	7%	0.065	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-17	174.1	-72.3	169.5	87.9	0	0	112.6	L596 F615 T675 I676 M677 Y745	L596-Q679 HydrophobicContact CD2-CB 3.87Å; L596-Q679 HydrophobicContact CD2-CG 4.49Å; L596-Q679 WeakPolarHBondContact CD2-O 3.5Å; F615-Q679 HydrophobicContact CB-CG 4.38Å; F615-Q679 HydrophobicContact CD1-CG 3.41Å; F615-Q679 VanDerWaalsContact CD1-CG 3.41Å; F615-Q679 HydrophobicContact CE1-CG 3.96Å; F615-Q679 HydrophobicContact CG-CG 4.21Å; T675-Q679 WeakPolarHBondContact O-CG 3.1Å; T675-Q679 PolarHBondContact O-NE2 3.26Å; I676-Q679 WeakPolarHBondContact O-CB 3.46Å; I676-Q679 PolarHBondContact O-N 2.83Å; M677-Q679 PolarHBondContact O-N 3.04Å; M677-Q679 VanDerWaalsContact O-N 3.1Å; Q679-Y745 PolarHBondContact OE1-OH 2.79Å; Q679-Y745 VanDerWaalsContact OE1-OH 3.06Å
680	F	87.3	Confident	87.5	Confident	9 Å²	9	22.9 Å²	22.9	4%	0.039	13%	0.133	C	C	.	.			trans	-103.2	136.2	-171.8	-55.2	-38.2	0	0	0	112.4	I676 M677 I685 Y739 L740 Y745 F768	I676-F680 HydrophobicContact CG2-CD2 4.36Å; I676-F680 HydrophobicContact CG2-CE2 3.43Å; I676-F680 VanDerWaalsContact CG2-CE2 3.43Å; I676-F680 HydrophobicContact CG2-CZ 3.89Å; I676-F680 WeakPolarHBondContact O-CD2 3.04Å; I676-F680 WeakPolarHBondContact O-CE2 3.39Å; M677-F680 PolarHBondContact O-N 3.14Å; F680-I685 HydrophobicContact CB-CD1 4.23Å; F680-I685 HydrophobicContact CB-CG2 3.84Å; F680-I685 HydrophobicContact CD2-CG2 4.17Å; F680-I685 HydrophobicContact CG-CD1 4.41Å; F680-I685 HydrophobicContact CG-CG2 4.44Å; F680-Y739 HydrophobicContact CB-CE1 4.07Å; F680-Y739 AromaticContact CD1-CE1 3.8Å; F680-Y739 HydrophobicContact CD1-CE1 3.8Å; F680-Y739 HydrophobicContact CG-CE1 4.18Å; F680-L740 HydrophobicContact CD1-CD2 4.32Å; F680-L740 HydrophobicContact CD2-CD2 3.73Å; F680-L740 HydrophobicContact CE1-CD2 4Å; F680-L740 HydrophobicContact CE2-CD2 3.34Å; F680-L740 HydrophobicContact CG-CD2 4.2Å; F680-L740 HydrophobicContact CZ-CD2 3.51Å; F680-Y745 AromaticContact CE1-CD2 3.68Å; F680-Y745 HydrophobicContact CE1-CD2 3.68Å; F680-Y745 AromaticContact CE1-CE2 3.67Å; F680-Y745 HydrophobicContact CE1-CE2 3.67Å; F680-Y745 HydrophobicContact CE1-CG 4.21Å; F680-Y745 AromaticContact CZ-CD1 3.85Å; F680-Y745 HydrophobicContact CZ-CD1 3.85Å; F680-Y745 AromaticContact CZ-CD2 3.62Å; F680-Y745 HydrophobicContact CZ-CD2 3.62Å; F680-Y745 AromaticContact CZ-CE1 3.97Å; F680-Y745 HydrophobicContact CZ-CE1 3.97Å; F680-Y745 AromaticContact CZ-CE2 3.79Å; F680-Y745 HydrophobicContact CZ-CE2 3.79Å; F680-Y745 AromaticContact CZ-CG 3.65Å; F680-Y745 HydrophobicContact CZ-CG 3.65Å; F680-Y745 AromaticContact CZ-CZ 3.95Å; F680-F768 HydrophobicContact CD2-CE1 4.18Å; F680-F768 HydrophobicContact CD2-CZ 4.39Å; F680-F768 HydrophobicContact CE2-CD1 4.13Å; F680-F768 AromaticContact CE2-CE1 3.94Å; F680-F768 HydrophobicContact CE2-CE1 3.94Å
681	S	88.6	Confident	88.1	Confident	96 Å²	96	22.9 Å²	22.9	67%	0.671	13%	0.133	S	C	*	.			trans	-134.6	94.9	171.6	-168.4	0	0	0	0	108.4	Y739	S681-Y739 PolarHBondContact N-OH 2.96Å
682	H	94.2	Very high	88.6	Confident	37 Å²	37	22.9 Å²	22.9	17%	0.171	13%	0.133	C	C	.	.			trans	-152.9	139.7	-178.4	-175.6	-90.6	0	0	0	109.8	H684 I685 S735 Y739	H682-H684 AromaticContact CE1-CD2 3.86Å; H682-H684 PolarHBondContact ND1-N 3.36Å; H682-H684 PolarHBondContact O-N 3.02Å; H682-H684 VanDerWaalsContact O-N 3.1Å; H682-I685 HydrophobicContact CB-CB 4.2Å; H682-I685 HydrophobicContact CB-CD1 4.03Å; H682-I685 HydrophobicContact CB-CG1 4.1Å; H682-I685 PolarHBondContact O-N 3.09Å; H682-I685 VanDerWaalsContact O-N 3.08Å; H682-S735 PolarHBondContact CE1-O 2.98Å; H682-S735 PolarHBondContact CE1-OG 2.04Å; H682-S735 VanDerWaalsContact CE1-OG 3.27Å; H682-S735 PolarHBondContact NE2-OG 2.83Å; H682-Y739 HydrophobicContact CB-CD1 4.1Å; H682-Y739 HydrophobicContact CB-CD2 3.91Å; H682-Y739 HydrophobicContact CB-CE1 4.32Å; H682-Y739 HydrophobicContact CB-CE2 4.12Å; H682-Y739 HydrophobicContact CB-CG 3.88Å; H682-Y739 AromaticContact CD2-CD2 3.5Å; H682-Y739 AromaticContact CD2-CG 3.75Å; H682-Y739 AromaticContact CG-CD2 3.92Å; H682-Y739 AromaticContact CG-CG 3.85Å
683	P	94.6	Very high	89.1	Confident	83 Å²	83	22.6 Å²	22.6	54%	0.539	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-23.8	-175.7	22.6	-35.2	0	0	0	114.5	K764	P683-K764 WeakPolarHBondContact O-CE 3.39Å
684	H	96.8	Very high	89.2	Confident	31 Å²	31	29.7 Å²	29.7	14%	0.144	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	21	178.4	-60.7	-68.3	0	0	0	114.2	H682 G732 C762 C763 K764 V765	H682-H684 AromaticContact CE1-CD2 3.86Å; H682-H684 PolarHBondContact ND1-N 3.36Å; H682-H684 PolarHBondContact O-N 3.02Å; H682-H684 VanDerWaalsContact O-N 3.1Å; H684-G732 WeakPolarHBondContact CB-O 3.28Å; H684-G732 VanDerWaalsContact CE1-CA 3.46Å; H684-G732 WeakPolarHBondContact CE1-CA 3.3Å; H684-G732 WeakPolarHBondContact ND1-CA 3.45Å; H684-C762 PolarHBondContact CE1-SG 3.01Å; H684-C762 PolarHBondContact ND1-SG 2.6Å; H684-C763 PolarHBondContact ND1-O 3.4Å; H684-K764 WeakPolarHBondContact O-CA 3.33Å; H684-V765 PolarHBondContact O-N 2.86Å
685	I	95	Very high	89	Confident	3 Å²	3	37.4 Å²	37.4	2%	0.015	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-122.2	136.7	169.9	-67	-179.5	0	0	0	107.7	F680 H682 H687 Y739 L740 F768	F680-I685 HydrophobicContact CB-CD1 4.23Å; F680-I685 HydrophobicContact CB-CG2 3.84Å; F680-I685 HydrophobicContact CD2-CG2 4.17Å; F680-I685 HydrophobicContact CG-CD1 4.41Å; F680-I685 HydrophobicContact CG-CG2 4.44Å; H682-I685 HydrophobicContact CB-CB 4.2Å; H682-I685 HydrophobicContact CB-CD1 4.03Å; H682-I685 HydrophobicContact CB-CG1 4.1Å; H682-I685 PolarHBondContact O-N 3.09Å; H682-I685 VanDerWaalsContact O-N 3.08Å; I685-H687 PolarHBondContact O-N 3.48Å; I685-Y739 HydrophobicContact CD1-CD1 3.35Å; I685-Y739 HydrophobicContact CD1-CE1 3.96Å; I685-Y739 HydrophobicContact CD1-CG 4.13Å; I685-L740 HydrophobicContact CD1-CD1 4.5Å; I685-L740 HydrophobicContact CD1-CD2 3.67Å; I685-L740 HydrophobicContact CD1-CG 3.76Å; I685-F768 HydrophobicContact CG2-CE2 4.27Å; I685-F768 HydrophobicContact CG2-CZ 3.79Å
686	L	94.7	Very high	88.9	Confident	11 Å²	11	44.7 Å²	44.7	6%	0.058	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-60.3	126	-178.3	-173.4	68.4	0	0	0	110.9	M677 T702 E703 M705 L756 V765	M677-L686 HydrophobicContact SD-CD2 4.48Å; L686-T702 HydrophobicContact CD2-CG2 3.97Å; L686-T702 HydrophobicContact CG-CG2 4.4Å; L686-E703 HydrophobicContact CD1-CG 3.59Å; L686-M705 HydrophobicContact CD1-CG 3.81Å; L686-M705 HydrophobicContact CD1-SD 4.12Å; L686-L756 HydrophobicContact CD1-CD1 3.97Å; L686-L756 HydrophobicContact CD2-CD1 3.93Å; L686-V765 WeakPolarHBondContact CB-O 3.5Å; L686-V765 PolarHBondContact N-O 2.78Å
687	H	92.1	Very high	89.1	Confident	78 Å²	78	47 Å²	47	36%	0.361	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-83.2	132	-177.2	-172.3	59.8	0	0	0	112.3	I685 E689 T702 E703	I685-H687 PolarHBondContact O-N 3.48Å; H687-E689 IonicContact CD2-OE1 2.69Å; H687-T702 VanDerWaalsContact O-CA 3.28Å; H687-T702 WeakPolarHBondContact O-CA 3.45Å; H687-T702 WeakPolarHBondContact O-CB 3.44Å; H687-E703 HydrophobicContact CB-CG 4.16Å; H687-E703 WeakPolarHBondContact CB-OE1 2.8Å; H687-E703 PolarHBondContact N-OE1 2.94Å; H687-E703 PolarHBondContact O-N 2.82Å
688	L	92.9	Very high	89.2	Confident	16 Å²	16	48.2 Å²	48.2	8%	0.084	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	119.4	170.8	-179.4	75.2	0	0	0	110.4	T616 A674 M677 I700 I701 T702	T616-L688 HydrophobicContact CG2-CD2 3.48Å; T616-L688 VanDerWaalsContact CG2-CD2 3.48Å; A674-L688 HydrophobicContact CB-CD1 4.44Å; A674-L688 HydrophobicContact CB-CD2 4.23Å; A674-L688 WeakPolarHBondContact O-CD2 3.44Å; M677-L688 HydrophobicContact CB-CB 4.03Å; M677-L688 HydrophobicContact CE-CD1 4.24Å; L688-I700 HydrophobicContact CD1-CG2 3.53Å; L688-I701 WeakPolarHBondContact CD1-O 3.39Å; L688-T702 HydrophobicContact CD1-CG2 4.28Å
689	E	92	Very high	89.5	Confident	27 Å²	27	47.9 Å²	47.9	13%	0.126	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-32.2	174.4	-68.8	-76.1	173.6	0	0	111.7	L643 K651 V653 H687 I701	L643-E689 HydrophobicContact CD2-CB 4.07Å; K651-E689 WeakPolarHBondContact CD-OE1 3.35Å; K651-E689 VanDerWaalsContact NZ-CD 3.25Å; K651-E689 IonicContact NZ-OE1 3.17Å; K651-E689 PolarHBondContact NZ-OE1 2.81Å; K651-E689 IonicContact NZ-OE2 2.66Å; K651-E689 PolarHBondContact NZ-OE2 3.38Å; V653-E689 HydrophobicContact CG1-CG 4.24Å; H687-E689 IonicContact CD2-OE1 2.69Å; E689-I701 HydrophobicContact CB-CG2 4.09Å; E689-I701 PolarHBondContact N-O 2.94Å
690	G	91.1	Very high	89.9	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.01	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.1	-172.7	174.6	0	0	0	0	0	114.3	R617 I701	R617-G690 CarbonylContact O-C 3.52Å; R617-G690 WeakPolarHBondContact O-CA 3.33Å; G690-I701 PolarHBondContact N-O 3.48Å; G690-I701 WeakPolarHBondContact O-CB 3.21Å; G690-I701 PolarHBondContact O-N 2.87Å
691	V	92.2	Very high	90.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	156.2	179	-63.5	0	0	0	0	110.6	L613 T616 R617 E618 L619 A674 T693 M699 I700	L613-V691 HydrophobicContact CD2-CG2 3.96Å; T616-V691 HydrophobicContact CG2-CG1 4.31Å; T616-V691 VanDerWaalsContact OG1-CG2 3.27Å; T616-V691 WeakPolarHBondContact OG1-CG2 3.47Å; R617-V691 PolarHBondContact O-N 2.89Å; E618-V691 CarbonylContact C-O 3.57Å; E618-V691 WeakPolarHBondContact CA-O 3.34Å; L619-V691 PolarHBondContact N-O 2.79Å; A674-V691 HydrophobicContact CB-CG1 3.62Å; V691-T693 HydrophobicContact CB-CG2 4.08Å; V691-T693 HydrophobicContact CG2-CG2 3.77Å; V691-M699 CarbonylContact C-O 3.47Å; V691-M699 VanDerWaalsContact CA-O 3.32Å; V691-M699 WeakPolarHBondContact CA-O 3.42Å; V691-I700 HydrophobicContact CG1-CG1 4.43Å
692	V	90.9	Very high	90.5	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	109.8	165.9	172.6	0	0	0	0	106.8	L619 P621 L624 I698 M699 I701	L619-V692 HydrophobicContact CB-CG2 4.25Å; P621-V692 HydrophobicContact CG-CG1 3.64Å; P621-V692 HydrophobicContact CG-CG2 4.26Å; L624-V692 HydrophobicContact CD1-CG2 3.69Å; V692-I698 WeakPolarHBondContact O-CA 3.32Å; V692-I698 WeakPolarHBondContact O-CG2 3.39Å; V692-M699 HydrophobicContact CB-CB 4Å; V692-M699 HydrophobicContact CB-CG 4.14Å; V692-M699 HydrophobicContact CG2-CB 4.4Å; V692-M699 HydrophobicContact CG2-SD 4.48Å; V692-M699 PolarHBondContact N-O 2.82Å; V692-M699 PolarHBondContact O-N 2.75Å; V692-I701 HydrophobicContact CG2-CD1 4.01Å
693	T	87.5	Confident	90.4	Very high	17 Å²	17	43 Å²	43	10%	0.104	21%	0.205	C	C	.	.			trans	-118.7	-24.6	-177.2	63.2	0	0	0	0	112.6	A609 E618 L671 V691 R695 I698	A609-T693 HydrophobicContact CB-CG2 4.28Å; E618-T693 PolarHBondContact OE1-N 2.78Å; E618-T693 PolarHBondContact OE1-OG1 3.45Å; E618-T693 PolarHBondContact OE2-N 3.24Å; E618-T693 VanDerWaalsContact OE2-N 3.15Å; E618-T693 PolarHBondContact OE2-OG1 3.28Å; L671-T693 HydrophobicContact CD2-CG2 3.8Å; V691-T693 HydrophobicContact CB-CG2 4.08Å; V691-T693 HydrophobicContact CG2-CG2 3.77Å; T693-R695 VanDerWaalsContact C-N 3.33Å; T693-R695 PolarHBondContact O-N 2.94Å; T693-I698 HydrophobicContact CG2-CG2 4.48Å
694	K	83.7	Confident	90.4	Very high	160 Å²	160	40.7 Å²	40.7	70%	0.696	19%	0.186	S	C	*	.	S	Bend	trans	-77.6	-13	-177.7	-67.6	174.5	-176.9	174	0	114.6	E618	E618-K694 HydrophobicContact CG-CD 3.98Å; E618-K694 HydrophobicContact CG-CG 4.4Å; E618-K694 WeakPolarHBondContact OE1-CB 3.25Å; E618-K694 VanDerWaalsContact OE1-CG 3.28Å; E618-K694 WeakPolarHBondContact OE1-CG 3.47Å; E618-K694 PolarHBondContact OE1-N 3.07Å
695	R	80.4	Confident	90.3	Very high	163 Å²	163	39.8 Å²	39.8	62%	0.615	18%	0.182	S	C	*	.	S	Bend	trans	-134.8	150.4	178.3	-63.8	-164.1	-175.9	173.5	2.4	110.5	P621 T693 P697	P621-R695 HydrophobicContact CG-CB 4.31Å; P621-R695 HydrophobicContact CG-CG 4.46Å; T693-R695 VanDerWaalsContact C-N 3.33Å; T693-R695 PolarHBondContact O-N 2.94Å; R695-P697 CarbonylContact O-C 3.44Å
696	K	80.3	Confident	90.2	Very high	157 Å²	157	43.9 Å²	43.9	68%	0.683	20%	0.201	S	C	*	.	S	Bend	trans	-88.4	146.1	172.8	-73.5	-172.4	165.1	-155.4	0	111.5	D660	D660-K696 WeakPolarHBondContact OD1-CD 3.45Å; D660-K696 WeakPolarHBondContact OD1-CE 3.23Å; D660-K696 IonicContact OD1-NZ 3.74Å; D660-K696 PolarHBondContact OD1-NZ 2.85Å
697	P	85.1	Confident	90.2	Very high	51 Å²	51	45.2 Å²	45.2	33%	0.331	21%	0.209	S	C	.	.	S	Bend	cis	-71.7	151.5	-6.3	31.6	-34.3	0	0	0	111.3	T657 R695 M699	T657-P697 HydrophobicContact CG2-CG 4.4Å; R695-P697 CarbonylContact O-C 3.44Å; P697-M699 HydrophobicContact CG-CE 3.68Å; P697-M699 VanDerWaalsContact O-CG 3.29Å; P697-M699 WeakPolarHBondContact O-CG 3.28Å
698	I	87.3	Confident	90.2	Very high	26 Å²	26	43 Å²	43	13%	0.133	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-67.7	137.1	174.7	-60.8	177.9	0	0	0	108.1	T657 L658 F670 L671 V692 T693	T657-I698 WeakPolarHBondContact CA-O 3.17Å; L658-I698 HydrophobicContact CB-CB 4.27Å; L658-I698 HydrophobicContact CD2-CB 4.48Å; L658-I698 HydrophobicContact CD2-CD1 4.32Å; L658-I698 PolarHBondContact N-O 2.91Å; F670-I698 HydrophobicContact CD1-CG2 4.1Å; F670-I698 HydrophobicContact CE1-CB 4.5Å; F670-I698 HydrophobicContact CE1-CG2 3.94Å; L671-I698 HydrophobicContact CD2-CG2 3.93Å; V692-I698 WeakPolarHBondContact O-CA 3.32Å; V692-I698 WeakPolarHBondContact O-CG2 3.39Å; T693-I698 HydrophobicContact CG2-CG2 4.48Å
699	M	90.4	Very high	90.3	Very high	25 Å²	25	43.4 Å²	43.4	12%	0.123	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	146.1	-174.6	-43.1	-179.1	179.9	0	0	113.1	L624 I655 K656 T657 V691 V692 P697 I701	L624-M699 HydrophobicContact CD1-SD 4.4Å; I655-M699 HydrophobicContact CG2-CB 4.07Å; I655-M699 HydrophobicContact CG2-CG 4.29Å; I655-M699 HydrophobicContact CG2-SD 3.75Å; K656-M699 CarbonylContact O-C 3.59Å; K656-M699 WeakPolarHBondContact O-CA 3.24Å; T657-M699 HydrophobicContact CG2-CG 4.14Å; V691-M699 CarbonylContact C-O 3.47Å; V691-M699 VanDerWaalsContact CA-O 3.32Å; V691-M699 WeakPolarHBondContact CA-O 3.42Å; V692-M699 HydrophobicContact CB-CB 4Å; V692-M699 HydrophobicContact CB-CG 4.14Å; V692-M699 HydrophobicContact CG2-CB 4.4Å; V692-M699 HydrophobicContact CG2-SD 4.48Å; V692-M699 PolarHBondContact N-O 2.82Å; V692-M699 PolarHBondContact O-N 2.75Å; P697-M699 HydrophobicContact CG-CE 3.68Å; P697-M699 VanDerWaalsContact O-CG 3.29Å; P697-M699 WeakPolarHBondContact O-CG 3.28Å; M699-I701 HydrophobicContact CB-CD1 3.83Å
700	I	91.2	Very high	90.5	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.4	168.3	-61.4	171.6	0	0	0	107.5	K656 F670 A674 M677 L688 V691 T702	K656-I700 HydrophobicContact CB-CB 4.4Å; K656-I700 PolarHBondContact N-O 2.87Å; K656-I700 PolarHBondContact O-N 2.96Å; F670-I700 HydrophobicContact CD1-CD1 3.88Å; F670-I700 HydrophobicContact CD1-CG1 4.22Å; F670-I700 HydrophobicContact CD2-CD1 4.03Å; F670-I700 HydrophobicContact CE1-CD1 3.68Å; F670-I700 HydrophobicContact CE1-CG1 3.62Å; F670-I700 HydrophobicContact CE2-CD1 3.86Å; F670-I700 HydrophobicContact CE2-CG1 4.42Å; F670-I700 HydrophobicContact CG-CD1 4.06Å; F670-I700 HydrophobicContact CZ-CB 4.36Å; F670-I700 HydrophobicContact CZ-CD1 3.67Å; F670-I700 HydrophobicContact CZ-CG1 3.74Å; F670-I700 WeakPolarHBondContact O-CD1 3.21Å; A674-I700 HydrophobicContact CB-CD1 3.94Å; A674-I700 HydrophobicContact CB-CG1 3.99Å; A674-I700 HydrophobicContact CB-CG2 4.19Å; M677-I700 HydrophobicContact CE-CG2 3.83Å; L688-I700 HydrophobicContact CD1-CG2 3.53Å; V691-I700 HydrophobicContact CG1-CG1 4.43Å; I700-T702 HydrophobicContact CG2-CG2 4.31Å
701	I	93.3	Very high	90.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	114.6	-174.3	-59.7	78.7	0	0	0	108.7	L619 L624 V653 A654 I655 L688 E689 G690 V692 M699	L619-I701 HydrophobicContact CD1-CB 4.01Å; L619-I701 HydrophobicContact CD1-CD1 4.09Å; L619-I701 HydrophobicContact CD1-CG1 4.02Å; L619-I701 HydrophobicContact CD1-CG2 4.29Å; L624-I701 HydrophobicContact CD1-CD1 3.94Å; L624-I701 HydrophobicContact CD1-CG1 3.87Å; L624-I701 HydrophobicContact CD2-CG1 4.01Å; L624-I701 HydrophobicContact CD2-CG2 4.26Å; V653-I701 HydrophobicContact CB-CG2 3.64Å; V653-I701 HydrophobicContact CG1-CG2 3.86Å; V653-I701 HydrophobicContact CG2-CG2 3.84Å; A654-I701 WeakPolarHBondContact O-CA 3.47Å; I655-I701 HydrophobicContact CG1-CG1 4.36Å; L688-I701 WeakPolarHBondContact CD1-O 3.39Å; E689-I701 HydrophobicContact CB-CG2 4.09Å; E689-I701 PolarHBondContact N-O 2.94Å; G690-I701 PolarHBondContact N-O 3.48Å; G690-I701 WeakPolarHBondContact O-CB 3.21Å; G690-I701 PolarHBondContact O-N 2.87Å; V692-I701 HydrophobicContact CG2-CD1 4.01Å; M699-I701 HydrophobicContact CB-CD1 3.83Å
702	T	93.9	Very high	90.5	Very high	16 Å²	16	44.9 Å²	44.9	10%	0.098	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	168.5	176.7	64.1	0	0	0	0	110.8	V653 A654 M677 L686 H687 L688 I700	V653-T702 WeakPolarHBondContact CA-O 3.45Å; V653-T702 WeakPolarHBondContact CB-O 3.37Å; A654-T702 PolarHBondContact N-O 3.25Å; A654-T702 PolarHBondContact O-N 3.31Å; M677-T702 HydrophobicContact CE-CG2 4.22Å; M677-T702 HydrophobicContact SD-CG2 4.34Å; L686-T702 HydrophobicContact CD2-CG2 3.97Å; L686-T702 HydrophobicContact CG-CG2 4.4Å; H687-T702 VanDerWaalsContact O-CA 3.28Å; H687-T702 WeakPolarHBondContact O-CA 3.45Å; H687-T702 WeakPolarHBondContact O-CB 3.44Å; L688-T702 HydrophobicContact CD1-CG2 4.28Å; I700-T702 HydrophobicContact CG2-CG2 4.31Å
703	E	93.1	Very high	90.7	Very high	35 Å²	35	45 Å²	45	16%	0.164	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	149.2	163.9	66.3	-176.8	132.6	0	0	111.1	L686 H687 M705 K764	L686-E703 HydrophobicContact CD1-CG 3.59Å; H687-E703 HydrophobicContact CB-CG 4.16Å; H687-E703 WeakPolarHBondContact CB-OE1 2.8Å; H687-E703 PolarHBondContact N-OE1 2.94Å; H687-E703 PolarHBondContact O-N 2.82Å; E703-M705 HydrophobicContact CG-SD 4.17Å; E703-K764 VanDerWaalsContact OE1-CD 3.23Å; E703-K764 WeakPolarHBondContact OE1-CD 3.31Å; E703-K764 IonicContact OE1-NZ 2.77Å; E703-K764 PolarHBondContact OE1-NZ 3.45Å; E703-K764 IonicContact OE2-NZ 3.51Å; E703-K764 PolarHBondContact OE2-NZ 2.76Å
704	F	94	Very high	91	Very high	35 Å²	35	44.1 Å²	44.1	15%	0.154	22%	0.221	C	C	.	.			trans	-87.2	136.4	176.2	-177.8	-110	0	0	0	110.3	I630 R640 T652 A654 E706	I630-F704 HydrophobicContact CD1-CD2 4.14Å; I630-F704 HydrophobicContact CD1-CE2 3.73Å; R640-F704 HydrophobicContact CB-CE2 4.16Å; R640-F704 HydrophobicContact CG-CD2 4.17Å; R640-F704 HydrophobicContact CG-CE2 3.92Å; R640-F704 HydrophobicContact CG-CZ 4.18Å; T652-F704 HydrophobicContact CG2-CB 3.73Å; T652-F704 HydrophobicContact CG2-CD1 3.65Å; T652-F704 HydrophobicContact CG2-CE1 4.41Å; T652-F704 HydrophobicContact CG2-CG 3.72Å; A654-F704 HydrophobicContact CB-CD2 4.42Å; F704-E706 HydrophobicContact CD1-CG 4.13Å; F704-E706 HydrophobicContact CE1-CB 4.35Å; F704-E706 HydrophobicContact CE1-CG 4.01Å
705	M	94.9	Very high	91.1	Very high	11 Å²	11	42.5 Å²	42.5	5%	0.054	21%	0.21	C	C	.	.			trans	-114.6	102.1	-178.3	-60.8	-66.2	-71.5	0	0	108.4	L686 E703 N707 G708 L756 V757 N758 K764	L686-M705 HydrophobicContact CD1-CG 3.81Å; L686-M705 HydrophobicContact CD1-SD 4.12Å; E703-M705 HydrophobicContact CG-SD 4.17Å; M705-N707 PolarHBondContact O-N 3.09Å; M705-G708 PolarHBondContact O-N 2.98Å; M705-L756 HydrophobicContact CB-CB 3.77Å; M705-L756 HydrophobicContact CB-CD1 4.25Å; M705-L756 VanDerWaalsContact CE-C 3.42Å; M705-L756 HydrophobicContact CE-CB 3.77Å; M705-L756 VanDerWaalsContact CE-O 3.25Å; M705-L756 WeakPolarHBondContact CE-O 3.45Å; M705-L756 HydrophobicContact CG-CB 3.59Å; M705-L756 HydrophobicContact CG-CD1 3.8Å; M705-L756 HydrophobicContact CG-CG 4.33Å; M705-V757 CarbonylContact C-O 3.58Å; M705-N758 HydrophobicContact CE-CB 3.88Å; M705-N758 HydrophobicContact SD-CB 4.07Å; M705-K764 HydrophobicContact CE-CB 3.91Å; M705-K764 HydrophobicContact CE-CD 3.88Å; M705-K764 HydrophobicContact CE-CG 3.7Å; M705-K764 HydrophobicContact SD-CD 4Å; M705-K764 HydrophobicContact SD-CG 4.48Å
706	E	93.7	Very high	91.5	Very high	90 Å²	90	41.9 Å²	41.9	42%	0.421	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-30.7	-164.7	-65.4	76.5	-168.1	0	0	114.1	F704 N758 Q759	F704-E706 HydrophobicContact CD1-CG 4.13Å; F704-E706 HydrophobicContact CE1-CB 4.35Å; F704-E706 HydrophobicContact CE1-CG 4.01Å; E706-N758 WeakPolarHBondContact OE2-CA 3.37Å; E706-Q759 HydrophobicContact CB-CB 4.34Å; E706-Q759 HydrophobicContact CG-CB 4.16Å; E706-Q759 PolarHBondContact OE2-N 2.89Å
707	N	93.8	Very high	91.8	Very high	39 Å²	39	38.4 Å²	38.4	21%	0.209	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	4.4	-176.9	-74.6	-50.7	0	0	0	112.7	M705 F713 V757 N758	M705-N707 PolarHBondContact O-N 3.09Å; N707-F713 HydrophobicContact CB-CD2 3.51Å; N707-F713 HydrophobicContact CB-CE2 3.76Å; N707-F713 HydrophobicContact CB-CG 4.35Å; N707-V757 WeakPolarHBondContact CA-O 3.26Å; N707-V757 HydrophobicContact CB-CB 3.84Å; N707-V757 HydrophobicContact CB-CG1 4.01Å; N707-V757 WeakPolarHBondContact CB-O 3.05Å; N707-V757 PolarHBondContact N-O 2.74Å; N707-N758 PolarHBondContact ND2-O 2.75Å
708	G	93.3	Very high	91.3	Very high	30 Å²	30	39.9 Å²	39.9	31%	0.309	20%	0.199	S	C	.	.			trans	65	-149.9	175.7	0	0	0	0	0	113.7	M705 L756 V757	M705-G708 PolarHBondContact O-N 2.98Å; G708-L756 CarbonylContact O-C 3.52Å; G708-L756 WeakPolarHBondContact O-CA 3.01Å; G708-V757 PolarHBondContact O-N 3.06Å
709	A	94.5	Very high	90.7	Very high	25 Å²	25	44.3 Å²	44.3	21%	0.207	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-73.8	140.9	-179.3	0	0	0	0	0	112.2	D711 A712 F713 I755 L756	A709-D711 VanDerWaalsContact C-N 3.33Å; A709-D711 WeakPolarHBondContact CB-OD1 3.4Å; A709-D711 PolarHBondContact O-N 3.02Å; A709-A712 PolarHBondContact O-N 2.83Å; A709-F713 WeakPolarHBondContact O-CB 3.29Å; A709-F713 PolarHBondContact O-N 2.99Å; A709-I755 CarbonylContact C-O 3.49Å; A709-I755 WeakPolarHBondContact CA-O 3.37Å; A709-L756 HydrophobicContact CB-CD2 4.33Å
710	L	96.6	Very high	90.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.8	-36.7	-172.1	177	63.2	0	0	0	112.5	F713 L714 M729 I733 A752 I755 V757 V819	L710-F713 HydrophobicContact CD1-CD1 4.25Å; L710-F713 PolarHBondContact O-N 2.96Å; L710-L714 HydrophobicContact CD1-CD1 3.94Å; L710-L714 HydrophobicContact CD1-CD2 4.26Å; L710-L714 HydrophobicContact CD1-CG 3.82Å; L710-L714 HydrophobicContact CG-CD1 3.77Å; L710-L714 HydrophobicContact CG-CG 4.15Å; L710-L714 WeakPolarHBondContact O-CB 3.27Å; L710-L714 WeakPolarHBondContact O-CD1 3.47Å; L710-L714 WeakPolarHBondContact O-CG 3.34Å; L710-L714 PolarHBondContact O-N 3.44Å; L710-M729 HydrophobicContact CD1-SD 3.99Å; L710-I733 HydrophobicContact CD2-CD1 3.79Å; L710-A752 WeakPolarHBondContact CB-O 3.39Å; L710-I755 HydrophobicContact CB-CB 3.89Å; L710-I755 HydrophobicContact CB-CG2 4.13Å; L710-I755 WeakPolarHBondContact CB-O 3.31Å; L710-I755 HydrophobicContact CD2-CB 3.93Å; L710-I755 HydrophobicContact CD2-CG1 4.38Å; L710-I755 HydrophobicContact CD2-CG2 3.83Å; L710-I755 PolarHBondContact N-O 2.72Å; L710-V757 HydrophobicContact CB-CG2 3.84Å; L710-V757 HydrophobicContact CD1-CG2 3.6Å; L710-V757 HydrophobicContact CG-CG2 4.31Å; L710-V819 HydrophobicContact CD2-CG2 3.84Å
711	D	92.4	Very high	90.1	Very high	26 Å²	26	49.6 Å²	49.6	14%	0.139	25%	0.248	C	C	.	.	H	α-helix	trans	-64	-44.9	179.9	72.3	-46.5	0	0	0	112.3	A709 R715 A752 R753	A709-D711 VanDerWaalsContact C-N 3.33Å; A709-D711 WeakPolarHBondContact CB-OD1 3.4Å; A709-D711 PolarHBondContact O-N 3.02Å; D711-R715 WeakPolarHBondContact O-CG 3.48Å; D711-R715 PolarHBondContact O-N 3.17Å; D711-R715 IonicContact OD2-CZ 3.07Å; D711-R715 IonicContact OD2-NH1 2.65Å; D711-R715 PolarHBondContact OD2-NH1 3.02Å; D711-R715 IonicContact OD2-NH2 2.85Å; D711-R715 PolarHBondContact OD2-NH2 2.83Å; D711-A752 HydrophobicContact CB-CB 3.91Å; D711-R753 WeakPolarHBondContact OD1-CA 3.28Å
712	A	91.3	Very high	89.7	Confident	33 Å²	33	53.7 Å²	53.7	27%	0.273	27%	0.272	S	S	.	.	H	α-helix	trans	-66.1	-45.6	174.3	0	0	0	0	0	111.2	A709 L714 R715 E716	A709-A712 PolarHBondContact O-N 2.83Å; A712-L714 VanDerWaalsContact C-N 3.33Å; A712-L714 PolarHBondContact O-N 3.43Å; A712-R715 PolarHBondContact O-N 3.31Å; A712-E716 WeakPolarHBondContact O-CG 3.36Å; A712-E716 PolarHBondContact O-N 3.13Å; A712-E716 VanDerWaalsContact O-N 3.07Å
713	F	94.8	Very high	89.3	Confident	3 Å²	3	56.4 Å²	56.4	1%	0.013	29%	0.291	C	S	.	.	H	α-helix	trans	-56.9	-43.2	178	174.5	-96.7	0	0	0	113	N707 A709 L710 E716 R717 L721 M729 V757 L761	N707-F713 HydrophobicContact CB-CD2 3.51Å; N707-F713 HydrophobicContact CB-CE2 3.76Å; N707-F713 HydrophobicContact CB-CG 4.35Å; A709-F713 WeakPolarHBondContact O-CB 3.29Å; A709-F713 PolarHBondContact O-N 2.99Å; L710-F713 HydrophobicContact CD1-CD1 4.25Å; L710-F713 PolarHBondContact O-N 2.96Å; F713-E716 PolarHBondContact O-N 3.39Å; F713-R717 VanDerWaalsContact CE2-CD 3.42Å; F713-R717 HydrophobicContact CE2-CG 4.5Å; F713-R717 PolarHBondContact O-N 3.38Å; F713-L721 HydrophobicContact CE1-CD1 3.99Å; F713-L721 HydrophobicContact CE1-CD2 4.19Å; F713-L721 HydrophobicContact CZ-CD2 4.35Å; F713-M729 HydrophobicContact CE1-CE 3.68Å; F713-M729 HydrophobicContact CZ-CE 4.46Å; F713-V757 HydrophobicContact CD1-CG1 4.43Å; F713-V757 HydrophobicContact CD1-CG2 4.32Å; F713-V757 HydrophobicContact CE1-CG1 4.39Å; F713-V757 HydrophobicContact CG-CG2 4.42Å; F713-V757 HydrophobicContact CZ-CG1 4.48Å; F713-L761 HydrophobicContact CE1-CD2 4.08Å; F713-L761 HydrophobicContact CE2-CD2 4.14Å; F713-L761 HydrophobicContact CZ-CD2 3.36Å
714	L	92.5	Very high	89.1	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-64.8	-45.2	178.1	-73.5	165.1	0	0	0	111.8	L710 A712 E716 R717 E718 L721 L726 M729 V819 F822	L710-L714 HydrophobicContact CD1-CD1 3.94Å; L710-L714 HydrophobicContact CD1-CD2 4.26Å; L710-L714 HydrophobicContact CD1-CG 3.82Å; L710-L714 HydrophobicContact CG-CD1 3.77Å; L710-L714 HydrophobicContact CG-CG 4.15Å; L710-L714 WeakPolarHBondContact O-CB 3.27Å; L710-L714 WeakPolarHBondContact O-CD1 3.47Å; L710-L714 WeakPolarHBondContact O-CG 3.34Å; L710-L714 PolarHBondContact O-N 3.44Å; A712-L714 VanDerWaalsContact C-N 3.33Å; A712-L714 PolarHBondContact O-N 3.43Å; L714-E716 VanDerWaalsContact C-N 3.29Å; L714-E716 PolarHBondContact O-N 2.81Å; L714-R717 CarbonylContact O-C 3.6Å; L714-R717 PolarHBondContact O-N 2.86Å; L714-R717 VanDerWaalsContact O-N 3.16Å; L714-E718 PolarHBondContact O-N 2.99Å; L714-E718 VanDerWaalsContact O-N 3.12Å; L714-L721 HydrophobicContact CD2-CD1 3.83Å; L714-L726 HydrophobicContact CD2-CD2 3.74Å; L714-M729 HydrophobicContact CD2-SD 4.49Å; L714-V819 HydrophobicContact CD1-CB 4.38Å; L714-V819 HydrophobicContact CD1-CG2 4.12Å; L714-F822 CarbonylContact C-O 3.51Å; L714-F822 HydrophobicContact CD2-CD1 4.38Å
715	R	86.8	Confident	89	Confident	125 Å²	125	57.8 Å²	57.8	47%	0.472	31%	0.306	S	S	.	.	H	α-helix	trans	-62.4	-36.1	179.2	-74.6	-173.4	-66.4	-107.7	-1.2	112.4	D711 A712 R717 F822 G823	D711-R715 WeakPolarHBondContact O-CG 3.48Å; D711-R715 PolarHBondContact O-N 3.17Å; D711-R715 IonicContact OD2-CZ 3.07Å; D711-R715 IonicContact OD2-NH1 2.65Å; D711-R715 PolarHBondContact OD2-NH1 3.02Å; D711-R715 IonicContact OD2-NH2 2.85Å; D711-R715 PolarHBondContact OD2-NH2 2.83Å; A712-R715 PolarHBondContact O-N 3.31Å; R715-R717 VanDerWaalsContact C-N 3.29Å; R715-R717 PolarHBondContact O-N 2.98Å; R715-F822 WeakPolarHBondContact CA-O 3.31Å; R715-F822 WeakPolarHBondContact CG-O 3.41Å; R715-F822 PolarHBondContact N-O 3.34Å; R715-G823 PolarHBondContact NH1-O 3.1Å
716	E	89.1	Confident	88.9	Confident	150 Å²	150	57.6 Å²	57.6	70%	0.701	31%	0.305	S	S	*	.	H	α-helix	trans	-74.9	-17.6	178.9	-71.1	176.7	-171.2	0	0	113.5	A712 F713 L714	A712-E716 WeakPolarHBondContact O-CG 3.36Å; A712-E716 PolarHBondContact O-N 3.13Å; A712-E716 VanDerWaalsContact O-N 3.07Å; F713-E716 PolarHBondContact O-N 3.39Å; L714-E716 VanDerWaalsContact C-N 3.29Å; L714-E716 PolarHBondContact O-N 2.81Å
717	R	86.1	Confident	88.9	Confident	85 Å²	85	53.4 Å²	53.4	32%	0.321	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.1	23.6	-170.8	-64	-169.1	-174	-116.1	13.7	114.6	F713 L714 R715 D719 Q720 L721	F713-R717 VanDerWaalsContact CE2-CD 3.42Å; F713-R717 HydrophobicContact CE2-CG 4.5Å; F713-R717 PolarHBondContact O-N 3.38Å; L714-R717 CarbonylContact O-C 3.6Å; L714-R717 PolarHBondContact O-N 2.86Å; L714-R717 VanDerWaalsContact O-N 3.16Å; R715-R717 VanDerWaalsContact C-N 3.29Å; R715-R717 PolarHBondContact O-N 2.98Å; R717-D719 PolarHBondContact O-N 3.19Å; R717-Q720 HydrophobicContact CB-CB 4.26Å; R717-Q720 VanDerWaalsContact NH1-OE1 3.09Å; R717-Q720 PolarHBondContact O-N 3.47Å; R717-L721 HydrophobicContact CB-CD1 4.19Å; R717-L721 HydrophobicContact CB-CG 4.17Å; R717-L721 PolarHBondContact O-N 3.28Å
718	E	74.9	Confident	89	Confident	81 Å²	81	53.6 Å²	53.6	38%	0.379	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	-39.7	-180	-175.3	176.1	-175.3	0	0	113	L714 F822	L714-E718 PolarHBondContact O-N 2.99Å; L714-E718 VanDerWaalsContact O-N 3.12Å; E718-F822 HydrophobicContact CB-CB 4.25Å; E718-F822 HydrophobicContact CB-CD1 4.11Å; E718-F822 HydrophobicContact CB-CG 4.17Å; E718-F822 HydrophobicContact CG-CB 4.01Å; E718-F822 HydrophobicContact CG-CD1 4.08Å; E718-F822 HydrophobicContact CG-CD2 3.96Å; E718-F822 HydrophobicContact CG-CE1 4.49Å; E718-F822 HydrophobicContact CG-CE2 4.41Å; E718-F822 HydrophobicContact CG-CG 3.76Å; E718-F822 WeakPolarHBondContact O-CE1 3.45Å
719	D	74.1	Confident	89.2	Confident	119 Å²	119	52.3 Å²	52.3	64%	0.636	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-5.2	-178.5	-67	-43.1	0	0	0	115.2	R717 R929	R717-D719 PolarHBondContact O-N 3.19Å; D719-R929 IonicContact OD1-CZ 3.26Å; D719-R929 VanDerWaalsContact OD1-CZ 3.26Å; D719-R929 IonicContact OD1-NH1 3.55Å; D719-R929 IonicContact OD1-NH2 2.72Å; D719-R929 PolarHBondContact OD1-NH2 3.15Å
720	Q	82.2	Confident	89.3	Confident	121 Å²	121	51.1 Å²	51.1	57%	0.565	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-17	-171.6	-61.1	176	24.3	0	0	113.5	R717	R717-Q720 HydrophobicContact CB-CB 4.26Å; R717-Q720 VanDerWaalsContact NH1-OE1 3.09Å; R717-Q720 PolarHBondContact O-N 3.47Å
721	L	86.1	Confident	89.4	Confident	18 Å²	18	52.8 Å²	52.8	9%	0.094	28%	0.277	C	S	.	.			trans	-97.1	132	-174.6	-61.6	170.5	0	0	0	111.2	F713 L714 R717 L726 M729 F822	F713-L721 HydrophobicContact CE1-CD1 3.99Å; F713-L721 HydrophobicContact CE1-CD2 4.19Å; F713-L721 HydrophobicContact CZ-CD2 4.35Å; L714-L721 HydrophobicContact CD2-CD1 3.83Å; R717-L721 HydrophobicContact CB-CD1 4.19Å; R717-L721 HydrophobicContact CB-CG 4.17Å; R717-L721 PolarHBondContact O-N 3.28Å; L721-L726 HydrophobicContact CB-CD2 4.17Å; L721-L726 HydrophobicContact CD1-CD2 4.01Å; L721-M729 HydrophobicContact CD1-CE 4.49Å; L721-M729 HydrophobicContact CD2-CE 4.11Å; L721-F822 HydrophobicContact CB-CE1 4.16Å; L721-F822 HydrophobicContact CD1-CE1 4.35Å
722	V	86.5	Confident	89.5	Confident	85 Å²	85	51.6 Å²	51.6	52%	0.515	27%	0.271	S	S	.	.			trans	-89.2	153	174.2	-61.9	0	0	0	0	111	G724 Q725 L726	V722-G724 PolarHBondContact O-N 3.27Å; V722-Q725 HydrophobicContact CG2-CB 4.27Å; V722-Q725 HydrophobicContact CG2-CG 3.73Å; V722-Q725 WeakPolarHBondContact O-CB 3.18Å; V722-Q725 PolarHBondContact O-N 3.49Å; V722-L726 PolarHBondContact O-N 2.99Å
723	P	84.5	Confident	89.9	Confident	74 Å²	74	50 Å²	50	48%	0.481	26%	0.258	S	S	.	.	H	α-helix	trans	-52.8	-36	-178.6	-29.7	35.5	0	0	0	114.2	Q725 L726 V727 L890	P723-Q725 VanDerWaalsContact C-N 3.32Å; P723-Q725 PolarHBondContact O-N 3.41Å; P723-L726 WeakPolarHBondContact O-CB 3.29Å; P723-L726 PolarHBondContact O-N 2.93Å; P723-V727 WeakPolarHBondContact O-CG2 3.29Å; P723-V727 PolarHBondContact O-N 3.19Å; P723-L890 HydrophobicContact CB-CD1 4.36Å
724	G	88.4	Confident	90	Very high	32 Å²	32	49.9 Å²	49.9	33%	0.33	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-36.2	176	0	0	0	0	0	113.7	V722 V727 A728 L884	V722-G724 PolarHBondContact O-N 3.27Å; G724-V727 PolarHBondContact O-N 3.15Å; G724-A728 WeakPolarHBondContact O-CB 3.49Å; G724-A728 PolarHBondContact O-N 3.34Å; G724-L884 WeakPolarHBondContact O-CD2 3.39Å
725	Q	92.6	Very high	90.3	Very high	67 Å²	67	50.6 Å²	50.6	31%	0.313	26%	0.262	S	S	.	.	H	α-helix	trans	-68.4	-40.5	175.6	-71.1	170.2	-42.6	0	0	111	V722 P723 V727 A728 M729 L761	V722-Q725 HydrophobicContact CG2-CB 4.27Å; V722-Q725 HydrophobicContact CG2-CG 3.73Å; V722-Q725 WeakPolarHBondContact O-CB 3.18Å; V722-Q725 PolarHBondContact O-N 3.49Å; P723-Q725 VanDerWaalsContact C-N 3.32Å; P723-Q725 PolarHBondContact O-N 3.41Å; Q725-V727 VanDerWaalsContact C-N 3.35Å; Q725-V727 PolarHBondContact O-N 3.46Å; Q725-A728 WeakPolarHBondContact O-CB 3.04Å; Q725-A728 PolarHBondContact O-N 3.32Å; Q725-M729 VanDerWaalsContact O-CG 3.31Å; Q725-M729 WeakPolarHBondContact O-CG 3.48Å; Q725-M729 PolarHBondContact O-N 3.37Å; Q725-L761 HydrophobicContact CG-CD1 4.38Å
726	L	93.5	Very high	90.7	Very high	7 Å²	7	44.6 Å²	44.6	4%	0.037	24%	0.239	C	C	.	.	H	α-helix	trans	-61.5	-43.1	175.5	-58.7	180	0	0	0	111.5	L714 L721 V722 P723 A728 M729 L730 V819 L820 F822	L714-L726 HydrophobicContact CD2-CD2 3.74Å; L721-L726 HydrophobicContact CB-CD2 4.17Å; L721-L726 HydrophobicContact CD1-CD2 4.01Å; V722-L726 PolarHBondContact O-N 2.99Å; P723-L726 WeakPolarHBondContact O-CB 3.29Å; P723-L726 PolarHBondContact O-N 2.93Å; L726-A728 VanDerWaalsContact C-N 3.34Å; L726-A728 PolarHBondContact O-N 3.31Å; L726-M729 HydrophobicContact CD2-SD 4.42Å; L726-M729 PolarHBondContact O-N 2.66Å; L726-L730 WeakPolarHBondContact O-CG 3.11Å; L726-L730 PolarHBondContact O-N 3.13Å; L726-V819 HydrophobicContact CB-CG1 3.92Å; L726-V819 HydrophobicContact CD2-CG1 3.97Å; L726-V819 HydrophobicContact CG-CG1 4.45Å; L726-L820 HydrophobicContact CD1-CD2 4.22Å; L726-F822 HydrophobicContact CD1-CE1 4.11Å; L726-F822 HydrophobicContact CD1-CE2 4.31Å; L726-F822 HydrophobicContact CD1-CZ 3.76Å; L726-F822 HydrophobicContact CD2-CE1 4.18Å
727	V	94.2	Very high	91.1	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-66.1	-37.4	175.7	-176.1	0	0	0	0	111.2	P723 G724 Q725 L730 Q731 L855 L880 V883 L884 L890	P723-V727 WeakPolarHBondContact O-CG2 3.29Å; P723-V727 PolarHBondContact O-N 3.19Å; G724-V727 PolarHBondContact O-N 3.15Å; Q725-V727 VanDerWaalsContact C-N 3.35Å; Q725-V727 PolarHBondContact O-N 3.46Å; V727-L730 PolarHBondContact O-N 3.16Å; V727-Q731 WeakPolarHBondContact O-CB 3.27Å; V727-Q731 PolarHBondContact O-N 3.09Å; V727-L855 HydrophobicContact CG2-CD1 3.71Å; V727-L855 HydrophobicContact CG2-CD2 4.48Å; V727-L880 HydrophobicContact CG1-CB 4.49Å; V727-L880 HydrophobicContact CG1-CD2 4.08Å; V727-V883 HydrophobicContact CG1-CB 4.37Å; V727-V883 HydrophobicContact CG1-CG1 4.05Å; V727-V883 HydrophobicContact CG2-CG1 4.36Å; V727-L884 HydrophobicContact CB-CD2 3.78Å; V727-L884 HydrophobicContact CB-CG 4.19Å; V727-L884 HydrophobicContact CG1-CD1 4.28Å; V727-L884 HydrophobicContact CG1-CD2 3.8Å; V727-L884 HydrophobicContact CG1-CG 3.62Å; V727-L890 HydrophobicContact CG2-CD1 4.19Å; V727-L890 HydrophobicContact CG2-CD2 4.22Å
728	A	95.1	Very high	91.7	Very high	43 Å²	43	34.5 Å²	34.5	36%	0.355	20%	0.196	S	C	.	.	H	α-helix	trans	-64.3	-40.9	176	0	0	0	0	0	112.1	G724 Q725 L726 Q731 G732 L884	G724-A728 WeakPolarHBondContact O-CB 3.49Å; G724-A728 PolarHBondContact O-N 3.34Å; Q725-A728 WeakPolarHBondContact O-CB 3.04Å; Q725-A728 PolarHBondContact O-N 3.32Å; L726-A728 VanDerWaalsContact C-N 3.34Å; L726-A728 PolarHBondContact O-N 3.31Å; A728-Q731 PolarHBondContact O-N 3.2Å; A728-G732 PolarHBondContact O-N 3.21Å; A728-L884 HydrophobicContact CB-CD1 4.32Å; A728-L884 HydrophobicContact CB-CD2 4.21Å
729	M	97.1	Very high	92.6	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.02	19%	0.186	C	C	.	.	H	α-helix	trans	-59.1	-47.8	172.5	-69.6	171.1	-175.5	0	0	111.2	L710 F713 L714 L721 Q725 L726 Q731 G732 I733 L761 C763	L710-M729 HydrophobicContact CD1-SD 3.99Å; F713-M729 HydrophobicContact CE1-CE 3.68Å; F713-M729 HydrophobicContact CZ-CE 4.46Å; L714-M729 HydrophobicContact CD2-SD 4.49Å; L721-M729 HydrophobicContact CD1-CE 4.49Å; L721-M729 HydrophobicContact CD2-CE 4.11Å; Q725-M729 VanDerWaalsContact O-CG 3.31Å; Q725-M729 WeakPolarHBondContact O-CG 3.48Å; Q725-M729 PolarHBondContact O-N 3.37Å; L726-M729 HydrophobicContact CD2-SD 4.42Å; L726-M729 PolarHBondContact O-N 2.66Å; M729-Q731 VanDerWaalsContact C-N 3.34Å; M729-Q731 PolarHBondContact O-N 3.15Å; M729-G732 PolarHBondContact O-N 2.86Å; M729-I733 WeakPolarHBondContact O-CD1 3.08Å; M729-I733 VanDerWaalsContact O-CG1 3.29Å; M729-I733 WeakPolarHBondContact O-CG1 3.35Å; M729-I733 PolarHBondContact O-N 3.18Å; M729-L761 HydrophobicContact CE-CB 3.99Å; M729-L761 HydrophobicContact CE-CD1 4.32Å; M729-L761 HydrophobicContact CE-CD2 4.23Å; M729-L761 HydrophobicContact CE-CG 4.43Å; M729-C763 VanDerWaalsContact CB-SG 3.54Å; M729-C763 VanDerWaalsContact CG-SG 3.57Å
730	L	97.6	Very high	93.4	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.9	-38.8	177.2	-68.6	175.3	0	0	0	112.9	L726 V727 I733 A734 M816 V819 L880	L726-L730 WeakPolarHBondContact O-CG 3.11Å; L726-L730 PolarHBondContact O-N 3.13Å; V727-L730 PolarHBondContact O-N 3.16Å; L730-I733 HydrophobicContact CD2-CD1 4.48Å; L730-I733 PolarHBondContact O-N 3.36Å; L730-A734 WeakPolarHBondContact O-CB 3.29Å; L730-A734 PolarHBondContact O-N 3.39Å; L730-M816 HydrophobicContact CD1-CB 4.35Å; L730-M816 HydrophobicContact CD1-CE 4.48Å; L730-M816 HydrophobicContact CD1-CG 4.15Å; L730-M816 HydrophobicContact CD2-CB 4.28Å; L730-M816 HydrophobicContact CD2-CG 3.92Å; L730-V819 HydrophobicContact CD1-CB 4.46Å; L730-V819 HydrophobicContact CD1-CG1 4.29Å; L730-V819 HydrophobicContact CD2-CB 3.83Å; L730-V819 HydrophobicContact CD2-CG1 4.16Å; L730-V819 HydrophobicContact CD2-CG2 3.64Å; L730-V819 HydrophobicContact CG-CB 4.2Å; L730-V819 HydrophobicContact CG-CG1 4Å; L730-V819 HydrophobicContact CG-CG2 4.36Å; L730-L880 HydrophobicContact CB-CD1 4.05Å; L730-L880 HydrophobicContact CB-CD2 4.33Å
731	Q	96.8	Very high	93.8	Very high	35 Å²	35	22.2 Å²	22.2	16%	0.164	14%	0.136	C	C	.	.	H	α-helix	trans	-63.4	-43	176.1	-177.6	-82.7	-15.7	0	0	110.9	V727 A728 M729 A734 S735 L880 E881 L884	V727-Q731 WeakPolarHBondContact O-CB 3.27Å; V727-Q731 PolarHBondContact O-N 3.09Å; A728-Q731 PolarHBondContact O-N 3.2Å; M729-Q731 VanDerWaalsContact C-N 3.34Å; M729-Q731 PolarHBondContact O-N 3.15Å; Q731-A734 PolarHBondContact O-N 3.06Å; Q731-S735 WeakPolarHBondContact O-CB 3.41Å; Q731-S735 PolarHBondContact O-N 3.19Å; Q731-L880 HydrophobicContact CB-CB 3.99Å; Q731-L880 HydrophobicContact CG-CB 4.34Å; Q731-E881 HydrophobicContact CG-CG 3.72Å; Q731-E881 PolarHBondContact NE2-OE1 2.79Å; Q731-L884 HydrophobicContact CB-CD1 3.89Å; Q731-L884 HydrophobicContact CG-CD1 4.11Å
732	G	96.4	Very high	94	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-61.5	-46.9	176	0	0	0	0	0	112.2	H684 A728 M729 A734 S735 G736	H684-G732 WeakPolarHBondContact CB-O 3.28Å; H684-G732 VanDerWaalsContact CE1-CA 3.46Å; H684-G732 WeakPolarHBondContact CE1-CA 3.3Å; H684-G732 WeakPolarHBondContact ND1-CA 3.45Å; A728-G732 PolarHBondContact O-N 3.21Å; M729-G732 PolarHBondContact O-N 2.86Å; G732-A734 PolarHBondContact O-N 3.07Å; G732-S735 WeakPolarHBondContact O-CB 3.39Å; G732-S735 PolarHBondContact O-N 3.04Å; G732-S735 VanDerWaalsContact O-N 3.17Å; G732-G736 PolarHBondContact O-N 3.44Å
733	I	98.3	Very high	93.9	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60	-45.8	176	-61.7	160.9	0	0	0	110.6	L710 M729 L730 S735 G736 M737 L750 I755 C763 V765 F812 V815	L710-I733 HydrophobicContact CD2-CD1 3.79Å; M729-I733 WeakPolarHBondContact O-CD1 3.08Å; M729-I733 VanDerWaalsContact O-CG1 3.29Å; M729-I733 WeakPolarHBondContact O-CG1 3.35Å; M729-I733 PolarHBondContact O-N 3.18Å; L730-I733 HydrophobicContact CD2-CD1 4.48Å; L730-I733 PolarHBondContact O-N 3.36Å; I733-S735 VanDerWaalsContact C-N 3.31Å; I733-S735 PolarHBondContact O-N 3.11Å; I733-G736 PolarHBondContact O-N 2.99Å; I733-M737 HydrophobicContact CG2-CG 4.5Å; I733-M737 WeakPolarHBondContact O-CG 3.41Å; I733-M737 PolarHBondContact O-N 3.06Å; I733-L750 HydrophobicContact CG2-CD1 4.34Å; I733-I755 HydrophobicContact CD1-CG1 4.07Å; I733-I755 HydrophobicContact CD1-CG2 3.99Å; I733-I755 HydrophobicContact CG1-CD1 4.22Å; I733-I755 HydrophobicContact CG1-CG1 4.22Å; I733-I755 HydrophobicContact CG1-CG2 3.89Å; I733-I755 HydrophobicContact CG2-CD1 4.05Å; I733-C763 HydrophobicContact CD1-CB 4.28Å; I733-C763 HydrophobicContact CG1-CB 3.76Å; I733-V765 HydrophobicContact CG2-CG2 4.38Å; I733-F812 HydrophobicContact CB-CE2 4.11Å; I733-F812 HydrophobicContact CG2-CD2 3.94Å; I733-F812 HydrophobicContact CG2-CE2 3.81Å; I733-V815 HydrophobicContact CD1-CG1 4.04Å
734	A	98.1	Very high	93.9	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61	-39.3	176.6	0	0	0	0	0	112.1	L730 Q731 G732 M737 N738 F812 Q877 L880	L730-A734 WeakPolarHBondContact O-CB 3.29Å; L730-A734 PolarHBondContact O-N 3.39Å; Q731-A734 PolarHBondContact O-N 3.06Å; G732-A734 PolarHBondContact O-N 3.07Å; A734-M737 PolarHBondContact O-N 2.83Å; A734-N738 VanDerWaalsContact O-CB 3.24Å; A734-N738 WeakPolarHBondContact O-CB 3.46Å; A734-N738 PolarHBondContact O-N 2.99Å; A734-F812 HydrophobicContact CB-CE1 4.49Å; A734-F812 HydrophobicContact CB-CE2 4.01Å; A734-F812 HydrophobicContact CB-CZ 3.74Å; A734-Q877 HydrophobicContact CB-CB 4.26Å; A734-L880 HydrophobicContact CB-CD1 3.96Å
735	S	97.8	Very high	93.7	Very high	14 Å²	14	22.4 Å²	22.4	10%	0.098	12%	0.12	C	C	.	.	H	α-helix	trans	-63.5	-43.9	175.5	-172.6	0	0	0	0	111.7	H682 Q731 G732 I733 N738 Y739	H682-S735 PolarHBondContact CE1-O 2.98Å; H682-S735 PolarHBondContact CE1-OG 2.04Å; H682-S735 VanDerWaalsContact CE1-OG 3.27Å; H682-S735 PolarHBondContact NE2-OG 2.83Å; Q731-S735 WeakPolarHBondContact O-CB 3.41Å; Q731-S735 PolarHBondContact O-N 3.19Å; G732-S735 WeakPolarHBondContact O-CB 3.39Å; G732-S735 PolarHBondContact O-N 3.04Å; G732-S735 VanDerWaalsContact O-N 3.17Å; I733-S735 VanDerWaalsContact C-N 3.31Å; I733-S735 PolarHBondContact O-N 3.11Å; S735-N738 PolarHBondContact O-N 2.84Å; S735-Y739 PolarHBondContact O-N 3.12Å
736	G	96.4	Very high	93.5	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62.1	-45	175.3	0	0	0	0	0	112.5	G732 I733 Y739 L740	G732-G736 PolarHBondContact O-N 3.44Å; I733-G736 PolarHBondContact O-N 2.99Å; G736-Y739 WeakPolarHBondContact O-CB 3.44Å; G736-Y739 PolarHBondContact O-N 2.79Å; G736-L740 PolarHBondContact O-N 2.03Å
737	M	97.4	Very high	93.4	Very high	1 Å²	1	19 Å²	19	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-70.2	-32.5	178	-69.1	-55	-58.3	0	0	113.3	I733 A734 Y739 L740 S741 H747 L750 V765 D808 F873	I733-M737 HydrophobicContact CG2-CG 4.5Å; I733-M737 WeakPolarHBondContact O-CG 3.41Å; I733-M737 PolarHBondContact O-N 3.06Å; A734-M737 PolarHBondContact O-N 2.83Å; M737-Y739 VanDerWaalsContact C-N 3.34Å; M737-L740 HydrophobicContact CE-CD1 4.33Å; M737-L740 PolarHBondContact O-N 2.82Å; M737-L740 HydrophobicContact SD-CD1 3.81Å; M737-S741 VanDerWaalsContact O-CB 3.29Å; M737-S741 WeakPolarHBondContact O-CB 3.48Å; M737-S741 PolarHBondContact O-N 2.04Å; M737-H747 HydrophobicContact CE-CB 3.82Å; M737-H747 HydrophobicContact SD-CB 4.33Å; M737-L750 HydrophobicContact CE-CD2 4.1Å; M737-L750 HydrophobicContact CG-CD1 4.14Å; M737-L750 HydrophobicContact CG-CD2 3.82Å; M737-L750 HydrophobicContact SD-CD1 3.81Å; M737-L750 HydrophobicContact SD-CD2 4.01Å; M737-L750 HydrophobicContact SD-CG 4.44Å; M737-V765 HydrophobicContact CG-CG2 4.34Å; M737-V765 HydrophobicContact SD-CG1 4.07Å; M737-V765 HydrophobicContact SD-CG2 4.22Å; M737-D808 HydrophobicContact CE-CB 3.8Å; M737-D808 WeakPolarHBondContact CE-OD2 3.37Å; M737-F873 HydrophobicContact CB-CD1 3.54Å; M737-F873 HydrophobicContact CB-CD2 4.07Å; M737-F873 HydrophobicContact CB-CE1 3.36Å; M737-F873 HydrophobicContact CB-CE2 3.91Å; M737-F873 HydrophobicContact CB-CG 3.9Å; M737-F873 HydrophobicContact CB-CZ 3.56Å; M737-F873 HydrophobicContact CE-CE2 4.07Å; M737-F873 HydrophobicContact CE-CZ 3.99Å; M737-F873 HydrophobicContact CG-CE1 3.93Å; M737-F873 HydrophobicContact CG-CZ 3.99Å
738	N	96.9	Very high	93.1	Very high	21 Å²	21	20.3 Å²	20.3	11%	0.112	11%	0.109	C	C	.	.	H	α-helix	trans	-62.4	-43	170.7	-173.6	34.5	0	0	0	110.7	A734 S735 S741 N742 F873 Q874 Q877	A734-N738 VanDerWaalsContact O-CB 3.24Å; A734-N738 WeakPolarHBondContact O-CB 3.46Å; A734-N738 PolarHBondContact O-N 2.99Å; S735-N738 PolarHBondContact O-N 2.84Å; N738-S741 PolarHBondContact O-N 2.91Å; N738-N742 WeakPolarHBondContact O-CB 3.1Å; N738-N742 PolarHBondContact O-N 3.09Å; N738-N742 PolarHBondContact O-ND2 2.91Å; N738-N742 VanDerWaalsContact O-ND2 3.1Å; N738-N742 PolarHBondContact OD1-ND2 2.78Å; N738-F873 HydrophobicContact CB-CB 3.86Å; N738-Q874 PolarHBondContact OD1-N 2.96Å; N738-Q877 PolarHBondContact ND2-OE1 3.16Å
739	Y	94.6	Very high	92.9	Very high	43 Å²	43	19 Å²	19	17%	0.169	10%	0.096	C	C	.	.	H	α-helix	trans	-58.9	-49.6	173.6	179.9	-84.3	0	0	0	111.4	F680 S681 H682 I685 S735 G736 M737 S741 N742 H743	F680-Y739 HydrophobicContact CB-CE1 4.07Å; F680-Y739 AromaticContact CD1-CE1 3.8Å; F680-Y739 HydrophobicContact CD1-CE1 3.8Å; F680-Y739 HydrophobicContact CG-CE1 4.18Å; S681-Y739 PolarHBondContact N-OH 2.96Å; H682-Y739 HydrophobicContact CB-CD1 4.1Å; H682-Y739 HydrophobicContact CB-CD2 3.91Å; H682-Y739 HydrophobicContact CB-CE1 4.32Å; H682-Y739 HydrophobicContact CB-CE2 4.12Å; H682-Y739 HydrophobicContact CB-CG 3.88Å; H682-Y739 AromaticContact CD2-CD2 3.5Å; H682-Y739 AromaticContact CD2-CG 3.75Å; H682-Y739 AromaticContact CG-CD2 3.92Å; H682-Y739 AromaticContact CG-CG 3.85Å; I685-Y739 HydrophobicContact CD1-CD1 3.35Å; I685-Y739 HydrophobicContact CD1-CE1 3.96Å; I685-Y739 HydrophobicContact CD1-CG 4.13Å; S735-Y739 PolarHBondContact O-N 3.12Å; G736-Y739 WeakPolarHBondContact O-CB 3.44Å; G736-Y739 PolarHBondContact O-N 2.79Å; M737-Y739 VanDerWaalsContact C-N 3.34Å; Y739-S741 PolarHBondContact O-N 2.82Å; Y739-N742 PolarHBondContact O-N 3Å; Y739-H743 AromaticContact CD1-ND1 3.64Å; Y739-H743 AromaticContact CD2-CE1 3.62Å; Y739-H743 AromaticContact CD2-ND1 3.93Å; Y739-H743 AromaticContact CE1-CE1 3.78Å; Y739-H743 AromaticContact CE1-ND1 3.53Å; Y739-H743 AromaticContact CE2-CE1 3.28Å; Y739-H743 WeakPolarHBondContact CE2-CE1 3.5Å; Y739-H743 AromaticContact CE2-ND1 3.84Å; Y739-H743 AromaticContact CG-ND1 3.85Å; Y739-H743 AromaticContact CZ-CE1 3.36Å; Y739-H743 AromaticContact CZ-ND1 3.63Å; Y739-H743 PolarHBondContact O-N 3.05Å; Y739-H743 PolarHBondContact O-ND1 2.82Å
740	L	91.3	Very high	92.8	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-59.7	-46.4	177.8	-68.8	176.9	0	0	0	112.3	F680 I685 G736 M737 N742 H743 N744 Y745 V765 F768	F680-L740 HydrophobicContact CD1-CD2 4.32Å; F680-L740 HydrophobicContact CD2-CD2 3.73Å; F680-L740 HydrophobicContact CE1-CD2 4Å; F680-L740 HydrophobicContact CE2-CD2 3.34Å; F680-L740 HydrophobicContact CG-CD2 4.2Å; F680-L740 HydrophobicContact CZ-CD2 3.51Å; I685-L740 HydrophobicContact CD1-CD1 4.5Å; I685-L740 HydrophobicContact CD1-CD2 3.67Å; I685-L740 HydrophobicContact CD1-CG 3.76Å; G736-L740 PolarHBondContact O-N 2.03Å; M737-L740 HydrophobicContact CE-CD1 4.33Å; M737-L740 PolarHBondContact O-N 2.82Å; M737-L740 HydrophobicContact SD-CD1 3.81Å; L740-N742 VanDerWaalsContact C-N 3.32Å; L740-N742 PolarHBondContact O-N 3.08Å; L740-H743 CarbonylContact O-C 3.53Å; L740-H743 WeakPolarHBondContact O-CA 3.29Å; L740-H743 PolarHBondContact O-N 3.14Å; L740-N744 PolarHBondContact O-N 2.85Å; L740-Y745 PolarHBondContact O-N 2.82Å; L740-V765 HydrophobicContact CD1-CG1 4.29Å; L740-F768 HydrophobicContact CD1-CE1 3.9Å; L740-F768 HydrophobicContact CD2-CE1 4.11Å
741	S	91	Very high	92.7	Very high	21 Å²	21	18.8 Å²	18.8	15%	0.147	10%	0.095	C	C	.	.	H	α-helix	trans	-59.9	-40.5	178.5	-179.5	0	0	0	0	112.2	M737 N738 Y739 H743 N744 T805	M737-S741 VanDerWaalsContact O-CB 3.29Å; M737-S741 WeakPolarHBondContact O-CB 3.48Å; M737-S741 PolarHBondContact O-N 2.04Å; N738-S741 PolarHBondContact O-N 2.91Å; Y739-S741 PolarHBondContact O-N 2.82Å; S741-H743 PolarHBondContact O-N 2.91Å; S741-N744 PolarHBondContact O-N 2.84Å; S741-N744 VanDerWaalsContact O-N 3.12Å; S741-T805 VanDerWaalsContact OG-CG2 3.3Å; S741-T805 WeakPolarHBondContact OG-CG2 3.47Å
742	N	90.3	Very high	92.7	Very high	79 Å²	79	17.1 Å²	17.1	42%	0.422	9%	0.087	S	C	.	.	H	α-helix	trans	-70.9	-15.4	178.4	-73.7	-30.3	0	0	0	113.6	N738 Y739 L740	N738-N742 WeakPolarHBondContact O-CB 3.1Å; N738-N742 PolarHBondContact O-N 3.09Å; N738-N742 PolarHBondContact O-ND2 2.91Å; N738-N742 VanDerWaalsContact O-ND2 3.1Å; N738-N742 PolarHBondContact OD1-ND2 2.78Å; Y739-N742 PolarHBondContact O-N 3Å; L740-N742 VanDerWaalsContact C-N 3.32Å; L740-N742 PolarHBondContact O-N 3.08Å
743	H	84.8	Confident	92.6	Very high	51 Å²	51	20.8 Å²	20.8	24%	0.236	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	13.9	173.4	-65.1	99.5	0	0	0	112.4	L596 Y739 L740 S741 Y745	L596-H743 HydrophobicContact CD1-CB 4.45Å; L596-H743 WeakPolarHBondContact CD1-CD2 3.41Å; Y739-H743 AromaticContact CD1-ND1 3.64Å; Y739-H743 AromaticContact CD2-CE1 3.62Å; Y739-H743 AromaticContact CD2-ND1 3.93Å; Y739-H743 AromaticContact CE1-CE1 3.78Å; Y739-H743 AromaticContact CE1-ND1 3.53Å; Y739-H743 AromaticContact CE2-CE1 3.28Å; Y739-H743 WeakPolarHBondContact CE2-CE1 3.5Å; Y739-H743 AromaticContact CE2-ND1 3.84Å; Y739-H743 AromaticContact CG-ND1 3.85Å; Y739-H743 AromaticContact CZ-CE1 3.36Å; Y739-H743 AromaticContact CZ-ND1 3.63Å; Y739-H743 PolarHBondContact O-N 3.05Å; Y739-H743 PolarHBondContact O-ND1 2.82Å; L740-H743 CarbonylContact O-C 3.53Å; L740-H743 WeakPolarHBondContact O-CA 3.29Å; L740-H743 PolarHBondContact O-N 3.14Å; S741-H743 PolarHBondContact O-N 2.91Å; H743-Y745 VanDerWaalsContact C-N 3.29Å; H743-Y745 HydrophobicContact CB-CD2 3.98Å; H743-Y745 HydrophobicContact CB-CE2 4.42Å; H743-Y745 WeakPolarHBondContact O-CD2 3.44Å; H743-Y745 WeakPolarHBondContact O-CE2 3.48Å; H743-Y745 PolarHBondContact O-N 3.04Å
744	N	82.6	Confident	92.4	Very high	73 Å²	73	21.3 Å²	21.3	39%	0.39	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	29.3	177.9	-61.5	-21.5	0	0	0	114.7	L740 S741 L773 L774	L740-N744 PolarHBondContact O-N 2.85Å; S741-N744 PolarHBondContact O-N 2.84Å; S741-N744 VanDerWaalsContact O-N 3.12Å; N744-L773 HydrophobicContact CB-CD1 4.25Å; N744-L774 HydrophobicContact CB-CB 4.4Å; N744-L774 PolarHBondContact O-N 3.07Å
745	Y	85.5	Confident	92.4	Very high	10 Å²	10	21.3 Å²	21.3	4%	0.039	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	139.4	173.4	-76.4	-91	0	0	0	112	I676 Q679 F680 L740 H743 T771 L773	I676-Y745 HydrophobicContact CG2-CE1 4.46Å; Q679-Y745 PolarHBondContact OE1-OH 2.79Å; Q679-Y745 VanDerWaalsContact OE1-OH 3.06Å; F680-Y745 AromaticContact CE1-CD2 3.68Å; F680-Y745 HydrophobicContact CE1-CD2 3.68Å; F680-Y745 AromaticContact CE1-CE2 3.67Å; F680-Y745 HydrophobicContact CE1-CE2 3.67Å; F680-Y745 HydrophobicContact CE1-CG 4.21Å; F680-Y745 AromaticContact CZ-CD1 3.85Å; F680-Y745 HydrophobicContact CZ-CD1 3.85Å; F680-Y745 AromaticContact CZ-CD2 3.62Å; F680-Y745 HydrophobicContact CZ-CD2 3.62Å; F680-Y745 AromaticContact CZ-CE1 3.97Å; F680-Y745 HydrophobicContact CZ-CE1 3.97Å; F680-Y745 AromaticContact CZ-CE2 3.79Å; F680-Y745 HydrophobicContact CZ-CE2 3.79Å; F680-Y745 AromaticContact CZ-CG 3.65Å; F680-Y745 HydrophobicContact CZ-CG 3.65Å; F680-Y745 AromaticContact CZ-CZ 3.95Å; L740-Y745 PolarHBondContact O-N 2.82Å; H743-Y745 VanDerWaalsContact C-N 3.29Å; H743-Y745 HydrophobicContact CB-CD2 3.98Å; H743-Y745 HydrophobicContact CB-CE2 4.42Å; H743-Y745 WeakPolarHBondContact O-CD2 3.44Å; H743-Y745 WeakPolarHBondContact O-CE2 3.48Å; H743-Y745 PolarHBondContact O-N 3.04Å; Y745-T771 HydrophobicContact CD1-CG2 3.77Å; Y745-L773 HydrophobicContact CD2-CD1 4.17Å; Y745-L773 HydrophobicContact CE1-CB 4.32Å; Y745-L773 HydrophobicContact CE1-CD1 4.32Å; Y745-L773 HydrophobicContact CE2-CD1 3.76Å
746	V	87.5	Confident	92.3	Very high	3 Å²	3	22.4 Å²	22.4	2%	0.018	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.1	169.9	-173.6	0	0	0	0	108.8	R748 T771 R772 L774 F803 T805 D808	V746-R748 HydrophobicContact CB-CG 4.22Å; V746-R748 HydrophobicContact CG1-CG 3.66Å; V746-T771 WeakPolarHBondContact O-CA 3.37Å; V746-T771 WeakPolarHBondContact O-CG2 3.35Å; V746-R772 PolarHBondContact N-O 3.46Å; V746-R772 VanDerWaalsContact N-O 3.11Å; V746-R772 PolarHBondContact O-N 2.83Å; V746-L774 HydrophobicContact CG2-CD1 3.68Å; V746-L774 HydrophobicContact CG2-CD2 3.66Å; V746-L774 HydrophobicContact CG2-CG 3.69Å; V746-F803 HydrophobicContact CG1-CB 4.31Å; V746-T805 HydrophobicContact CG2-CG2 4.44Å; V746-D808 WeakPolarHBondContact CA-OD2 3.43Å; V746-D808 VanDerWaalsContact CG1-OD2 3.26Å; V746-D808 WeakPolarHBondContact CG1-OD2 3.39Å
747	H	90.9	Very high	92.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.108	C	C	.	.			trans	-75.5	-43.6	-175.8	-173	-37.2	0	0	0	112.6	M737 D749 V765 S766 D767 T771 D808	M737-H747 HydrophobicContact CE-CB 3.82Å; M737-H747 HydrophobicContact SD-CB 4.33Å; H747-D749 PolarHBondContact CE1-O 2.87Å; H747-D749 PolarHBondContact ND1-N 3.04Å; H747-D749 PolarHBondContact O-N 2.6Å; H747-V765 WeakPolarHBondContact CD2-CG1 3.36Å; H747-V765 WeakPolarHBondContact NE2-CG1 3.34Å; H747-S766 PolarHBondContact CE1-O 2.76Å; H747-S766 PolarHBondContact NE2-O 3.49Å; H747-S766 VanDerWaalsContact NE2-O 3.07Å; H747-D767 PolarHBondContact CE1-O 3.33Å; H747-D767 VanDerWaalsContact CE1-O 3.24Å; H747-T771 PolarHBondContact O-OG1 2.67Å; H747-D808 PolarHBondContact N-OD2 2.71Å
748	R	88.9	Confident	92.2	Very high	27 Å²	27	23.6 Å²	23.6	10%	0.102	12%	0.115	C	C	.	.	S	Bend	trans	69.5	-6.7	175.1	-51.1	173.2	57.3	-148.1	4.3	116.8	V746 L770 T783 F803 D808	V746-R748 HydrophobicContact CB-CG 4.22Å; V746-R748 HydrophobicContact CG1-CG 3.66Å; R748-L770 HydrophobicContact CB-CB 4.38Å; R748-L770 WeakPolarHBondContact CD-O 3.45Å; R748-L770 PolarHBondContact NH1-O 3.46Å; R748-T783 VanDerWaalsContact NH2-CG2 3.28Å; R748-F803 HydrophobicContact CB-CD1 4.02Å; R748-F803 HydrophobicContact CB-CE1 4.24Å; R748-F803 HydrophobicContact CG-CB 4.13Å; R748-F803 HydrophobicContact CG-CD1 3.72Å; R748-F803 HydrophobicContact CG-CE1 4.38Å; R748-F803 HydrophobicContact CG-CG 4.03Å; R748-F803 VanDerWaalsContact NH2-CE2 3.32Å; R748-D808 PolarHBondContact N-OD1 3.27Å
749	D	89.7	Confident	91.9	Very high	16 Å²	16	29.5 Å²	29.5	9%	0.086	14%	0.141	C	C	.	.			trans	-143.3	47.6	172.3	-165.9	20	0	0	0	111.7	H747 A751 R753 N754 L770 P789	H747-D749 PolarHBondContact CE1-O 2.87Å; H747-D749 PolarHBondContact ND1-N 3.04Å; H747-D749 PolarHBondContact O-N 2.6Å; D749-A751 PolarHBondContact O-N 2.97Å; D749-R753 IonicContact OD1-CZ 3.86Å; D749-R753 IonicContact OD1-NH2 2.61Å; D749-R753 PolarHBondContact OD1-NH2 3.16Å; D749-R753 IonicContact OD2-CZ 3.31Å; D749-R753 IonicContact OD2-NH2 2.65Å; D749-R753 PolarHBondContact OD2-NH2 3.09Å; D749-N754 PolarHBondContact O-ND2 2.78Å; D749-N754 PolarHBondContact OD2-ND2 3.49Å; D749-L770 HydrophobicContact CB-CD1 4.05Å; D749-P789 HydrophobicContact CB-CG 4.23Å; D749-P789 VanDerWaalsContact OD1-CB 3.23Å; D749-P789 WeakPolarHBondContact OD1-CB 3.47Å; D749-P789 WeakPolarHBondContact OD1-CG 3.45Å
750	L	96.1	Very high	91.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.167	C	C	.	.			trans	-74	110.8	175.3	-177.3	67.1	0	0	0	109.8	I733 M737 I755 S811 F812 V815 F873	I733-L750 HydrophobicContact CG2-CD1 4.34Å; M737-L750 HydrophobicContact CE-CD2 4.1Å; M737-L750 HydrophobicContact CG-CD1 4.14Å; M737-L750 HydrophobicContact CG-CD2 3.82Å; M737-L750 HydrophobicContact SD-CD1 3.81Å; M737-L750 HydrophobicContact SD-CD2 4.01Å; M737-L750 HydrophobicContact SD-CG 4.44Å; L750-I755 HydrophobicContact CD1-CD1 3.88Å; L750-S811 WeakPolarHBondContact O-CB 3.23Å; L750-F812 HydrophobicContact CD2-CB 3.77Å; L750-F812 HydrophobicContact CD2-CD2 4.28Å; L750-V815 HydrophobicContact CG-CG2 4.11Å; L750-F873 HydrophobicContact CD2-CZ 4.43Å
751	A	95.9	Very high	92	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.18	C	C	.	.			trans	-150.3	156.9	-179.8	0	0	0	0	0	109.8	D749 R753 N754 I755 W792	D749-A751 PolarHBondContact O-N 2.97Å; A751-R753 HydrophobicContact CB-CG 4.03Å; A751-R753 PolarHBondContact O-N 3.06Å; A751-N754 PolarHBondContact O-N 3.46Å; A751-I755 PolarHBondContact O-N 3.35Å; A751-W792 HydrophobicContact CB-CD2 4.03Å; A751-W792 HydrophobicContact CB-CG 3.94Å; A751-W792 HydrophobicContact CB-CZ2 4.49Å
752	A	96.2	Very high	92.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-57.9	-33.7	-179.4	0	0	0	0	0	113.2	L710 D711 N754 I755 E818	L710-A752 WeakPolarHBondContact CB-O 3.39Å; D711-A752 HydrophobicContact CB-CB 3.91Å; A752-N754 PolarHBondContact O-N 2.83Å; A752-I755 PolarHBondContact O-N 2.93Å; A752-I755 VanDerWaalsContact O-N 3.07Å; A752-E818 HydrophobicContact CB-CB 3.94Å; A752-E818 HydrophobicContact CB-CG 4.41Å; A752-E818 WeakPolarHBondContact CB-OE2 3.37Å; A752-E818 PolarHBondContact N-OE2 3.01Å
753	R	93.9	Very high	92.5	Very high	78 Å²	78	32.9 Å²	32.9	29%	0.294	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-61.7	-21.7	174.1	68.2	176.8	-171.9	-77.5	-6.5	114.7	D711 D749 A751 W792	D711-R753 WeakPolarHBondContact OD1-CA 3.28Å; D749-R753 IonicContact OD1-CZ 3.86Å; D749-R753 IonicContact OD1-NH2 2.61Å; D749-R753 PolarHBondContact OD1-NH2 3.16Å; D749-R753 IonicContact OD2-CZ 3.31Å; D749-R753 IonicContact OD2-NH2 2.65Å; D749-R753 PolarHBondContact OD2-NH2 3.09Å; A751-R753 HydrophobicContact CB-CG 4.03Å; A751-R753 PolarHBondContact O-N 3.06Å; R753-W792 VanDerWaalsContact NH1-CH2 3.3Å; R753-W792 VanDerWaalsContact NH1-CZ3 3.28Å
754	N	94.7	Very high	93.1	Very high	11 Å²	11	31.7 Å²	31.7	6%	0.059	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-102.2	8.8	179.5	-66.7	-10.8	0	0	0	111.7	D749 A751 A752 S766 D767	D749-N754 PolarHBondContact O-ND2 2.78Å; D749-N754 PolarHBondContact OD2-ND2 3.49Å; A751-N754 PolarHBondContact O-N 3.46Å; A752-N754 PolarHBondContact O-N 2.83Å; N754-S766 WeakPolarHBondContact O-CA 2.98Å; N754-S766 PolarHBondContact O-N 3.09Å; N754-S766 PolarHBondContact O-OG 3.31Å; N754-D767 HydrophobicContact CB-CB 4.22Å
755	I	97.8	Very high	93.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	127.3	169.5	-53.8	-55.3	0	0	0	108.1	A709 L710 I733 L750 A751 A752 C763 K764 V765	A709-I755 CarbonylContact C-O 3.49Å; A709-I755 WeakPolarHBondContact CA-O 3.37Å; L710-I755 HydrophobicContact CB-CB 3.89Å; L710-I755 HydrophobicContact CB-CG2 4.13Å; L710-I755 WeakPolarHBondContact CB-O 3.31Å; L710-I755 HydrophobicContact CD2-CB 3.93Å; L710-I755 HydrophobicContact CD2-CG1 4.38Å; L710-I755 HydrophobicContact CD2-CG2 3.83Å; L710-I755 PolarHBondContact N-O 2.72Å; I733-I755 HydrophobicContact CD1-CG1 4.07Å; I733-I755 HydrophobicContact CD1-CG2 3.99Å; I733-I755 HydrophobicContact CG1-CD1 4.22Å; I733-I755 HydrophobicContact CG1-CG1 4.22Å; I733-I755 HydrophobicContact CG1-CG2 3.89Å; I733-I755 HydrophobicContact CG2-CD1 4.05Å; L750-I755 HydrophobicContact CD1-CD1 3.88Å; A751-I755 PolarHBondContact O-N 3.35Å; A752-I755 PolarHBondContact O-N 2.93Å; A752-I755 VanDerWaalsContact O-N 3.07Å; I755-C763 HydrophobicContact CG2-CB 3.64Å; I755-K764 WeakPolarHBondContact CA-O 3.34Å; I755-V765 HydrophobicContact CD1-CB 4.29Å; I755-V765 HydrophobicContact CD1-CG2 3.85Å
756	L	96.1	Very high	94.1	Very high	37 Å²	37	28.1 Å²	28.1	19%	0.194	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	149.3	176.3	-60.9	178.4	0	0	0	110.9	L686 M705 G708 A709 C763 K764	L686-L756 HydrophobicContact CD1-CD1 3.97Å; L686-L756 HydrophobicContact CD2-CD1 3.93Å; M705-L756 HydrophobicContact CB-CB 3.77Å; M705-L756 HydrophobicContact CB-CD1 4.25Å; M705-L756 VanDerWaalsContact CE-C 3.42Å; M705-L756 HydrophobicContact CE-CB 3.77Å; M705-L756 VanDerWaalsContact CE-O 3.25Å; M705-L756 WeakPolarHBondContact CE-O 3.45Å; M705-L756 HydrophobicContact CG-CB 3.59Å; M705-L756 HydrophobicContact CG-CD1 3.8Å; M705-L756 HydrophobicContact CG-CG 4.33Å; G708-L756 CarbonylContact O-C 3.52Å; G708-L756 WeakPolarHBondContact O-CA 3.01Å; A709-L756 HydrophobicContact CB-CD2 4.33Å; L756-C763 CarbonylContact O-C 3.56Å; L756-C763 WeakPolarHBondContact O-CA 3.37Å; L756-K764 PolarHBondContact N-O 3.07Å; L756-K764 PolarHBondContact O-N 3.33Å
757	V	96.7	Very high	93.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.4	-177	-169.9	0	0	0	0	109.7	M705 N707 G708 L710 F713 L761	M705-V757 CarbonylContact C-O 3.58Å; N707-V757 WeakPolarHBondContact CA-O 3.26Å; N707-V757 HydrophobicContact CB-CB 3.84Å; N707-V757 HydrophobicContact CB-CG1 4.01Å; N707-V757 WeakPolarHBondContact CB-O 3.05Å; N707-V757 PolarHBondContact N-O 2.74Å; G708-V757 PolarHBondContact O-N 3.06Å; L710-V757 HydrophobicContact CB-CG2 3.84Å; L710-V757 HydrophobicContact CD1-CG2 3.6Å; L710-V757 HydrophobicContact CG-CG2 4.31Å; F713-V757 HydrophobicContact CD1-CG1 4.43Å; F713-V757 HydrophobicContact CD1-CG2 4.32Å; F713-V757 HydrophobicContact CE1-CG1 4.39Å; F713-V757 HydrophobicContact CG-CG2 4.42Å; F713-V757 HydrophobicContact CZ-CG1 4.48Å; V757-L761 HydrophobicContact CG1-CD2 4.49Å
758	N	94.1	Very high	93.3	Very high	26 Å²	26	30.7 Å²	30.7	14%	0.139	15%	0.153	C	C	.	.			trans	-90.2	178.3	174.9	80.7	-13.1	0	0	0	111.4	M705 E706 N707 D760 L761 C762	M705-N758 HydrophobicContact CE-CB 3.88Å; M705-N758 HydrophobicContact SD-CB 4.07Å; E706-N758 WeakPolarHBondContact OE2-CA 3.37Å; N707-N758 PolarHBondContact ND2-O 2.75Å; N758-D760 PolarHBondContact O-N 3.04Å; N758-D760 PolarHBondContact OD1-N 3.29Å; N758-L761 PolarHBondContact O-N 2.93Å; N758-L761 VanDerWaalsContact O-N 3.09Å; N758-L761 PolarHBondContact OD1-N 2.76Å; N758-C762 PolarHBondContact N-O 2.99Å; N758-C762 VanDerWaalsContact N-O 3.16Å; N758-C762 WeakPolarHBondContact OD1-CA 3.43Å; N758-C762 WeakPolarHBondContact OD1-CB 3.28Å; N758-C762 PolarHBondContact OD1-N 3.48Å
759	Q	92.3	Very high	92.2	Very high	144 Å²	144	30.3 Å²	30.3	67%	0.673	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-31.6	178.7	-171.9	171.7	6.2	0	0	114.2	E706 L761	E706-Q759 HydrophobicContact CB-CB 4.34Å; E706-Q759 HydrophobicContact CG-CB 4.16Å; E706-Q759 PolarHBondContact OE2-N 2.89Å; Q759-L761 VanDerWaalsContact C-N 3.29Å; Q759-L761 PolarHBondContact O-N 3.39Å
760	D	93.2	Very high	90.8	Very high	134 Å²	134	32.7 Å²	32.7	72%	0.717	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	12.3	-179	-57.4	-48.7	0	0	0	113.8	N758 C762	N758-D760 PolarHBondContact O-N 3.04Å; N758-D760 PolarHBondContact OD1-N 3.29Å; D760-C762 PolarHBondContact O-N 2.87Å
761	L	92.9	Very high	89.3	Confident	49 Å²	49	32.7 Å²	32.7	26%	0.257	17%	0.17	S	C	.	.			trans	63.7	18.5	-174.6	-49.7	-179.1	0	0	0	114.3	F713 Q725 M729 V757 N758 Q759 C763	F713-L761 HydrophobicContact CE1-CD2 4.08Å; F713-L761 HydrophobicContact CE2-CD2 4.14Å; F713-L761 HydrophobicContact CZ-CD2 3.36Å; Q725-L761 HydrophobicContact CG-CD1 4.38Å; M729-L761 HydrophobicContact CE-CB 3.99Å; M729-L761 HydrophobicContact CE-CD1 4.32Å; M729-L761 HydrophobicContact CE-CD2 4.23Å; M729-L761 HydrophobicContact CE-CG 4.43Å; V757-L761 HydrophobicContact CG1-CD2 4.49Å; N758-L761 PolarHBondContact O-N 2.93Å; N758-L761 VanDerWaalsContact O-N 3.09Å; N758-L761 PolarHBondContact OD1-N 2.76Å; Q759-L761 VanDerWaalsContact C-N 3.29Å; Q759-L761 PolarHBondContact O-N 3.39Å; L761-C763 PolarHBondContact O-N 3.26Å
762	C	95.3	Very high	87.9	Confident	31 Å²	31	36 Å²	36	21%	0.209	18%	0.183	C	C	.	.			trans	-75.9	120.5	174.3	-173.9	0	0	0	0	109.9	H684 N758 D760	H684-C762 PolarHBondContact CE1-SG 3.01Å; H684-C762 PolarHBondContact ND1-SG 2.6Å; N758-C762 PolarHBondContact N-O 2.99Å; N758-C762 VanDerWaalsContact N-O 3.16Å; N758-C762 WeakPolarHBondContact OD1-CA 3.43Å; N758-C762 WeakPolarHBondContact OD1-CB 3.28Å; N758-C762 PolarHBondContact OD1-N 3.48Å; D760-C762 PolarHBondContact O-N 2.87Å
763	C	97.5	Very high	86	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.007	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	132.7	175.1	-71.3	0	0	0	0	111.3	H684 M729 I733 I755 L756 L761	H684-C763 PolarHBondContact ND1-O 3.4Å; M729-C763 VanDerWaalsContact CB-SG 3.54Å; M729-C763 VanDerWaalsContact CG-SG 3.57Å; I733-C763 HydrophobicContact CD1-CB 4.28Å; I733-C763 HydrophobicContact CG1-CB 3.76Å; I755-C763 HydrophobicContact CG2-CB 3.64Å; L756-C763 CarbonylContact O-C 3.56Å; L756-C763 WeakPolarHBondContact O-CA 3.37Å; L761-C763 PolarHBondContact O-N 3.26Å
764	K	97	Very high	84.2	Confident	25 Å²	25	35.9 Å²	35.9	11%	0.109	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	132.1	174.8	-57.5	-167.2	179	-164.1	0	111.4	P683 H684 E703 M705 I755 L756	P683-K764 WeakPolarHBondContact O-CE 3.39Å; H684-K764 WeakPolarHBondContact O-CA 3.33Å; E703-K764 VanDerWaalsContact OE1-CD 3.23Å; E703-K764 WeakPolarHBondContact OE1-CD 3.31Å; E703-K764 IonicContact OE1-NZ 2.77Å; E703-K764 PolarHBondContact OE1-NZ 3.45Å; E703-K764 IonicContact OE2-NZ 3.51Å; E703-K764 PolarHBondContact OE2-NZ 2.76Å; M705-K764 HydrophobicContact CE-CB 3.91Å; M705-K764 HydrophobicContact CE-CD 3.88Å; M705-K764 HydrophobicContact CE-CG 3.7Å; M705-K764 HydrophobicContact SD-CD 4Å; M705-K764 HydrophobicContact SD-CG 4.48Å; I755-K764 WeakPolarHBondContact CA-O 3.34Å; L756-K764 PolarHBondContact N-O 3.07Å; L756-K764 PolarHBondContact O-N 3.33Å
765	V	96.7	Very high	82.1	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	130.6	174.9	179.1	0	0	0	0	109.7	H684 L686 I733 M737 L740 H747 I755 F768	H684-V765 PolarHBondContact O-N 2.86Å; L686-V765 WeakPolarHBondContact CB-O 3.5Å; L686-V765 PolarHBondContact N-O 2.78Å; I733-V765 HydrophobicContact CG2-CG2 4.38Å; M737-V765 HydrophobicContact CG-CG2 4.34Å; M737-V765 HydrophobicContact SD-CG1 4.07Å; M737-V765 HydrophobicContact SD-CG2 4.22Å; L740-V765 HydrophobicContact CD1-CG1 4.29Å; H747-V765 WeakPolarHBondContact CD2-CG1 3.36Å; H747-V765 WeakPolarHBondContact NE2-CG1 3.34Å; I755-V765 HydrophobicContact CD1-CB 4.29Å; I755-V765 HydrophobicContact CD1-CG2 3.85Å; V765-F768 HydrophobicContact CG1-CZ 4.24Å
766	S	92.1	Very high	79.5	Confident	9 Å²	9	48.2 Å²	48.2	6%	0.063	25%	0.253	C	S	.	.			trans	-137.5	-177.7	-176.2	74.4	0	0	0	0	112	H747 N754	H747-S766 PolarHBondContact CE1-O 2.76Å; H747-S766 PolarHBondContact NE2-O 3.49Å; H747-S766 VanDerWaalsContact NE2-O 3.07Å; N754-S766 WeakPolarHBondContact O-CA 2.98Å; N754-S766 PolarHBondContact O-N 3.09Å; N754-S766 PolarHBondContact O-OG 3.31Å
767	D	83.1	Confident	76.9	Confident	56 Å²	56	55.8 Å²	55.8	30%	0.299	29%	0.285	S	S	.	.			trans	58.4	77.1	-179.3	-163.3	-0.3	0	0	0	114.6	H747 N754 G769	H747-D767 PolarHBondContact CE1-O 3.33Å; H747-D767 VanDerWaalsContact CE1-O 3.24Å; N754-D767 HydrophobicContact CB-CB 4.22Å; D767-G769 VanDerWaalsContact C-N 3.29Å; D767-G769 PolarHBondContact O-N 3.03Å; D767-G769 PolarHBondContact OD1-N 2.72Å
768	F	80.1	Confident	74.3	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.321	C	S	.	.			trans	-89.7	14.7	-179.2	-62.7	-88.5	0	0	0	113.6	E673 I676 M677 F680 I685 L740 V765 L770 T771	E673-F768 HydrophobicContact CG-CB 4.24Å; I676-F768 HydrophobicContact CB-CB 4.28Å; I676-F768 HydrophobicContact CG2-CB 3.87Å; I676-F768 HydrophobicContact CG2-CD1 3.89Å; I676-F768 HydrophobicContact CG2-CG 4.02Å; M677-F768 HydrophobicContact CG-CB 4.49Å; M677-F768 HydrophobicContact CG-CD2 3.26Å; M677-F768 HydrophobicContact CG-CE2 3.72Å; M677-F768 HydrophobicContact CG-CG 4.09Å; M677-F768 HydrophobicContact SD-CD2 3.86Å; M677-F768 HydrophobicContact SD-CE2 4.27Å; F680-F768 HydrophobicContact CD2-CE1 4.18Å; F680-F768 HydrophobicContact CD2-CZ 4.39Å; F680-F768 HydrophobicContact CE2-CD1 4.13Å; F680-F768 AromaticContact CE2-CE1 3.94Å; F680-F768 HydrophobicContact CE2-CE1 3.94Å; I685-F768 HydrophobicContact CG2-CE2 4.27Å; I685-F768 HydrophobicContact CG2-CZ 3.79Å; L740-F768 HydrophobicContact CD1-CE1 3.9Å; L740-F768 HydrophobicContact CD2-CE1 4.11Å; V765-F768 HydrophobicContact CG1-CZ 4.24Å; F768-L770 PolarHBondContact O-N 2.89Å; F768-L770 VanDerWaalsContact O-N 3.14Å; F768-T771 WeakPolarHBondContact CA-OG1 3.47Å; F768-T771 HydrophobicContact CD1-CG2 4.07Å; F768-T771 WeakPolarHBondContact CD1-OG1 3.49Å; F768-T771 WeakPolarHBondContact O-CB 3.34Å; F768-T771 PolarHBondContact O-N 2.9Å
769	G	64.9	Low	71.9	Confident	20 Å²	20	62.8 Å²	62.8	21%	0.206	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-29	-175.1	0	0	0	0	0	113.9	D767	D767-G769 VanDerWaalsContact C-N 3.29Å; D767-G769 PolarHBondContact O-N 3.03Å; D767-G769 PolarHBondContact OD1-N 2.72Å
770	L	60.1	Low	69.2	Low	66 Å²	66	58.2 Å²	58.2	35%	0.346	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-7.8	178.1	-63.8	177.5	0	0	0	114.1	R748 D749 F768	R748-L770 HydrophobicContact CB-CB 4.38Å; R748-L770 WeakPolarHBondContact CD-O 3.45Å; R748-L770 PolarHBondContact NH1-O 3.46Å; D749-L770 HydrophobicContact CB-CD1 4.05Å; F768-L770 PolarHBondContact O-N 2.89Å; F768-L770 VanDerWaalsContact O-N 3.14Å
771	T	65.6	Low	67.1	Low	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.289	C	S	.	.			trans	-64.2	142.1	-173.9	-62.3	0	0	0	0	112.8	R672 I676 Y745 V746 H747 F768	R672-T771 PolarHBondContact NH2-O 3.01Å; I676-T771 HydrophobicContact CD1-CG2 4.3Å; I676-T771 HydrophobicContact CG2-CG2 3.95Å; Y745-T771 HydrophobicContact CD1-CG2 3.77Å; V746-T771 WeakPolarHBondContact O-CA 3.37Å; V746-T771 WeakPolarHBondContact O-CG2 3.35Å; H747-T771 PolarHBondContact O-OG1 2.67Å; F768-T771 WeakPolarHBondContact CA-OG1 3.47Å; F768-T771 HydrophobicContact CD1-CG2 4.07Å; F768-T771 WeakPolarHBondContact CD1-OG1 3.49Å; F768-T771 WeakPolarHBondContact O-CB 3.34Å; F768-T771 PolarHBondContact O-N 2.9Å
772	R	65.1	Low	65	Low	70 Å²	70	59.5 Å²	59.5	26%	0.264	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	151	-177.9	-67.9	-86	169.8	-171.2	3.3	111	Y599 R672 V746 Y781	Y599-R772 PolarHBondContact OH-NH1 2.91Å; R672-R772 VanDerWaalsContact CZ-NH1 3.31Å; R672-R772 VanDerWaalsContact NH2-NE 3.11Å; V746-R772 PolarHBondContact N-O 3.46Å; V746-R772 VanDerWaalsContact N-O 3.11Å; V746-R772 PolarHBondContact O-N 2.83Å; R772-Y781 HydrophobicContact CB-CE1 4.4Å; R772-Y781 HydrophobicContact CG-CD1 4.41Å; R772-Y781 HydrophobicContact CG-CE1 3.85Å
773	L	57.7	Low	62.8	Low	57 Å²	57	59 Å²	59	30%	0.298	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	141.6	169.8	-174	74.7	0	0	0	109.5	Y599 N744 Y745	Y599-L773 HydrophobicContact CD2-CB 4.03Å; Y599-L773 HydrophobicContact CG-CB 4.12Å; Y599-L773 HydrophobicContact CG-CD2 4.2Å; N744-L773 HydrophobicContact CB-CD1 4.25Å; Y745-L773 HydrophobicContact CD2-CD1 4.17Å; Y745-L773 HydrophobicContact CE1-CB 4.32Å; Y745-L773 HydrophobicContact CE1-CD1 4.32Å; Y745-L773 HydrophobicContact CE2-CD1 3.76Å
774	L	55.8	Low	59.9	Low	18 Å²	18	68.9 Å²	68.9	9%	0.094	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-83.1	137.3	172.9	-67.3	171.6	0	0	0	111.6	N744 V746 T805	N744-L774 HydrophobicContact CB-CB 4.4Å; N744-L774 PolarHBondContact O-N 3.07Å; V746-L774 HydrophobicContact CG2-CD1 3.68Å; V746-L774 HydrophobicContact CG2-CD2 3.66Å; V746-L774 HydrophobicContact CG2-CG 3.69Å; L774-T805 HydrophobicContact CD1-CG2 4.13Å
775	D	50.5	Low	57.3	Low	124 Å²	124	70.3 Å²	70.3	66%	0.663	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-79	136.1	170.5	-78.7	-30.7	0	0	0	111.2	F777 G779	D775-F777 PolarHBondContact O-N 2.97Å; D775-G779 PolarHBondContact O-N 2.03Å
776	D	43.2	Very low	55.1	Low	146 Å²	146	73 Å²	73	78%	0.781	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-6.2	-168.3	-75.2	-32.6	0	0	0	115.9
777	F	41.5	Very low	53.5	Low	196 Å²	196	82.3 Å²	82.3	86%	0.86	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-20	-170.6	-98.3	-90.7	0	0	0	116	D775	D775-F777 PolarHBondContact O-N 2.97Å
778	D	41.7	Very low	53	Low	141 Å²	141	80.9 Å²	80.9	75%	0.754	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-156	0.2	176.6	-100.2	-28.8	0	0	0	114.6	T780	D778-T780 PolarHBondContact O-N 3.45Å; D778-T780 VanDerWaalsContact O-N 3.15Å
779	G	43.7	Very low	53.3	Low	31 Å²	31	81.8 Å²	81.8	32%	0.32	44%	0.439	S	S	.	.	S	Bend	trans	63.6	17.9	179.4	0	0	0	0	0	114.6	D775 T804	D775-G779 PolarHBondContact O-N 2.03Å; G779-T804 VanDerWaalsContact O-CG2 3.31Å; G779-T804 WeakPolarHBondContact O-CG2 3.39Å
780	T	36	Very low	54.3	Low	48 Å²	48	82 Å²	82	29%	0.294	44%	0.435	S	S	.	.			trans	-122.3	134.6	-178.6	52.1	0	0	0	0	111.7	D778 I802 T804 R867	D778-T780 PolarHBondContact O-N 3.45Å; D778-T780 VanDerWaalsContact O-N 3.15Å; T780-I802 HydrophobicContact CG2-CG2 3.73Å; T780-T804 HydrophobicContact CG2-CG2 3.91Å; T780-R867 VanDerWaalsContact CG2-NH1 3.28Å
781	Y	48.4	Very low	55.8	Low	65 Å²	65	79.9 Å²	79.9	26%	0.255	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.3	174.5	176.1	-111.7	0	0	0	110.8	R772 T783 F803	R772-Y781 HydrophobicContact CB-CE1 4.4Å; R772-Y781 HydrophobicContact CG-CD1 4.41Å; R772-Y781 HydrophobicContact CG-CE1 3.85Å; Y781-T783 HydrophobicContact CD1-CG2 3.9Å; Y781-T783 HydrophobicContact CE1-CG2 3.11Å; Y781-F803 PolarHBondContact N-O 3.04Å; Y781-F803 PolarHBondContact O-N 2.83Å; Y781-F803 VanDerWaalsContact O-N 3.13Å
782	E	49.6	Very low	57.2	Low	145 Å²	145	81.5 Å²	81.5	68%	0.678	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.1	176	-68.7	-176.3	179.3	0	0	110.7	I802	E782-I802 HydrophobicContact CG-CG1 4.47Å
783	T	47.7	Very low	58.5	Low	21 Å²	21	78.4 Å²	78.4	13%	0.129	42%	0.417	C	S	.	.			trans	-103.4	135.3	174.7	54	0	0	0	0	113.5	R748 Y781 G785	R748-T783 VanDerWaalsContact NH2-CG2 3.28Å; Y781-T783 HydrophobicContact CD1-CG2 3.9Å; Y781-T783 HydrophobicContact CE1-CG2 3.11Å; T783-G785 PolarHBondContact O-N 2.89Å
784	Q	36.9	Very low	60.3	Low	208 Å²	208	75.7 Å²	75.7	97%	0.972	40%	0.403	S	S	*	.	S	Bend	trans	-86.7	87.5	163.9	-61.8	-167.4	-2.9	0	0	110.5
785	G	41.9	Very low	62	Low	56 Å²	56	75.2 Å²	75.2	58%	0.577	40%	0.401	S	S	*	.	S	Bend	trans	96.2	158.2	173.6	0	0	0	0	0	116.7	T783	T783-G785 PolarHBondContact O-N 2.89Å
786	G	51.1	Low	64	Low	56 Å²	56	70.4 Å²	70.4	58%	0.577	37%	0.374	S	S	*	.			trans	130.7	147.5	179.5	0	0	0	0	0	114.5	R801	G786-R801 PolarHBondContact O-NH1 3.09Å
787	K	59	Low	66.1	Low	205 Å²	205	63.4 Å²	63.4	89%	0.891	34%	0.337	S	S	*	.			trans	-66.5	134.2	172	-72	-178.4	-179.3	175.5	0	109.3
788	I	72.8	Confident	68.1	Low	25 Å²	25	55.6 Å²	55.6	13%	0.128	30%	0.304	C	S	.	.			trans	-114	136.7	177	-71.6	-177.1	0	0	0	109.2	I790 T793 R801 F803	I788-I790 VanDerWaalsContact C-N 3.25Å; I788-I790 HydrophobicContact CB-CD1 4.14Å; I788-I790 HydrophobicContact CG2-CD1 3.92Å; I788-I790 PolarHBondContact O-N 2.73Å; I788-T793 HydrophobicContact CG2-CG2 3.63Å; I788-T793 WeakPolarHBondContact CG2-OG1 3.44Å; I788-R801 VanDerWaalsContact CG1-NH1 3.3Å; I788-F803 HydrophobicContact CD1-CZ 3.78Å; I788-F803 HydrophobicContact CG1-CZ 4.25Å
789	P	85.3	Confident	70.1	Confident	20 Å²	20	51.8 Å²	51.8	13%	0.13	29%	0.292	C	S	.	.			trans	-73.7	76.2	173	34.5	-38.7	0	0	0	110.6	D749 R791 W792 T793	D749-P789 HydrophobicContact CB-CG 4.23Å; D749-P789 VanDerWaalsContact OD1-CB 3.23Å; D749-P789 WeakPolarHBondContact OD1-CB 3.47Å; D749-P789 WeakPolarHBondContact OD1-CG 3.45Å; P789-R791 VanDerWaalsContact C-N 3.27Å; P789-R791 PolarHBondContact O-N 3.22Å; P789-W792 HydrophobicContact CB-CE3 4.07Å; P789-W792 PolarHBondContact O-N 3.34Å; P789-T793 PolarHBondContact O-N 2.78Å; P789-T793 PolarHBondContact O-OG1 2.99Å
790	I	86.9	Confident	71.8	Confident	23 Å²	23	56.4 Å²	56.4	12%	0.118	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-46.5	-43.5	-167.4	-64.7	-58.7	0	0	0	114.2	I788 W792 T793 I798 N832 V835 M836	I788-I790 VanDerWaalsContact C-N 3.25Å; I788-I790 HydrophobicContact CB-CD1 4.14Å; I788-I790 HydrophobicContact CG2-CD1 3.92Å; I788-I790 PolarHBondContact O-N 2.73Å; I790-W792 PolarHBondContact O-N 3.42Å; I790-T793 PolarHBondContact O-N 2.74Å; I790-I798 HydrophobicContact CD1-CG1 4.45Å; I790-I798 HydrophobicContact CG2-CD1 4.49Å; I790-N832 HydrophobicContact CB-CB 4.05Å; I790-N832 HydrophobicContact CG1-CB 4.08Å; I790-N832 HydrophobicContact CG2-CB 4.06Å; I790-N832 WeakPolarHBondContact CG2-O 3.29Å; I790-V835 HydrophobicContact CG2-CB 4.48Å; I790-V835 HydrophobicContact CG2-CG1 4.35Å; I790-M836 HydrophobicContact CD1-CG 4.4Å; I790-M836 HydrophobicContact CD1-SD 3.81Å; I790-M836 HydrophobicContact CG1-SD 4.41Å; I790-M836 HydrophobicContact CG2-CG 3.47Å; I790-M836 VanDerWaalsContact CG2-CG 3.47Å; I790-M836 HydrophobicContact CG2-SD 4.19Å
791	R	91.3	Very high	73.9	Confident	23 Å²	23	58 Å²	58	9%	0.087	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-67.5	-20.9	-175.4	-59.3	171.6	-175.8	-93.9	0.6	114.6	P789 P826 Y827 G828 M830 V835	P789-R791 VanDerWaalsContact C-N 3.27Å; P789-R791 PolarHBondContact O-N 3.22Å; R791-P826 HydrophobicContact CB-CB 4.38Å; R791-P826 WeakPolarHBondContact CD-O 3.22Å; R791-P826 PolarHBondContact NH1-O 3.14Å; R791-Y827 HydrophobicContact CB-CD2 4.14Å; R791-Y827 HydrophobicContact CG-CD2 4.4Å; R791-Y827 WeakPolarHBondContact O-CE2 3.46Å; R791-G828 PolarHBondContact NH1-O 2.65Å; R791-M830 PolarHBondContact NH1-O 3.28Å; R791-M830 PolarHBondContact NH2-O 2.85Å; R791-V835 HydrophobicContact CG-CG1 4.4Å; R791-V835 HydrophobicContact CG-CG2 4.35Å
792	W	95.1	Very high	75.5	Confident	34 Å²	34	56.4 Å²	56.4	13%	0.129	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-105.7	-5.8	178.8	-62.7	-98.2	0	0	0	112.3	A751 R753 P789 I790 S811 I814 E818 P826	A751-W792 HydrophobicContact CB-CD2 4.03Å; A751-W792 HydrophobicContact CB-CG 3.94Å; A751-W792 HydrophobicContact CB-CZ2 4.49Å; R753-W792 VanDerWaalsContact NH1-CH2 3.3Å; R753-W792 VanDerWaalsContact NH1-CZ3 3.28Å; P789-W792 HydrophobicContact CB-CE3 4.07Å; P789-W792 PolarHBondContact O-N 3.34Å; I790-W792 PolarHBondContact O-N 3.42Å; W792-S811 VanDerWaalsContact O-CA 3.29Å; W792-S811 WeakPolarHBondContact O-CA 3.35Å; W792-S811 VanDerWaalsContact O-CB 3.32Å; W792-S811 WeakPolarHBondContact O-CB 3.41Å; W792-S811 PolarHBondContact O-OG 2.75Å; W792-I814 HydrophobicContact CG-CG2 4.05Å; W792-E818 VanDerWaalsContact CZ2-OE1 3.31Å; W792-E818 WeakPolarHBondContact CZ2-OE1 3.03Å; W792-E818 PolarHBondContact NE1-OE1 2.03Å; W792-E818 VanDerWaalsContact NE1-OE1 3.09Å; W792-E818 PolarHBondContact NE1-OE2 3.26Å; W792-P826 HydrophobicContact CZ2-CG 3.89Å
793	T	92.8	Very high	77.1	Confident	4 Å²	4	49.8 Å²	49.8	3%	0.025	27%	0.27	C	S	.	.	S	Bend	trans	-92.1	139.6	-169.7	-54.8	0	0	0	0	111.5	I788 P789 I790 A797 I798 F803 W810	I788-T793 HydrophobicContact CG2-CG2 3.63Å; I788-T793 WeakPolarHBondContact CG2-OG1 3.44Å; P789-T793 PolarHBondContact O-N 2.78Å; P789-T793 PolarHBondContact O-OG1 2.99Å; I790-T793 PolarHBondContact O-N 2.74Å; T793-A797 HydrophobicContact CG2-CB 3.49Å; T793-A797 VanDerWaalsContact CG2-CB 3.49Å; T793-I798 HydrophobicContact CG2-CG1 3.73Å; T793-I798 WeakPolarHBondContact O-CD1 3.07Å; T793-F803 HydrophobicContact CG2-CE1 4.46Å; T793-W810 PolarHBondContact O-NE1 2.87Å
794	A	94.7	Very high	79.1	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.267	C	S	.	.			trans	-66.9	152.1	176.9	0	0	0	0	0	112.8	E796 A797 I798 W810	A794-E796 VanDerWaalsContact C-N 3.33Å; A794-E796 WeakPolarHBondContact CB-OE1 3.02Å; A794-E796 WeakPolarHBondContact CB-OE2 3.2Å; A794-E796 PolarHBondContact O-N 3.42Å; A794-A797 HydrophobicContact CB-CB 4.43Å; A794-A797 PolarHBondContact O-N 3.2Å; A794-I798 WeakPolarHBondContact O-CG1 3.27Å; A794-I798 PolarHBondContact O-N 2.85Å; A794-W810 HydrophobicContact CB-CB 3.71Å; A794-W810 HydrophobicContact CB-CD2 4.15Å; A794-W810 HydrophobicContact CB-CG 3.76Å
795	P	92.8	Very high	81.8	Confident	8 Å²	8	40.7 Å²	40.7	5%	0.052	23%	0.229	C	C	.	.	H	α-helix	trans	-57.3	-41.3	-177.7	20.7	-32.2	0	0	0	113.2	A797 I798 A799 W810 I839 Y865	P795-A797 VanDerWaalsContact C-N 3.3Å; P795-A797 PolarHBondContact O-N 2.82Å; P795-I798 PolarHBondContact O-N 3Å; P795-A799 WeakPolarHBondContact O-CB 3.33Å; P795-A799 PolarHBondContact O-N 3.34Å; P795-W810 HydrophobicContact CG-CE3 4.46Å; P795-W810 HydrophobicContact CG-CH2 4.17Å; P795-W810 HydrophobicContact CG-CZ3 3.98Å; P795-I839 HydrophobicContact CB-CG2 4.07Å; P795-I839 HydrophobicContact CG-CG2 4.44Å; P795-Y865 HydrophobicContact CB-CD2 4.5Å; P795-Y865 HydrophobicContact CB-CE2 4.22Å; P795-Y865 HydrophobicContact CG-CD2 4.28Å; P795-Y865 HydrophobicContact CG-CE2 4.47Å
796	E	91.1	Very high	84.3	Confident	23 Å²	23	39 Å²	39	11%	0.107	21%	0.209	C	C	.	.	H	α-helix	trans	-67.2	-30.2	178.2	72.5	-79.4	-168.8	0	0	113.2	A794 H800 R801 I802 R870	A794-E796 VanDerWaalsContact C-N 3.33Å; A794-E796 WeakPolarHBondContact CB-OE1 3.02Å; A794-E796 WeakPolarHBondContact CB-OE2 3.2Å; A794-E796 PolarHBondContact O-N 3.42Å; E796-H800 CarbonylContact O-C 3.56Å; E796-H800 WeakPolarHBondContact O-CA 3.37Å; E796-H800 WeakPolarHBondContact O-CB 3.47Å; E796-H800 PolarHBondContact O-N 3.49Å; E796-R801 PolarHBondContact O-N 2.97Å; E796-I802 PolarHBondContact O-N 2.77Å; E796-R870 IonicContact OE1-CZ 2.86Å; E796-R870 IonicContact OE1-NH1 2.91Å; E796-R870 PolarHBondContact OE1-NH1 2.78Å; E796-R870 IonicContact OE1-NH2 3.68Å; E796-R870 PolarHBondContact OE1-NH2 3.48Å; E796-R870 IonicContact OE2-CZ 3.89Å; E796-R870 IonicContact OE2-NH1 3.9Å; E796-R870 PolarHBondContact OE2-NH1 3.4Å; E796-R870 IonicContact OE2-NH2 3.95Å; E796-R870 PolarHBondContact OE2-NH2 3.08Å
797	A	87.8	Confident	86.4	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-79	-30.7	176.5	0	0	0	0	0	111.7	T793 A794 P795 R801 I802 F803	T793-A797 HydrophobicContact CG2-CB 3.49Å; T793-A797 VanDerWaalsContact CG2-CB 3.49Å; A794-A797 HydrophobicContact CB-CB 4.43Å; A794-A797 PolarHBondContact O-N 3.2Å; P795-A797 VanDerWaalsContact C-N 3.3Å; P795-A797 PolarHBondContact O-N 2.82Å; A797-R801 VanDerWaalsContact O-CA 3.25Å; A797-R801 WeakPolarHBondContact O-CA 3.03Å; A797-R801 PolarHBondContact O-N 2.99Å; A797-I802 WeakPolarHBondContact CA-O 3.12Å; A797-I802 WeakPolarHBondContact CB-O 3.42Å; A797-F803 HydrophobicContact CB-CD1 3.93Å; A797-F803 HydrophobicContact CB-CE1 3.83Å; A797-F803 HydrophobicContact CB-CG 4.5Å; A797-F803 HydrophobicContact CB-CZ 4.28Å
798	I	84.6	Confident	88.1	Confident	31 Å²	31	26.8 Å²	26.8	16%	0.159	14%	0.141	C	C	.	.	H	α-helix	trans	-70.1	-53.5	172	-66.8	168.8	0	0	0	110.3	I790 T793 A794 P795 M836 I839	I790-I798 HydrophobicContact CD1-CG1 4.45Å; I790-I798 HydrophobicContact CG2-CD1 4.49Å; T793-I798 HydrophobicContact CG2-CG1 3.73Å; T793-I798 WeakPolarHBondContact O-CD1 3.07Å; A794-I798 WeakPolarHBondContact O-CG1 3.27Å; A794-I798 PolarHBondContact O-N 2.85Å; P795-I798 PolarHBondContact O-N 3Å; I798-M836 HydrophobicContact CD1-CG 4.37Å; I798-M836 HydrophobicContact CG2-CG 3.86Å; I798-M836 HydrophobicContact CG2-SD 3.68Å; I798-I839 HydrophobicContact CD1-CD1 4.46Å
799	A	82.9	Confident	89.4	Confident	61 Å²	61	25.7 Å²	25.7	50%	0.504	14%	0.135	S	C	.	.	H	α-helix	trans	-76.6	-43.7	-170.8	0	0	0	0	0	113.1	P795	P795-A799 WeakPolarHBondContact O-CB 3.33Å; P795-A799 PolarHBondContact O-N 3.34Å
800	H	79.8	Confident	90	Very high	128 Å²	128	24.7 Å²	24.7	59%	0.593	13%	0.129	S	C	*	.	S	Bend	trans	-116.9	1.5	-170.4	-55.1	-59.4	0	0	0	113.3	E796 I802	E796-H800 CarbonylContact O-C 3.56Å; E796-H800 WeakPolarHBondContact O-CA 3.37Å; E796-H800 WeakPolarHBondContact O-CB 3.47Å; E796-H800 PolarHBondContact O-N 3.49Å; H800-I802 HydrophobicContact CB-CD1 3.61Å; H800-I802 HydrophobicContact CB-CG1 3.75Å; H800-I802 PolarHBondContact O-N 3.28Å
801	R	79.1	Confident	90.5	Very high	81 Å²	81	23.9 Å²	23.9	31%	0.306	13%	0.125	S	C	.	.			trans	57.3	26.6	-176	-58.5	-68.2	179.4	142.1	-7	113.2	G786 I788 E796 A797 F803	G786-R801 PolarHBondContact O-NH1 3.09Å; I788-R801 VanDerWaalsContact CG1-NH1 3.3Å; E796-R801 PolarHBondContact O-N 2.97Å; A797-R801 VanDerWaalsContact O-CA 3.25Å; A797-R801 WeakPolarHBondContact O-CA 3.03Å; A797-R801 PolarHBondContact O-N 2.99Å; R801-F803 VanDerWaalsContact O-CD2 3.26Å; R801-F803 WeakPolarHBondContact O-CD2 3.33Å
802	I	81.4	Confident	90.8	Very high	32 Å²	32	22.8 Å²	22.8	16%	0.164	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	108.1	179.6	-60.5	170.6	0	0	0	109.4	T780 E782 E796 A797 H800 T804 R867	T780-I802 HydrophobicContact CG2-CG2 3.73Å; E782-I802 HydrophobicContact CG-CG1 4.47Å; E796-I802 PolarHBondContact O-N 2.77Å; A797-I802 WeakPolarHBondContact CA-O 3.12Å; A797-I802 WeakPolarHBondContact CB-O 3.42Å; H800-I802 HydrophobicContact CB-CD1 3.61Å; H800-I802 HydrophobicContact CB-CG1 3.75Å; H800-I802 PolarHBondContact O-N 3.28Å; I802-T804 HydrophobicContact CG2-CG2 4.03Å; I802-R867 VanDerWaalsContact CG2-NH1 3.25Å
803	F	83.8	Confident	91	Very high	6 Å²	6	21.2 Å²	21.2	3%	0.026	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	131	177	-62.9	-88.2	0	0	0	111	V746 R748 Y781 I788 T793 A797 R801	V746-F803 HydrophobicContact CG1-CB 4.31Å; R748-F803 HydrophobicContact CB-CD1 4.02Å; R748-F803 HydrophobicContact CB-CE1 4.24Å; R748-F803 HydrophobicContact CG-CB 4.13Å; R748-F803 HydrophobicContact CG-CD1 3.72Å; R748-F803 HydrophobicContact CG-CE1 4.38Å; R748-F803 HydrophobicContact CG-CG 4.03Å; R748-F803 VanDerWaalsContact NH2-CE2 3.32Å; Y781-F803 PolarHBondContact N-O 3.04Å; Y781-F803 PolarHBondContact O-N 2.83Å; Y781-F803 VanDerWaalsContact O-N 3.13Å; I788-F803 HydrophobicContact CD1-CZ 3.78Å; I788-F803 HydrophobicContact CG1-CZ 4.25Å; T793-F803 HydrophobicContact CG2-CE1 4.46Å; A797-F803 HydrophobicContact CB-CD1 3.93Å; A797-F803 HydrophobicContact CB-CE1 3.83Å; A797-F803 HydrophobicContact CB-CG 4.5Å; A797-F803 HydrophobicContact CB-CZ 4.28Å; R801-F803 VanDerWaalsContact O-CD2 3.26Å; R801-F803 WeakPolarHBondContact O-CD2 3.33Å
804	T	90.3	Very high	91.2	Very high	9 Å²	9	21 Å²	21	6%	0.055	11%	0.114	C	C	.	.			trans	-146	169.5	-178.4	66.3	0	0	0	0	110.7	G779 T780 I802 A806 S807 D808	G779-T804 VanDerWaalsContact O-CG2 3.31Å; G779-T804 WeakPolarHBondContact O-CG2 3.39Å; T780-T804 HydrophobicContact CG2-CG2 3.91Å; I802-T804 HydrophobicContact CG2-CG2 4.03Å; T804-A806 PolarHBondContact O-N 2.91Å; T804-A806 PolarHBondContact OG1-N 2.76Å; T804-S807 PolarHBondContact N-OG 2.92Å; T804-S807 WeakPolarHBondContact O-CA 3.48Å; T804-S807 WeakPolarHBondContact O-CB 3.36Å; T804-S807 PolarHBondContact O-N 2.8Å; T804-S807 PolarHBondContact O-OG 3.08Å; T804-S807 PolarHBondContact OG1-N 3.11Å; T804-D808 PolarHBondContact O-N 3.47Å
805	T	92.6	Very high	91.3	Very high	30 Å²	30	21 Å²	21	18%	0.184	11%	0.114	C	C	.	.	H	α-helix	trans	-57.1	-32.9	170.6	53.9	0	0	0	0	112.1	S741 V746 L774 S807 D808 V809	S741-T805 VanDerWaalsContact OG-CG2 3.3Å; S741-T805 WeakPolarHBondContact OG-CG2 3.47Å; V746-T805 HydrophobicContact CG2-CG2 4.44Å; L774-T805 HydrophobicContact CD1-CG2 4.13Å; T805-S807 VanDerWaalsContact C-N 3.31Å; T805-S807 PolarHBondContact O-N 2.94Å; T805-D808 PolarHBondContact O-N 3.27Å; T805-V809 WeakPolarHBondContact O-CG2 3.34Å; T805-V809 PolarHBondContact O-N 2.83Å
806	A	95.6	Very high	91.6	Very high	19 Å²	19	20.6 Å²	20.6	16%	0.157	11%	0.111	C	C	.	.	H	α-helix	trans	-69.9	-24.7	174.4	0	0	0	0	0	113.5	T804 W810 R867 R870	T804-A806 PolarHBondContact O-N 2.91Å; T804-A806 PolarHBondContact OG1-N 2.76Å; A806-W810 PolarHBondContact O-N 2.82Å; A806-R867 HydrophobicContact CB-CB 4.08Å; A806-R870 VanDerWaalsContact O-CD 3.32Å; A806-R870 WeakPolarHBondContact O-CD 3.49Å; A806-R870 PolarHBondContact O-NH1 2.8Å
807	S	94.4	Very high	91.7	Very high	3 Å²	3	20.7 Å²	20.7	2%	0.021	11%	0.111	C	C	.	.	H	α-helix	trans	-74	-35.7	171.9	68.9	0	0	0	0	111.7	T804 T805 V809 W810 S811	T804-S807 PolarHBondContact N-OG 2.92Å; T804-S807 WeakPolarHBondContact O-CA 3.48Å; T804-S807 WeakPolarHBondContact O-CB 3.36Å; T804-S807 PolarHBondContact O-N 2.8Å; T804-S807 PolarHBondContact O-OG 3.08Å; T804-S807 PolarHBondContact OG1-N 3.11Å; T805-S807 VanDerWaalsContact C-N 3.31Å; T805-S807 PolarHBondContact O-N 2.94Å; S807-V809 VanDerWaalsContact C-N 3.31Å; S807-V809 PolarHBondContact O-N 3.35Å; S807-W810 WeakPolarHBondContact O-CB 3.03Å; S807-W810 PolarHBondContact O-N 3.13Å; S807-S811 PolarHBondContact O-N 3.44Å; S807-S811 PolarHBondContact O-OG 3.46Å
808	D	96.1	Very high	92.1	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.011	11%	0.113	C	C	.	.	H	α-helix	trans	-68.7	-30.2	171.4	-77.6	-17	0	0	0	111.9	M737 V746 H747 R748 T804 T805 W810 S811 F812 F873	M737-D808 HydrophobicContact CE-CB 3.8Å; M737-D808 WeakPolarHBondContact CE-OD2 3.37Å; V746-D808 WeakPolarHBondContact CA-OD2 3.43Å; V746-D808 VanDerWaalsContact CG1-OD2 3.26Å; V746-D808 WeakPolarHBondContact CG1-OD2 3.39Å; H747-D808 PolarHBondContact N-OD2 2.71Å; R748-D808 PolarHBondContact N-OD1 3.27Å; T804-D808 PolarHBondContact O-N 3.47Å; T805-D808 PolarHBondContact O-N 3.27Å; D808-W810 VanDerWaalsContact C-N 3.3Å; D808-W810 PolarHBondContact O-N 3.02Å; D808-S811 WeakPolarHBondContact O-CB 3.35Å; D808-S811 PolarHBondContact O-N 3.05Å; D808-F812 WeakPolarHBondContact O-CB 3.08Å; D808-F812 PolarHBondContact O-N 3.22Å; D808-F873 HydrophobicContact CB-CE2 3.88Å; D808-F873 HydrophobicContact CB-CZ 4.04Å
809	V	98.3	Very high	92.6	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.012	11%	0.105	C	C	.	.	H	α-helix	trans	-61.6	-39.2	172.3	166.2	0	0	0	0	111.4	T805 S807 F812 G813 C862 R870 P871 F873 L876	T805-V809 WeakPolarHBondContact O-CG2 3.34Å; T805-V809 PolarHBondContact O-N 2.83Å; S807-V809 VanDerWaalsContact C-N 3.31Å; S807-V809 PolarHBondContact O-N 3.35Å; V809-F812 WeakPolarHBondContact O-CB 3.5Å; V809-F812 PolarHBondContact O-N 2.9Å; V809-G813 PolarHBondContact O-N 3.45Å; V809-C862 HydrophobicContact CG1-CB 4.06Å; V809-C862 WeakPolarHBondContact O-CB 3.36Å; V809-R870 HydrophobicContact CG1-CB 3.95Å; V809-P871 HydrophobicContact CG1-CG 4.35Å; V809-P871 WeakPolarHBondContact CG1-O 3.25Å; V809-P871 VanDerWaalsContact CG2-O 3.28Å; V809-P871 WeakPolarHBondContact CG2-O 3.28Å; V809-F873 HydrophobicContact CG2-CD2 3.89Å; V809-F873 HydrophobicContact CG2-CE1 4.45Å; V809-F873 HydrophobicContact CG2-CE2 3.67Å; V809-F873 HydrophobicContact CG2-CG 4.37Å; V809-F873 HydrophobicContact CG2-CZ 3.97Å; V809-L876 HydrophobicContact CG1-CD1 4.07Å; V809-L876 HydrophobicContact CG2-CD1 4.18Å
810	W	97.9	Very high	93	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61	-48.4	172.9	176.2	-75.2	0	0	0	111.1	T793 A794 P795 A806 S807 D808 F812 G813 I814 I839 R844 W863	T793-W810 PolarHBondContact O-NE1 2.87Å; A794-W810 HydrophobicContact CB-CB 3.71Å; A794-W810 HydrophobicContact CB-CD2 4.15Å; A794-W810 HydrophobicContact CB-CG 3.76Å; P795-W810 HydrophobicContact CG-CE3 4.46Å; P795-W810 HydrophobicContact CG-CH2 4.17Å; P795-W810 HydrophobicContact CG-CZ3 3.98Å; A806-W810 PolarHBondContact O-N 2.82Å; S807-W810 WeakPolarHBondContact O-CB 3.03Å; S807-W810 PolarHBondContact O-N 3.13Å; D808-W810 VanDerWaalsContact C-N 3.3Å; D808-W810 PolarHBondContact O-N 3.02Å; W810-F812 VanDerWaalsContact C-N 3.28Å; W810-F812 PolarHBondContact O-N 3.34Å; W810-G813 WeakPolarHBondContact O-CA 3.5Å; W810-G813 PolarHBondContact O-N 2.93Å; W810-I814 PolarHBondContact O-N 2.91Å; W810-I839 HydrophobicContact CH2-CG2 3.81Å; W810-I839 HydrophobicContact CZ2-CD1 4.2Å; W810-I839 HydrophobicContact CZ2-CG1 4.3Å; W810-I839 HydrophobicContact CZ2-CG2 3.82Å; W810-R844 VanDerWaalsContact CH2-CZ 3.47Å; W810-W863 AromaticContact CD2-CD1 3.91Å; W810-W863 HydrophobicContact CE3-CB 4.17Å; W810-W863 HydrophobicContact CH2-CB 4.24Å; W810-W863 HydrophobicContact CZ3-CB 3.97Å; W810-W863 VanDerWaalsContact CZ3-O 3.23Å; W810-W863 WeakPolarHBondContact CZ3-O 3.28Å
811	S	97.9	Very high	93.3	Very high	6 Å²	6	12 Å²	12	4%	0.042	6%	0.061	C	C	.	.	H	α-helix	trans	-58.6	-40.3	176.7	-53.9	0	0	0	0	111.7	L750 W792 S807 D808 G813 I814 V815	L750-S811 WeakPolarHBondContact O-CB 3.23Å; W792-S811 VanDerWaalsContact O-CA 3.29Å; W792-S811 WeakPolarHBondContact O-CA 3.35Å; W792-S811 VanDerWaalsContact O-CB 3.32Å; W792-S811 WeakPolarHBondContact O-CB 3.41Å; W792-S811 PolarHBondContact O-OG 2.75Å; S807-S811 PolarHBondContact O-N 3.44Å; S807-S811 PolarHBondContact O-OG 3.46Å; D808-S811 WeakPolarHBondContact O-CB 3.35Å; D808-S811 PolarHBondContact O-N 3.05Å; S811-G813 VanDerWaalsContact C-N 3.32Å; S811-G813 PolarHBondContact O-N 3.09Å; S811-I814 WeakPolarHBondContact O-CA 3.15Å; S811-I814 WeakPolarHBondContact O-CB 3.3Å; S811-I814 PolarHBondContact O-N 3.19Å; S811-V815 PolarHBondContact O-N 3.48Å
812	F	98.5	Very high	93.7	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-61.1	-39.3	173.8	-178.9	-102.8	0	0	0	112.1	I733 A734 L750 D808 V809 W810 I814 V815 M816 F873 L876 L880	I733-F812 HydrophobicContact CB-CE2 4.11Å; I733-F812 HydrophobicContact CG2-CD2 3.94Å; I733-F812 HydrophobicContact CG2-CE2 3.81Å; A734-F812 HydrophobicContact CB-CE1 4.49Å; A734-F812 HydrophobicContact CB-CE2 4.01Å; A734-F812 HydrophobicContact CB-CZ 3.74Å; L750-F812 HydrophobicContact CD2-CB 3.77Å; L750-F812 HydrophobicContact CD2-CD2 4.28Å; D808-F812 WeakPolarHBondContact O-CB 3.08Å; D808-F812 PolarHBondContact O-N 3.22Å; V809-F812 WeakPolarHBondContact O-CB 3.5Å; V809-F812 PolarHBondContact O-N 2.9Å; W810-F812 VanDerWaalsContact C-N 3.28Å; W810-F812 PolarHBondContact O-N 3.34Å; F812-I814 VanDerWaalsContact C-N 3.27Å; F812-I814 PolarHBondContact O-N 3.26Å; F812-V815 PolarHBondContact O-N 2.83Å; F812-V815 VanDerWaalsContact O-N 3.15Å; F812-M816 HydrophobicContact CD1-CG 4.03Å; F812-M816 HydrophobicContact CD1-SD 3.9Å; F812-M816 HydrophobicContact CE1-CG 3.65Å; F812-M816 HydrophobicContact CE1-SD 3.47Å; F812-M816 WeakPolarHBondContact CE1-SD 3.46Å; F812-M816 HydrophobicContact CZ-CG 3.93Å; F812-M816 HydrophobicContact CZ-SD 4.25Å; F812-M816 WeakPolarHBondContact O-CG 3.45Å; F812-M816 PolarHBondContact O-N 2.81Å; F812-F873 HydrophobicContact CB-CE1 3.74Å; F812-F873 HydrophobicContact CB-CZ 4.02Å; F812-F873 HydrophobicContact CD1-CE1 4.32Å; F812-F873 HydrophobicContact CD2-CE1 4.09Å; F812-F873 AromaticContact CG-CE1 3.78Å; F812-F873 HydrophobicContact CG-CE1 3.78Å; F812-L876 HydrophobicContact CD1-CD1 3.75Å; F812-L876 HydrophobicContact CE1-CB 4.4Å; F812-L876 HydrophobicContact CE1-CD1 4.1Å; F812-L880 HydrophobicContact CE1-CD1 4.31Å; F812-L880 HydrophobicContact CZ-CD1 3.85Å
813	G	97.9	Very high	93.8	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-58.6	-38.4	172.1	0	0	0	0	0	112.7	V809 W810 S811 M816 W817 W863	V809-G813 PolarHBondContact O-N 3.45Å; W810-G813 WeakPolarHBondContact O-CA 3.5Å; W810-G813 PolarHBondContact O-N 2.93Å; S811-G813 VanDerWaalsContact C-N 3.32Å; S811-G813 PolarHBondContact O-N 3.09Å; G813-M816 WeakPolarHBondContact O-CB 3.33Å; G813-M816 PolarHBondContact O-N 3.38Å; G813-W817 PolarHBondContact O-N 3.46Å; G813-W817 VanDerWaalsContact O-N 3.15Å; G813-W863 VanDerWaalsContact C-NE1 3.35Å; G813-W863 WeakPolarHBondContact O-CZ2 3.33Å
814	I	97.5	Very high	93.7	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-68.7	-41.1	173.6	-55.6	-65.6	0	0	0	111	W792 W810 S811 F812 M816 W817 E818 P826 Y827 L845 W863	W792-I814 HydrophobicContact CG-CG2 4.05Å; W810-I814 PolarHBondContact O-N 2.91Å; S811-I814 WeakPolarHBondContact O-CA 3.15Å; S811-I814 WeakPolarHBondContact O-CB 3.3Å; S811-I814 PolarHBondContact O-N 3.19Å; F812-I814 VanDerWaalsContact C-N 3.27Å; F812-I814 PolarHBondContact O-N 3.26Å; I814-M816 VanDerWaalsContact C-N 3.32Å; I814-M816 PolarHBondContact O-N 3.18Å; I814-W817 CarbonylContact O-C 3.51Å; I814-W817 WeakPolarHBondContact O-CA 3.18Å; I814-W817 VanDerWaalsContact O-CB 3.31Å; I814-W817 WeakPolarHBondContact O-CB 3.06Å; I814-W817 PolarHBondContact O-N 3.37Å; I814-E818 WeakPolarHBondContact O-CG 3.44Å; I814-E818 PolarHBondContact O-N 3.39Å; I814-P826 HydrophobicContact CG2-CB 3.8Å; I814-P826 HydrophobicContact CG2-CG 3.59Å; I814-Y827 HydrophobicContact CD1-CE2 4.18Å; I814-L845 HydrophobicContact CD1-CD1 3.67Å; I814-W863 HydrophobicContact CD1-CZ2 3.93Å
815	V	98	Very high	93.3	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.6	-40	174.1	175.7	0	0	0	0	111.6	I733 L750 S811 F812 W817 E818 V819	I733-V815 HydrophobicContact CD1-CG1 4.04Å; L750-V815 HydrophobicContact CG-CG2 4.11Å; S811-V815 PolarHBondContact O-N 3.48Å; F812-V815 PolarHBondContact O-N 2.83Å; F812-V815 VanDerWaalsContact O-N 3.15Å; V815-W817 PolarHBondContact O-N 3.32Å; V815-E818 PolarHBondContact O-N 3Å; V815-V819 HydrophobicContact CG1-CG2 4.27Å; V815-V819 WeakPolarHBondContact O-CG2 3.4Å; V815-V819 PolarHBondContact O-N 2.9Å
816	M	97.6	Very high	92.9	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-57.1	-42	172.4	-69.6	-179.1	68.6	0	0	111.5	L730 F812 G813 I814 L820 L855 L858 M859	L730-M816 HydrophobicContact CD1-CB 4.35Å; L730-M816 HydrophobicContact CD1-CE 4.48Å; L730-M816 HydrophobicContact CD1-CG 4.15Å; L730-M816 HydrophobicContact CD2-CB 4.28Å; L730-M816 HydrophobicContact CD2-CG 3.92Å; F812-M816 HydrophobicContact CD1-CG 4.03Å; F812-M816 HydrophobicContact CD1-SD 3.9Å; F812-M816 HydrophobicContact CE1-CG 3.65Å; F812-M816 HydrophobicContact CE1-SD 3.47Å; F812-M816 WeakPolarHBondContact CE1-SD 3.46Å; F812-M816 HydrophobicContact CZ-CG 3.93Å; F812-M816 HydrophobicContact CZ-SD 4.25Å; F812-M816 WeakPolarHBondContact O-CG 3.45Å; F812-M816 PolarHBondContact O-N 2.81Å; G813-M816 WeakPolarHBondContact O-CB 3.33Å; G813-M816 PolarHBondContact O-N 3.38Å; I814-M816 VanDerWaalsContact C-N 3.32Å; I814-M816 PolarHBondContact O-N 3.18Å; M816-L820 WeakPolarHBondContact O-CB 3.21Å; M816-L820 WeakPolarHBondContact O-CG 3.44Å; M816-L820 PolarHBondContact O-N 3.09Å; M816-L820 VanDerWaalsContact O-N 3.07Å; M816-L855 HydrophobicContact CE-CB 4.46Å; M816-L858 HydrophobicContact CE-CB 4.07Å; M816-L858 HydrophobicContact CE-CD2 3.82Å; M816-L858 HydrophobicContact CE-CG 4.15Å; M816-L858 HydrophobicContact SD-CD2 4.21Å; M816-L858 HydrophobicContact SD-CG 4.35Å; M816-M859 HydrophobicContact CB-CE 3.92Å; M816-M859 HydrophobicContact CB-CG 3.84Å; M816-M859 HydrophobicContact CB-SD 4.46Å; M816-M859 HydrophobicContact CE-CG 4.05Å; M816-M859 WeakPolarHBondContact O-CE 3.06Å; M816-M859 HydrophobicContact SD-CG 4.22Å
817	W	94.7	Very high	92	Very high	25 Å²	25	12.1 Å²	12.1	10%	0.095	6%	0.059	C	C	.	.	H	α-helix	trans	-65.5	-44.6	175.5	-172.9	95.2	0	0	0	111.7	G813 I814 V815 V819 L820 S821 D824 P826 L845 P846 P848 M859 W863	G813-W817 PolarHBondContact O-N 3.46Å; G813-W817 VanDerWaalsContact O-N 3.15Å; I814-W817 CarbonylContact O-C 3.51Å; I814-W817 WeakPolarHBondContact O-CA 3.18Å; I814-W817 VanDerWaalsContact O-CB 3.31Å; I814-W817 WeakPolarHBondContact O-CB 3.06Å; I814-W817 PolarHBondContact O-N 3.37Å; V815-W817 PolarHBondContact O-N 3.32Å; W817-V819 PolarHBondContact O-N 2.92Å; W817-L820 PolarHBondContact O-N 3.03Å; W817-S821 WeakPolarHBondContact CZ3-OG 3.4Å; W817-S821 VanDerWaalsContact O-CB 3.23Å; W817-S821 WeakPolarHBondContact O-CB 3.43Å; W817-S821 PolarHBondContact O-N 3.44Å; W817-S821 PolarHBondContact O-OG 2.68Å; W817-D824 HydrophobicContact CH2-CB 3.89Å; W817-D824 HydrophobicContact CZ3-CB 3.94Å; W817-P826 HydrophobicContact CE3-CG 4.33Å; W817-P826 HydrophobicContact CZ3-CB 4.47Å; W817-P826 HydrophobicContact CZ3-CG 4.35Å; W817-L845 HydrophobicContact CB-CD1 4.4Å; W817-L845 HydrophobicContact CD2-CD1 3.84Å; W817-L845 HydrophobicContact CE3-CD1 4.21Å; W817-L845 HydrophobicContact CG-CB 4.29Å; W817-L845 HydrophobicContact CG-CD1 3.9Å; W817-L845 HydrophobicContact CZ2-CD2 4.48Å; W817-P846 PolarHBondContact NE1-O 2.8Å; W817-P848 HydrophobicContact CD2-CG 4.39Å; W817-P848 HydrophobicContact CG-CG 4.07Å; W817-M859 HydrophobicContact CB-CE 4.49Å; W817-M859 HydrophobicContact CB-SD 4.05Å; W817-W863 HydrophobicContact CB-CH2 4.17Å; W817-W863 HydrophobicContact CB-CZ2 4.07Å; W817-W863 HydrophobicContact CG-CH2 4.42Å
818	E	95.2	Very high	91.1	Very high	8 Å²	8	13.5 Å²	13.5	4%	0.037	7%	0.073	C	C	.	.	H	α-helix	trans	-58.7	-45.7	175.5	-69.8	179	118.3	0	0	111.6	A752 W792 I814 V815 S821 F822 G823 P826	A752-E818 HydrophobicContact CB-CB 3.94Å; A752-E818 HydrophobicContact CB-CG 4.41Å; A752-E818 WeakPolarHBondContact CB-OE2 3.37Å; A752-E818 PolarHBondContact N-OE2 3.01Å; W792-E818 VanDerWaalsContact CZ2-OE1 3.31Å; W792-E818 WeakPolarHBondContact CZ2-OE1 3.03Å; W792-E818 PolarHBondContact NE1-OE1 2.03Å; W792-E818 VanDerWaalsContact NE1-OE1 3.09Å; W792-E818 PolarHBondContact NE1-OE2 3.26Å; I814-E818 WeakPolarHBondContact O-CG 3.44Å; I814-E818 PolarHBondContact O-N 3.39Å; V815-E818 PolarHBondContact O-N 3Å; E818-S821 WeakPolarHBondContact CA-OG 3.49Å; E818-S821 CarbonylContact O-C 3.6Å; E818-S821 PolarHBondContact O-N 3.36Å; E818-S821 PolarHBondContact O-OG 2.67Å; E818-F822 PolarHBondContact O-N 2.8Å; E818-G823 PolarHBondContact O-N 3.42Å; E818-P826 HydrophobicContact CG-CG 3.66Å
819	V	94.8	Very high	90	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.4	-45.1	179.2	173.2	0	0	0	0	111.7	L710 L714 L726 L730 V815 W817 S821 F822	L710-V819 HydrophobicContact CD2-CG2 3.84Å; L714-V819 HydrophobicContact CD1-CB 4.38Å; L714-V819 HydrophobicContact CD1-CG2 4.12Å; L726-V819 HydrophobicContact CB-CG1 3.92Å; L726-V819 HydrophobicContact CD2-CG1 3.97Å; L726-V819 HydrophobicContact CG-CG1 4.45Å; L730-V819 HydrophobicContact CD1-CB 4.46Å; L730-V819 HydrophobicContact CD1-CG1 4.29Å; L730-V819 HydrophobicContact CD2-CB 3.83Å; L730-V819 HydrophobicContact CD2-CG1 4.16Å; L730-V819 HydrophobicContact CD2-CG2 3.64Å; L730-V819 HydrophobicContact CG-CB 4.2Å; L730-V819 HydrophobicContact CG-CG1 4Å; L730-V819 HydrophobicContact CG-CG2 4.36Å; V815-V819 HydrophobicContact CG1-CG2 4.27Å; V815-V819 WeakPolarHBondContact O-CG2 3.4Å; V815-V819 PolarHBondContact O-N 2.9Å; W817-V819 PolarHBondContact O-N 2.92Å; V819-S821 VanDerWaalsContact C-N 3.27Å; V819-S821 PolarHBondContact O-N 3.04Å; V819-F822 PolarHBondContact O-N 2.81Å
820	L	91.6	Very high	88.5	Confident	14 Å²	14	22.1 Å²	22.1	7%	0.073	11%	0.114	C	C	.	.	H	α-helix	trans	-78.1	-12.1	-179.2	-71.4	170.5	0	0	0	113.6	L726 M816 W817 P848 L855 M859	L726-L820 HydrophobicContact CD1-CD2 4.22Å; M816-L820 WeakPolarHBondContact O-CB 3.21Å; M816-L820 WeakPolarHBondContact O-CG 3.44Å; M816-L820 PolarHBondContact O-N 3.09Å; M816-L820 VanDerWaalsContact O-N 3.07Å; W817-L820 PolarHBondContact O-N 3.03Å; L820-P848 HydrophobicContact CB-CB 4.25Å; L820-P848 HydrophobicContact CB-CG 3.99Å; L820-P848 WeakPolarHBondContact O-CB 3.38Å; L820-L855 HydrophobicContact CD1-CB 3.87Å; L820-L855 HydrophobicContact CD1-CD1 3.89Å; L820-L855 HydrophobicContact CD2-CD1 4.11Å; L820-M859 HydrophobicContact CB-CE 4.2Å; L820-M859 HydrophobicContact CD1-CE 3.13Å; L820-M859 HydrophobicContact CG-CE 4.16Å
821	S	85.4	Confident	87.1	Confident	14 Å²	14	24.4 Å²	24.4	10%	0.098	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	13.1	171.5	62.5	0	0	0	0	112.7	W817 E818 V819 G823 D824	W817-S821 WeakPolarHBondContact CZ3-OG 3.4Å; W817-S821 VanDerWaalsContact O-CB 3.23Å; W817-S821 WeakPolarHBondContact O-CB 3.43Å; W817-S821 PolarHBondContact O-N 3.44Å; W817-S821 PolarHBondContact O-OG 2.68Å; E818-S821 WeakPolarHBondContact CA-OG 3.49Å; E818-S821 CarbonylContact O-C 3.6Å; E818-S821 PolarHBondContact O-N 3.36Å; E818-S821 PolarHBondContact O-OG 2.67Å; V819-S821 VanDerWaalsContact C-N 3.27Å; V819-S821 PolarHBondContact O-N 3.04Å; S821-G823 VanDerWaalsContact C-N 3.33Å; S821-G823 PolarHBondContact O-N 3.17Å; S821-D824 PolarHBondContact O-N 2.89Å
822	F	87.9	Confident	85.9	Confident	38 Å²	38	27.7 Å²	27.7	17%	0.167	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	40.9	177.8	-65.6	-89.1	0	0	0	114.9	L714 R715 E718 L721 L726 E818 V819	L714-F822 CarbonylContact C-O 3.51Å; L714-F822 HydrophobicContact CD2-CD1 4.38Å; R715-F822 WeakPolarHBondContact CA-O 3.31Å; R715-F822 WeakPolarHBondContact CG-O 3.41Å; R715-F822 PolarHBondContact N-O 3.34Å; E718-F822 HydrophobicContact CB-CB 4.25Å; E718-F822 HydrophobicContact CB-CD1 4.11Å; E718-F822 HydrophobicContact CB-CG 4.17Å; E718-F822 HydrophobicContact CG-CB 4.01Å; E718-F822 HydrophobicContact CG-CD1 4.08Å; E718-F822 HydrophobicContact CG-CD2 3.96Å; E718-F822 HydrophobicContact CG-CE1 4.49Å; E718-F822 HydrophobicContact CG-CE2 4.41Å; E718-F822 HydrophobicContact CG-CG 3.76Å; E718-F822 WeakPolarHBondContact O-CE1 3.45Å; L721-F822 HydrophobicContact CB-CE1 4.16Å; L721-F822 HydrophobicContact CD1-CE1 4.35Å; L726-F822 HydrophobicContact CD1-CE1 4.11Å; L726-F822 HydrophobicContact CD1-CE2 4.31Å; L726-F822 HydrophobicContact CD1-CZ 3.76Å; L726-F822 HydrophobicContact CD2-CE1 4.18Å; E818-F822 PolarHBondContact O-N 2.8Å; V819-F822 PolarHBondContact O-N 2.81Å
823	G	84.9	Confident	84.5	Confident	3 Å²	3	31.6 Å²	31.6	3%	0.031	17%	0.165	C	C	.	.	S	Bend	trans	82.5	22.7	175.7	0	0	0	0	0	113.9	R715 E818 S821	R715-G823 PolarHBondContact NH1-O 3.1Å; E818-G823 PolarHBondContact O-N 3.42Å; S821-G823 VanDerWaalsContact C-N 3.33Å; S821-G823 PolarHBondContact O-N 3.17Å
824	D	81.6	Confident	83.1	Confident	44 Å²	44	36.5 Å²	36.5	24%	0.235	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-62.3	152.1	168.9	-92.5	-7.5	0	0	0	111.4	W817 S821 P826 R926	W817-D824 HydrophobicContact CH2-CB 3.89Å; W817-D824 HydrophobicContact CZ3-CB 3.94Å; S821-D824 PolarHBondContact O-N 2.89Å; D824-P826 WeakPolarHBondContact O-CD 3.11Å; D824-R926 VanDerWaalsContact CG-NH2 3.27Å; D824-R926 IonicContact OD1-CZ 2.81Å; D824-R926 IonicContact OD1-NH1 3.46Å; D824-R926 PolarHBondContact OD1-NH1 2.8Å; D824-R926 IonicContact OD1-NH2 3.2Å; D824-R926 PolarHBondContact OD1-NH2 3.08Å; D824-R926 IonicContact OD2-CZ 3.53Å; D824-R926 IonicContact OD2-NH1 3.5Å; D824-R926 IonicContact OD2-NH2 3.43Å; D824-R926 PolarHBondContact OD2-NH2 2.99Å; D824-R926 VanDerWaalsContact OD2-NH2 3.07Å
825	K	80.6	Confident	81.7	Confident	85 Å²	85	36.5 Å²	36.5	37%	0.37	19%	0.188	S	C	.	.	P	Polyproline II helix	trans	-73.4	119.7	179.8	-178	177.3	169.9	-166.2	0	110.3	Y827 G828 E829	K825-Y827 PolarHBondContact O-N 3.05Å; K825-G828 WeakPolarHBondContact CD-O 3.23Å; K825-G828 WeakPolarHBondContact CE-O 3.4Å; K825-G828 PolarHBondContact NZ-O 2.77Å; K825-G828 PolarHBondContact O-N 2.78Å; K825-E829 IonicContact NZ-OE1 3.19Å; K825-E829 PolarHBondContact NZ-OE1 3Å; K825-E829 IonicContact NZ-OE2 2.74Å; K825-E829 PolarHBondContact NZ-OE2 2.79Å
826	P	84.6	Confident	80.5	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.006	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	132.4	177	-26.3	36	0	0	0	111.6	R791 W792 I814 W817 E818 D824 G828 L845	R791-P826 HydrophobicContact CB-CB 4.38Å; R791-P826 WeakPolarHBondContact CD-O 3.22Å; R791-P826 PolarHBondContact NH1-O 3.14Å; W792-P826 HydrophobicContact CZ2-CG 3.89Å; I814-P826 HydrophobicContact CG2-CB 3.8Å; I814-P826 HydrophobicContact CG2-CG 3.59Å; W817-P826 HydrophobicContact CE3-CG 4.33Å; W817-P826 HydrophobicContact CZ3-CB 4.47Å; W817-P826 HydrophobicContact CZ3-CG 4.35Å; E818-P826 HydrophobicContact CG-CG 3.66Å; D824-P826 WeakPolarHBondContact O-CD 3.11Å; P826-G828 PolarHBondContact O-N 3.21Å; P826-L845 HydrophobicContact CB-CD1 4.18Å
827	Y	76.1	Confident	79.3	Confident	10 Å²	10	46 Å²	46	4%	0.039	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	15.5	-175.7	-50.1	-90.5	0	0	0	114.7	R791 I814 K825 E829 M830 V835 I839 Y843 L845	R791-Y827 HydrophobicContact CB-CD2 4.14Å; R791-Y827 HydrophobicContact CG-CD2 4.4Å; R791-Y827 WeakPolarHBondContact O-CE2 3.46Å; I814-Y827 HydrophobicContact CD1-CE2 4.18Å; K825-Y827 PolarHBondContact O-N 3.05Å; Y827-E829 PolarHBondContact O-N 3.08Å; Y827-M830 HydrophobicContact CD1-SD 4.44Å; Y827-M830 WeakPolarHBondContact O-CB 3.31Å; Y827-M830 VanDerWaalsContact O-CG 3.26Å; Y827-M830 WeakPolarHBondContact O-CG 3.48Å; Y827-M830 PolarHBondContact O-N 3.07Å; Y827-V835 HydrophobicContact CD1-CG1 4.16Å; Y827-V835 HydrophobicContact CD1-CG2 4.34Å; Y827-V835 HydrophobicContact CD2-CG1 3.68Å; Y827-V835 HydrophobicContact CD2-CG2 4.15Å; Y827-V835 HydrophobicContact CE1-CG1 4.3Å; Y827-V835 HydrophobicContact CE2-CG1 3.84Å; Y827-V835 HydrophobicContact CG-CB 4.43Å; Y827-V835 HydrophobicContact CG-CG1 3.86Å; Y827-V835 HydrophobicContact CG-CG2 3.76Å; Y827-I839 HydrophobicContact CE1-CG1 4.3Å; Y827-Y843 HydrophobicContact CD1-CD1 4.27Å; Y827-Y843 AromaticContact CD1-CE1 3.89Å; Y827-Y843 HydrophobicContact CD1-CE1 3.89Å; Y827-Y843 HydrophobicContact CE1-CD1 4.04Å; Y827-Y843 AromaticContact CE1-CE1 3.97Å; Y827-Y843 HydrophobicContact CE1-CE1 3.97Å; Y827-L845 HydrophobicContact CD1-CD2 3.69Å; Y827-L845 HydrophobicContact CD1-CG 4.24Å; Y827-L845 HydrophobicContact CD2-CD1 4.44Å; Y827-L845 HydrophobicContact CD2-CD2 4.23Å; Y827-L845 HydrophobicContact CE1-CD2 3.87Å; Y827-L845 HydrophobicContact CE1-CG 3.89Å; Y827-L845 HydrophobicContact CE2-CD1 4.05Å; Y827-L845 HydrophobicContact CE2-CD2 4.38Å; Y827-L845 HydrophobicContact CE2-CG 4.22Å; Y827-L845 HydrophobicContact CG-CD2 3.87Å
828	G	75.9	Confident	78.1	Confident	31 Å²	31	46.1 Å²	46.1	32%	0.32	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	-132.2	174.9	0	0	0	0	0	113.4	R791 K825 P826 M830	R791-G828 PolarHBondContact NH1-O 2.65Å; K825-G828 WeakPolarHBondContact CD-O 3.23Å; K825-G828 WeakPolarHBondContact CE-O 3.4Å; K825-G828 PolarHBondContact NZ-O 2.77Å; K825-G828 PolarHBondContact O-N 2.78Å; P826-G828 PolarHBondContact O-N 3.21Å; G828-M830 VanDerWaalsContact C-N 3.33Å; G828-M830 PolarHBondContact O-N 2.82Å
829	E	72.9	Confident	77.3	Confident	139 Å²	139	45.8 Å²	45.8	65%	0.65	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	2.6	-176.1	-62.6	-47.9	116.3	0	0	115	K825 Y827 S831	K825-E829 IonicContact NZ-OE1 3.19Å; K825-E829 PolarHBondContact NZ-OE1 3Å; K825-E829 IonicContact NZ-OE2 2.74Å; K825-E829 PolarHBondContact NZ-OE2 2.79Å; Y827-E829 PolarHBondContact O-N 3.08Å; E829-S831 PolarHBondContact O-N 2.89Å
830	M	67.6	Low	76.5	Confident	47 Å²	47	50.6 Å²	50.6	23%	0.232	26%	0.257	C	S	.	.			trans	-55.4	133.6	173.4	-65	171.3	66.6	0	0	110.2	R791 Y827 G828 E834 V835 S838	R791-M830 PolarHBondContact NH1-O 3.28Å; R791-M830 PolarHBondContact NH2-O 2.85Å; Y827-M830 HydrophobicContact CD1-SD 4.44Å; Y827-M830 WeakPolarHBondContact O-CB 3.31Å; Y827-M830 VanDerWaalsContact O-CG 3.26Å; Y827-M830 WeakPolarHBondContact O-CG 3.48Å; Y827-M830 PolarHBondContact O-N 3.07Å; G828-M830 VanDerWaalsContact C-N 3.33Å; G828-M830 PolarHBondContact O-N 2.82Å; M830-E834 VanDerWaalsContact CA-OE2 3.31Å; M830-E834 WeakPolarHBondContact CA-OE2 3.48Å; M830-E834 HydrophobicContact CB-CB 4.05Å; M830-E834 HydrophobicContact CE-CB 3.95Å; M830-V835 HydrophobicContact CB-CG2 3.84Å; M830-V835 HydrophobicContact CE-CG2 4.39Å; M830-S838 WeakPolarHBondContact CE-OG 3.35Å
831	S	68.7	Low	75.6	Confident	47 Å²	47	55.6 Å²	55.6	33%	0.329	28%	0.284	S	S	.	.			trans	-61	159	171.3	69.4	0	0	0	0	111.3	E829 Q833 E834 V835	E829-S831 PolarHBondContact O-N 2.89Å; S831-Q833 PolarHBondContact O-N 2.7Å; S831-Q833 VanDerWaalsContact O-N 3.11Å; S831-E834 PolarHBondContact N-OE2 3.02Å; S831-E834 PolarHBondContact O-N 2.03Å; S831-E834 VanDerWaalsContact O-N 3.1Å; S831-E834 WeakPolarHBondContact OG-CG 3.41Å; S831-E834 PolarHBondContact OG-N 3.27Å; S831-E834 PolarHBondContact OG-OE2 2.9Å; S831-E834 VanDerWaalsContact OG-OE2 3.1Å; S831-V835 WeakPolarHBondContact O-CG2 3.36Å; S831-V835 PolarHBondContact O-N 2.92Å
832	N	71.4	Confident	75	Confident	76 Å²	76	57.2 Å²	57.2	41%	0.406	30%	0.302	S	S	.	.	H	α-helix	trans	-56.6	-31.6	177.1	-75.2	-8.6	0	0	0	112.2	I790 V835 M836	I790-N832 HydrophobicContact CB-CB 4.05Å; I790-N832 HydrophobicContact CG1-CB 4.08Å; I790-N832 HydrophobicContact CG2-CB 4.06Å; I790-N832 WeakPolarHBondContact CG2-O 3.29Å; N832-V835 PolarHBondContact O-N 2.88Å; N832-M836 WeakPolarHBondContact O-CE 3.45Å; N832-M836 VanDerWaalsContact O-CG 3.32Å; N832-M836 WeakPolarHBondContact O-CG 3.46Å; N832-M836 PolarHBondContact O-N 3.49Å
833	Q	70.8	Confident	74.4	Confident	82 Å²	82	59.1 Å²	59.1	38%	0.383	31%	0.309	S	S	.	.	H	α-helix	trans	-70	-43.1	176.6	-69.5	170	-26.3	0	0	112.7	Q37 S831 V835 M836 K837	Q37-Q833 VanDerWaalsContact O-CD 3.3Å; Q37-Q833 PolarHBondContact O-NE2 3.08Å; Q37-Q833 PolarHBondContact O-OE1 3.19Å; S831-Q833 PolarHBondContact O-N 2.7Å; S831-Q833 VanDerWaalsContact O-N 3.11Å; Q833-V835 VanDerWaalsContact C-N 3.26Å; Q833-V835 PolarHBondContact O-N 3.36Å; Q833-M836 HydrophobicContact CB-CE 4.32Å; Q833-M836 HydrophobicContact CG-CE 3.96Å; Q833-M836 PolarHBondContact O-N 2.95Å; Q833-K837 PolarHBondContact O-N 3Å
834	E	67.8	Low	74.2	Confident	102 Å²	102	61.1 Å²	61.1	48%	0.477	32%	0.316	S	S	.	.	H	α-helix	trans	-62.2	-37.5	174.7	-71.8	169.1	138	0	0	111.4	M830 S831 K837 S838	M830-E834 VanDerWaalsContact CA-OE2 3.31Å; M830-E834 WeakPolarHBondContact CA-OE2 3.48Å; M830-E834 HydrophobicContact CB-CB 4.05Å; M830-E834 HydrophobicContact CE-CB 3.95Å; S831-E834 PolarHBondContact N-OE2 3.02Å; S831-E834 PolarHBondContact O-N 2.03Å; S831-E834 VanDerWaalsContact O-N 3.1Å; S831-E834 WeakPolarHBondContact OG-CG 3.41Å; S831-E834 PolarHBondContact OG-N 3.27Å; S831-E834 PolarHBondContact OG-OE2 2.9Å; S831-E834 VanDerWaalsContact OG-OE2 3.1Å; E834-K837 PolarHBondContact O-N 2.81Å; E834-S838 VanDerWaalsContact O-CB 3.25Å; E834-S838 WeakPolarHBondContact O-CB 3.34Å; E834-S838 PolarHBondContact O-N 3.45Å; E834-S838 PolarHBondContact O-OG 3.43Å
835	V	68.2	Low	74	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.6	-48.3	174.7	175.7	0	0	0	0	111.2	I790 R791 Y827 M830 S831 N832 Q833 K837 S838 I839	I790-V835 HydrophobicContact CG2-CB 4.48Å; I790-V835 HydrophobicContact CG2-CG1 4.35Å; R791-V835 HydrophobicContact CG-CG1 4.4Å; R791-V835 HydrophobicContact CG-CG2 4.35Å; Y827-V835 HydrophobicContact CD1-CG1 4.16Å; Y827-V835 HydrophobicContact CD1-CG2 4.34Å; Y827-V835 HydrophobicContact CD2-CG1 3.68Å; Y827-V835 HydrophobicContact CD2-CG2 4.15Å; Y827-V835 HydrophobicContact CE1-CG1 4.3Å; Y827-V835 HydrophobicContact CE2-CG1 3.84Å; Y827-V835 HydrophobicContact CG-CB 4.43Å; Y827-V835 HydrophobicContact CG-CG1 3.86Å; Y827-V835 HydrophobicContact CG-CG2 3.76Å; M830-V835 HydrophobicContact CB-CG2 3.84Å; M830-V835 HydrophobicContact CE-CG2 4.39Å; S831-V835 WeakPolarHBondContact O-CG2 3.36Å; S831-V835 PolarHBondContact O-N 2.92Å; N832-V835 PolarHBondContact O-N 2.88Å; Q833-V835 VanDerWaalsContact C-N 3.26Å; Q833-V835 PolarHBondContact O-N 3.36Å; V835-K837 VanDerWaalsContact C-N 3.34Å; V835-K837 PolarHBondContact O-N 3.48Å; V835-S838 PolarHBondContact O-N 3.03Å; V835-I839 HydrophobicContact CG1-CD1 3.79Å; V835-I839 HydrophobicContact CG1-CG1 4.45Å; V835-I839 VanDerWaalsContact O-CG1 3.31Å; V835-I839 WeakPolarHBondContact O-CG1 3.03Å; V835-I839 PolarHBondContact O-N 3.14Å
836	M	72.9	Confident	73.6	Confident	63 Å²	63	55.8 Å²	55.8	31%	0.31	29%	0.292	S	S	.	.	H	α-helix	trans	-56.5	-48.5	176.6	-71.6	-176.8	-74.6	0	0	111.5	I790 I798 N832 Q833 I839 E840	I790-M836 HydrophobicContact CD1-CG 4.4Å; I790-M836 HydrophobicContact CD1-SD 3.81Å; I790-M836 HydrophobicContact CG1-SD 4.41Å; I790-M836 HydrophobicContact CG2-CG 3.47Å; I790-M836 VanDerWaalsContact CG2-CG 3.47Å; I790-M836 HydrophobicContact CG2-SD 4.19Å; I798-M836 HydrophobicContact CD1-CG 4.37Å; I798-M836 HydrophobicContact CG2-CG 3.86Å; I798-M836 HydrophobicContact CG2-SD 3.68Å; N832-M836 WeakPolarHBondContact O-CE 3.45Å; N832-M836 VanDerWaalsContact O-CG 3.32Å; N832-M836 WeakPolarHBondContact O-CG 3.46Å; N832-M836 PolarHBondContact O-N 3.49Å; Q833-M836 HydrophobicContact CB-CE 4.32Å; Q833-M836 HydrophobicContact CG-CE 3.96Å; Q833-M836 PolarHBondContact O-N 2.95Å; M836-I839 PolarHBondContact O-N 3.09Å; M836-E840 PolarHBondContact O-N 2.68Å; M836-E840 VanDerWaalsContact O-N 3.16Å
837	K	71.8	Confident	73.2	Confident	138 Å²	138	56.4 Å²	56.4	60%	0.6	30%	0.296	S	S	*	.	H	α-helix	trans	-62.3	-45.2	178.9	-176.7	179.6	176.7	-174.9	0	111.9	Q833 E834 V835 I839 E840 D841	Q833-K837 PolarHBondContact O-N 3Å; E834-K837 PolarHBondContact O-N 2.81Å; V835-K837 VanDerWaalsContact C-N 3.34Å; V835-K837 PolarHBondContact O-N 3.48Å; K837-I839 VanDerWaalsContact C-N 3.34Å; K837-I839 PolarHBondContact O-N 3.19Å; K837-E840 WeakPolarHBondContact O-CB 3.32Å; K837-E840 PolarHBondContact O-N 2.81Å; K837-E840 VanDerWaalsContact O-N 3.16Å; K837-D841 WeakPolarHBondContact O-CB 3.45Å; K837-D841 PolarHBondContact O-N 3.05Å
838	S	69.1	Low	73.2	Confident	27 Å²	27	56.6 Å²	56.6	19%	0.189	30%	0.298	C	S	.	.	H	α-helix	trans	-64.2	-40.9	-178.2	-59	0	0	0	0	111.5	M830 E834 V835 E840 D841 G842 Y843	M830-S838 WeakPolarHBondContact CE-OG 3.35Å; E834-S838 VanDerWaalsContact O-CB 3.25Å; E834-S838 WeakPolarHBondContact O-CB 3.34Å; E834-S838 PolarHBondContact O-N 3.45Å; E834-S838 PolarHBondContact O-OG 3.43Å; V835-S838 PolarHBondContact O-N 3.03Å; S838-E840 VanDerWaalsContact C-N 3.29Å; S838-E840 PolarHBondContact O-N 2.78Å; S838-D841 PolarHBondContact O-N 3.4Å; S838-G842 PolarHBondContact O-N 3.35Å; S838-Y843 WeakPolarHBondContact O-CA 3.45Å; S838-Y843 WeakPolarHBondContact O-CB 3.27Å; S838-Y843 PolarHBondContact O-N 2.04Å
839	I	78.6	Confident	72.7	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-41.9	175.2	-70	168.9	0	0	0	111.1	P795 I798 W810 Y827 V835 M836 K837 G842 R844	P795-I839 HydrophobicContact CB-CG2 4.07Å; P795-I839 HydrophobicContact CG-CG2 4.44Å; I798-I839 HydrophobicContact CD1-CD1 4.46Å; W810-I839 HydrophobicContact CH2-CG2 3.81Å; W810-I839 HydrophobicContact CZ2-CD1 4.2Å; W810-I839 HydrophobicContact CZ2-CG1 4.3Å; W810-I839 HydrophobicContact CZ2-CG2 3.82Å; Y827-I839 HydrophobicContact CE1-CG1 4.3Å; V835-I839 HydrophobicContact CG1-CD1 3.79Å; V835-I839 HydrophobicContact CG1-CG1 4.45Å; V835-I839 VanDerWaalsContact O-CG1 3.31Å; V835-I839 WeakPolarHBondContact O-CG1 3.03Å; V835-I839 PolarHBondContact O-N 3.14Å; M836-I839 PolarHBondContact O-N 3.09Å; K837-I839 VanDerWaalsContact C-N 3.34Å; K837-I839 PolarHBondContact O-N 3.19Å; I839-G842 PolarHBondContact O-N 3.06Å; I839-R844 PolarHBondContact O-NH1 3.25Å
840	E	78.8	Confident	72.6	Confident	101 Å²	101	53.9 Å²	53.9	47%	0.472	28%	0.283	S	S	.	.	H	α-helix	trans	-66.9	-41.3	177.8	-164.2	60.9	-153.8	0	0	112.2	M836 K837 S838 G842 Y865	M836-E840 PolarHBondContact O-N 2.68Å; M836-E840 VanDerWaalsContact O-N 3.16Å; K837-E840 WeakPolarHBondContact O-CB 3.32Å; K837-E840 PolarHBondContact O-N 2.81Å; K837-E840 VanDerWaalsContact O-N 3.16Å; S838-E840 VanDerWaalsContact C-N 3.29Å; S838-E840 PolarHBondContact O-N 2.78Å; E840-G842 PolarHBondContact O-N 2.84Å; E840-Y865 PolarHBondContact OE1-OH 3.43Å
841	D	72.2	Confident	73.2	Confident	119 Å²	119	51.7 Å²	51.7	64%	0.636	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	4.2	175.4	-67.5	-19.7	0	0	0	112.8	K837 S838	K837-D841 WeakPolarHBondContact O-CB 3.45Å; K837-D841 PolarHBondContact O-N 3.05Å; S838-D841 PolarHBondContact O-N 3.4Å
842	G	73	Confident	74.1	Confident	48 Å²	48	49.8 Å²	49.8	50%	0.495	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	3.6	175.7	0	0	0	0	0	114.9	S838 I839 E840	S838-G842 PolarHBondContact O-N 3.35Å; I839-G842 PolarHBondContact O-N 3.06Å; E840-G842 PolarHBondContact O-N 2.84Å
843	Y	74.5	Confident	74.6	Confident	77 Å²	77	47.1 Å²	47.1	30%	0.302	25%	0.247	S	C	.	.			trans	-65.3	139	175.2	178.4	-96	0	0	0	111	Y827 S838 P846 V900	Y827-Y843 HydrophobicContact CD1-CD1 4.27Å; Y827-Y843 AromaticContact CD1-CE1 3.89Å; Y827-Y843 HydrophobicContact CD1-CE1 3.89Å; Y827-Y843 HydrophobicContact CE1-CD1 4.04Å; Y827-Y843 AromaticContact CE1-CE1 3.97Å; Y827-Y843 HydrophobicContact CE1-CE1 3.97Å; S838-Y843 WeakPolarHBondContact O-CA 3.45Å; S838-Y843 WeakPolarHBondContact O-CB 3.27Å; S838-Y843 PolarHBondContact O-N 2.04Å; Y843-P846 WeakPolarHBondContact OH-CD 3.19Å; Y843-V900 HydrophobicContact CE2-CG1 4.4Å
844	R	81.3	Confident	75.4	Confident	46 Å²	46	45 Å²	45	17%	0.174	24%	0.24	C	C	.	.			trans	-132.6	153.2	174.6	-61.9	-61.2	-178.5	-93.4	1.1	109	W810 I839 W863	W810-R844 VanDerWaalsContact CH2-CZ 3.47Å; I839-R844 PolarHBondContact O-NH1 3.25Å; R844-W863 HydrophobicContact CB-CE3 4.22Å; R844-W863 HydrophobicContact CG-CB 4.45Å; R844-W863 PolarHBondContact NE-O 3.26Å; R844-W863 PolarHBondContact NH2-O 3.19Å
845	L	77.8	Confident	76.5	Confident	3 Å²	3	40.2 Å²	40.2	2%	0.016	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-60.1	134.3	-179.3	-70.7	168.9	0	0	0	110.7	I814 W817 P826 Y827 Y856 W863	I814-L845 HydrophobicContact CD1-CD1 3.67Å; W817-L845 HydrophobicContact CB-CD1 4.4Å; W817-L845 HydrophobicContact CD2-CD1 3.84Å; W817-L845 HydrophobicContact CE3-CD1 4.21Å; W817-L845 HydrophobicContact CG-CB 4.29Å; W817-L845 HydrophobicContact CG-CD1 3.9Å; W817-L845 HydrophobicContact CZ2-CD2 4.48Å; P826-L845 HydrophobicContact CB-CD1 4.18Å; Y827-L845 HydrophobicContact CD1-CD2 3.69Å; Y827-L845 HydrophobicContact CD1-CG 4.24Å; Y827-L845 HydrophobicContact CD2-CD1 4.44Å; Y827-L845 HydrophobicContact CD2-CD2 4.23Å; Y827-L845 HydrophobicContact CE1-CD2 3.87Å; Y827-L845 HydrophobicContact CE1-CG 3.89Å; Y827-L845 HydrophobicContact CE2-CD1 4.05Å; Y827-L845 HydrophobicContact CE2-CD2 4.38Å; Y827-L845 HydrophobicContact CE2-CG 4.22Å; Y827-L845 HydrophobicContact CG-CD2 3.87Å; L845-Y856 WeakPolarHBondContact O-CE2 3.28Å; L845-Y856 PolarHBondContact O-OH 3.28Å; L845-W863 HydrophobicContact CB-CH2 3.9Å; L845-W863 HydrophobicContact CB-CZ2 4.45Å; L845-W863 HydrophobicContact CB-CZ3 4.3Å; L845-W863 HydrophobicContact CD1-CZ2 4.43Å
846	P	72.8	Confident	77.5	Confident	14 Å²	14	41.6 Å²	41.6	9%	0.091	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-67.5	160.1	174.6	29.3	-34.8	0	0	0	110.6	W817 Y843 V900 T901	W817-P846 PolarHBondContact NE1-O 2.8Å; Y843-P846 WeakPolarHBondContact OH-CD 3.19Å; P846-V900 HydrophobicContact CB-CG1 4.36Å; P846-T901 HydrophobicContact CB-CG2 3.97Å; P846-T901 HydrophobicContact CG-CG2 3.67Å
847	P	74.9	Confident	78.3	Confident	13 Å²	13	42.9 Å²	42.9	8%	0.084	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-61.3	136	177.1	25.2	-30.7	0	0	0	110.3	C851 Y856 A894	P847-C851 HydrophobicContact CB-CB 4.14Å; P847-Y856 VanDerWaalsContact CA-CE2 3.45Å; P847-Y856 HydrophobicContact CB-CD1 3.98Å; P847-Y856 HydrophobicContact CB-CD2 3.61Å; P847-Y856 HydrophobicContact CB-CE1 4.13Å; P847-Y856 HydrophobicContact CB-CE2 3.79Å; P847-Y856 HydrophobicContact CB-CG 3.73Å; P847-Y856 VanDerWaalsContact CD-CZ 3.44Å; P847-Y856 HydrophobicContact CG-CD1 4.33Å; P847-Y856 HydrophobicContact CG-CE1 4.11Å; P847-Y856 HydrophobicContact CG-CE2 4.37Å; P847-Y856 VanDerWaalsContact N-CE2 3.31Å; P847-A894 HydrophobicContact CB-CB 3.86Å; P847-A894 HydrophobicContact CG-CB 4.2Å
848	P	77	Confident	79.4	Confident	14 Å²	14	36.9 Å²	36.9	9%	0.091	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-57.2	163.4	167.4	-25.4	35.6	0	0	0	111.9	W817 L820 C851	W817-P848 HydrophobicContact CD2-CG 4.39Å; W817-P848 HydrophobicContact CG-CG 4.07Å; L820-P848 HydrophobicContact CB-CB 4.25Å; L820-P848 HydrophobicContact CB-CG 3.99Å; L820-P848 WeakPolarHBondContact O-CB 3.38Å; P848-C851 HydrophobicContact CB-CB 4.23Å; P848-C851 WeakPolarHBondContact O-CB 3.05Å; P848-C851 PolarHBondContact O-N 2.83Å; P848-C851 VanDerWaalsContact O-N 3.13Å
849	V	65.8	Low	80.6	Confident	51 Å²	51	35.6 Å²	35.6	31%	0.309	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	138.7	-179.9	175.6	0	0	0	0	109.7	C851	V849-C851 PolarHBondContact O-N 2.04Å
850	D	70	Confident	81.2	Confident	63 Å²	63	39.5 Å²	39.5	34%	0.337	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	22.9	-173.9	-57	-43	0	0	0	113.9	P852 I893 G962 H963	D850-P852 VanDerWaalsContact O-CD 3.24Å; D850-P852 WeakPolarHBondContact O-CD 3.36Å; D850-I893 WeakPolarHBondContact O-CD1 3.47Å; D850-G962 WeakPolarHBondContact OD1-CA 3.43Å; D850-H963 IonicContact OD2-CD2 2.7Å; D850-H963 PolarHBondContact OD2-CD2 2.78Å; D850-H963 IonicContact OD2-NE2 2.61Å; D850-H963 PolarHBondContact OD2-NE2 3.35Å
851	C	80.9	Confident	81.9	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.007	21%	0.21	C	C	.	.			trans	-66.2	121.8	176.1	-178.7	0	0	0	0	110.4	P847 P848 V849 A853 A894	P847-C851 HydrophobicContact CB-CB 4.14Å; P848-C851 HydrophobicContact CB-CB 4.23Å; P848-C851 WeakPolarHBondContact O-CB 3.05Å; P848-C851 PolarHBondContact O-N 2.83Å; P848-C851 VanDerWaalsContact O-N 3.13Å; V849-C851 PolarHBondContact O-N 2.04Å; C851-A853 PolarHBondContact O-N 2.97Å; C851-A894 PolarHBondContact O-N 2.95Å
852	P	86.1	Confident	83.1	Confident	6 Å²	6	33 Å²	33	4%	0.039	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-60.2	129.6	173.9	-25.3	36.8	0	0	0	111.4	D850 P854 L855 Y856 L890 T892	D850-P852 VanDerWaalsContact O-CD 3.24Å; D850-P852 WeakPolarHBondContact O-CD 3.36Å; P852-P854 VanDerWaalsContact C-CD 3.41Å; P852-P854 VanDerWaalsContact C-N 3.34Å; P852-L855 HydrophobicContact CB-CD1 4.1Å; P852-L855 HydrophobicContact CB-CG 4.2Å; P852-L855 HydrophobicContact CG-CD1 3.95Å; P852-L855 PolarHBondContact O-N 2.86Å; P852-Y856 PolarHBondContact O-N 2.86Å; P852-Y856 VanDerWaalsContact O-N 3.13Å; P852-L890 HydrophobicContact CB-CB 4.35Å; P852-L890 HydrophobicContact CB-CD2 3.71Å; P852-L890 HydrophobicContact CG-CB 4.27Å; P852-L890 HydrophobicContact CG-CD2 3.81Å; P852-T892 CarbonylContact C-O 3.53Å; P852-T892 WeakPolarHBondContact CA-O 3.43Å
853	A	82.1	Confident	84.3	Confident	21 Å²	21	30.9 Å²	30.9	17%	0.174	16%	0.157	C	C	.	.	H	α-helix	trans	-51.4	-43.4	-178.3	0	0	0	0	0	113.6	C851 L855 Y856 E857 T892 A894	C851-A853 PolarHBondContact O-N 2.97Å; A853-L855 VanDerWaalsContact C-N 3.27Å; A853-L855 PolarHBondContact O-N 3.3Å; A853-Y856 PolarHBondContact O-N 2.67Å; A853-E857 WeakPolarHBondContact O-CG 3.45Å; A853-E857 PolarHBondContact O-N 3.42Å; A853-T892 HydrophobicContact CB-CG2 4.15Å; A853-T892 WeakPolarHBondContact CB-O 3.4Å; A853-T892 PolarHBondContact N-O 2.85Å; A853-A894 HydrophobicContact CB-CB 4.38Å
854	P	87.3	Confident	85.2	Confident	37 Å²	37	28.2 Å²	28.2	24%	0.24	15%	0.15	C	C	.	.	H	α-helix	trans	-60.2	-36	177.8	-23.7	35.1	0	0	0	113.4	P852 L858	P852-P854 VanDerWaalsContact C-CD 3.41Å; P852-P854 VanDerWaalsContact C-N 3.34Å; P854-L858 PolarHBondContact O-N 2.82Å; P854-L858 VanDerWaalsContact O-N 3.14Å
855	L	91.3	Very high	85.6	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-73.7	-38.2	179.6	-60.8	179.4	0	0	0	111.2	V727 M816 L820 P852 A853 L858 M859 L880 V883 L890	V727-L855 HydrophobicContact CG2-CD1 3.71Å; V727-L855 HydrophobicContact CG2-CD2 4.48Å; M816-L855 HydrophobicContact CE-CB 4.46Å; L820-L855 HydrophobicContact CD1-CB 3.87Å; L820-L855 HydrophobicContact CD1-CD1 3.89Å; L820-L855 HydrophobicContact CD2-CD1 4.11Å; P852-L855 HydrophobicContact CB-CD1 4.1Å; P852-L855 HydrophobicContact CB-CG 4.2Å; P852-L855 HydrophobicContact CG-CD1 3.95Å; P852-L855 PolarHBondContact O-N 2.86Å; A853-L855 VanDerWaalsContact C-N 3.27Å; A853-L855 PolarHBondContact O-N 3.3Å; L855-L858 WeakPolarHBondContact O-CB 3.09Å; L855-L858 PolarHBondContact O-N 3.07Å; L855-M859 WeakPolarHBondContact O-CG 3.07Å; L855-M859 PolarHBondContact O-N 3.42Å; L855-L880 HydrophobicContact CD2-CD2 3.81Å; L855-V883 HydrophobicContact CD2-CG1 4.28Å; L855-L890 HydrophobicContact CD1-CD2 3.96Å; L855-L890 HydrophobicContact CG-CD2 4.26Å
856	Y	90	Very high	86.2	Confident	30 Å²	30	35.7 Å²	35.7	12%	0.118	19%	0.185	C	C	.	.	H	α-helix	trans	-67.7	-39.2	175.3	-171.1	-119	0	0	0	112.8	L845 P847 P852 A853 L858 M859 K860 W863 A894	L845-Y856 WeakPolarHBondContact O-CE2 3.28Å; L845-Y856 PolarHBondContact O-OH 3.28Å; P847-Y856 VanDerWaalsContact CA-CE2 3.45Å; P847-Y856 HydrophobicContact CB-CD1 3.98Å; P847-Y856 HydrophobicContact CB-CD2 3.61Å; P847-Y856 HydrophobicContact CB-CE1 4.13Å; P847-Y856 HydrophobicContact CB-CE2 3.79Å; P847-Y856 HydrophobicContact CB-CG 3.73Å; P847-Y856 VanDerWaalsContact CD-CZ 3.44Å; P847-Y856 HydrophobicContact CG-CD1 4.33Å; P847-Y856 HydrophobicContact CG-CE1 4.11Å; P847-Y856 HydrophobicContact CG-CE2 4.37Å; P847-Y856 VanDerWaalsContact N-CE2 3.31Å; P852-Y856 PolarHBondContact O-N 2.86Å; P852-Y856 VanDerWaalsContact O-N 3.13Å; A853-Y856 PolarHBondContact O-N 2.67Å; Y856-L858 VanDerWaalsContact C-N 3.26Å; Y856-L858 PolarHBondContact O-N 3.12Å; Y856-M859 HydrophobicContact CD2-CB 4.49Å; Y856-M859 HydrophobicContact CD2-SD 3.9Å; Y856-M859 HydrophobicContact CE2-SD 4.5Å; Y856-M859 WeakPolarHBondContact O-CB 3.3Å; Y856-M859 PolarHBondContact O-N 2.99Å; Y856-K860 HydrophobicContact CD1-CD 4.27Å; Y856-K860 HydrophobicContact CD1-CG 4.47Å; Y856-K860 HydrophobicContact CE1-CD 3.8Å; Y856-K860 HydrophobicContact CE1-CG 4.09Å; Y856-K860 PolarHBondContact O-N 3.25Å; Y856-W863 HydrophobicContact CE2-CZ3 4.04Å; Y856-A894 HydrophobicContact CD1-CB 4.16Å; Y856-A894 HydrophobicContact CG-CB 4.29Å
857	E	89.4	Confident	87.2	Confident	90 Å²	90	39.4 Å²	39.4	42%	0.421	20%	0.198	S	C	.	.	H	α-helix	trans	-59.3	-40.2	171.6	-70.1	-54.1	139.7	0	0	111.5	A853 K860 N861	A853-E857 WeakPolarHBondContact O-CG 3.45Å; A853-E857 PolarHBondContact O-N 3.42Å; E857-K860 PolarHBondContact O-N 3.05Å; E857-K860 WeakPolarHBondContact OE1-CE 3.34Å; E857-K860 IonicContact OE1-NZ 2.76Å; E857-K860 PolarHBondContact OE1-NZ 2.98Å; E857-K860 WeakPolarHBondContact OE2-CE 3.36Å; E857-K860 IonicContact OE2-NZ 2.78Å; E857-K860 PolarHBondContact OE2-NZ 2.93Å; E857-N861 VanDerWaalsContact O-CG 3.28Å; E857-N861 PolarHBondContact O-N 3.25Å; E857-N861 PolarHBondContact O-ND2 2.76Å; E857-N861 VanDerWaalsContact O-ND2 3.11Å
858	L	93.8	Very high	88	Confident	12 Å²	12	42.9 Å²	42.9	6%	0.063	23%	0.227	C	C	.	.	H	α-helix	trans	-62.6	-43.1	174.9	-166.5	64.2	0	0	0	111.8	M816 P854 L855 Y856 K860 N861 C862 L876 H879 L880	M816-L858 HydrophobicContact CE-CB 4.07Å; M816-L858 HydrophobicContact CE-CD2 3.82Å; M816-L858 HydrophobicContact CE-CG 4.15Å; M816-L858 HydrophobicContact SD-CD2 4.21Å; M816-L858 HydrophobicContact SD-CG 4.35Å; P854-L858 PolarHBondContact O-N 2.82Å; P854-L858 VanDerWaalsContact O-N 3.14Å; L855-L858 WeakPolarHBondContact O-CB 3.09Å; L855-L858 PolarHBondContact O-N 3.07Å; Y856-L858 VanDerWaalsContact C-N 3.26Å; Y856-L858 PolarHBondContact O-N 3.12Å; L858-K860 PolarHBondContact O-N 3.16Å; L858-N861 WeakPolarHBondContact O-CB 3.39Å; L858-N861 PolarHBondContact O-N 2.85Å; L858-C862 PolarHBondContact O-N 3.4Å; L858-C862 PolarHBondContact O-SG 3.16Å; L858-C862 VanDerWaalsContact O-SG 3.32Å; L858-L876 HydrophobicContact CD1-CD2 3.55Å; L858-L876 HydrophobicContact CD2-CD2 3.94Å; L858-L876 HydrophobicContact CG-CD2 3.75Å; L858-H879 HydrophobicContact CD2-CB 4.46Å; L858-L880 HydrophobicContact CD2-CD2 4.22Å; L858-L880 HydrophobicContact CD2-CG 4.27Å
859	M	95.4	Very high	88.7	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.4	-46	173.8	-65	178	-161.6	0	0	112.2	M816 W817 L820 L855 Y856 N861 C862 W863	M816-M859 HydrophobicContact CB-CE 3.92Å; M816-M859 HydrophobicContact CB-CG 3.84Å; M816-M859 HydrophobicContact CB-SD 4.46Å; M816-M859 HydrophobicContact CE-CG 4.05Å; M816-M859 WeakPolarHBondContact O-CE 3.06Å; M816-M859 HydrophobicContact SD-CG 4.22Å; W817-M859 HydrophobicContact CB-CE 4.49Å; W817-M859 HydrophobicContact CB-SD 4.05Å; L820-M859 HydrophobicContact CB-CE 4.2Å; L820-M859 HydrophobicContact CD1-CE 3.13Å; L820-M859 HydrophobicContact CG-CE 4.16Å; L855-M859 WeakPolarHBondContact O-CG 3.07Å; L855-M859 PolarHBondContact O-N 3.42Å; Y856-M859 HydrophobicContact CD2-CB 4.49Å; Y856-M859 HydrophobicContact CD2-SD 3.9Å; Y856-M859 HydrophobicContact CE2-SD 4.5Å; Y856-M859 WeakPolarHBondContact O-CB 3.3Å; Y856-M859 PolarHBondContact O-N 2.99Å; M859-N861 VanDerWaalsContact C-N 3.27Å; M859-N861 PolarHBondContact O-N 3.04Å; M859-C862 WeakPolarHBondContact O-CA 3.45Å; M859-C862 VanDerWaalsContact O-CB 3.3Å; M859-C862 WeakPolarHBondContact O-CB 3.08Å; M859-C862 PolarHBondContact O-N 3.46Å; M859-W863 HydrophobicContact CB-CD2 4.4Å; M859-W863 HydrophobicContact CB-CE3 4.07Å; M859-W863 HydrophobicContact CB-CH2 3.63Å; M859-W863 HydrophobicContact CB-CZ2 3.99Å; M859-W863 HydrophobicContact CB-CZ3 3.67Å; M859-W863 HydrophobicContact CG-CH2 4.14Å; M859-W863 HydrophobicContact CG-CZ2 4.4Å; M859-W863 VanDerWaalsContact O-CD2 3.26Å; M859-W863 PolarHBondContact O-N 3.1Å; M859-W863 HydrophobicContact SD-CH2 3.71Å; M859-W863 HydrophobicContact SD-CZ2 4.31Å; M859-W863 HydrophobicContact SD-CZ3 4.39Å
860	K	90.3	Very high	90.2	Very high	82 Å²	82	49.7 Å²	49.7	36%	0.357	25%	0.246	S	C	.	.	H	α-helix	trans	-60.2	-37.6	177.7	-72.5	-171.3	-63.9	171.9	0	112.3	Y856 E857 L858 C862 W863 A864	Y856-K860 HydrophobicContact CD1-CD 4.27Å; Y856-K860 HydrophobicContact CD1-CG 4.47Å; Y856-K860 HydrophobicContact CE1-CD 3.8Å; Y856-K860 HydrophobicContact CE1-CG 4.09Å; Y856-K860 PolarHBondContact O-N 3.25Å; E857-K860 PolarHBondContact O-N 3.05Å; E857-K860 WeakPolarHBondContact OE1-CE 3.34Å; E857-K860 IonicContact OE1-NZ 2.76Å; E857-K860 PolarHBondContact OE1-NZ 2.98Å; E857-K860 WeakPolarHBondContact OE2-CE 3.36Å; E857-K860 IonicContact OE2-NZ 2.78Å; E857-K860 PolarHBondContact OE2-NZ 2.93Å; L858-K860 PolarHBondContact O-N 3.16Å; K860-C862 VanDerWaalsContact C-N 3.34Å; K860-W863 CarbonylContact O-C 3.57Å; K860-W863 PolarHBondContact O-N 3.19Å; K860-A864 PolarHBondContact O-N 3.16Å
861	N	94.9	Very high	91.5	Very high	85 Å²	85	47.6 Å²	47.6	46%	0.455	24%	0.235	S	C	.	.	H	α-helix	trans	-65.4	-37.4	174.4	-67.5	-35.5	0	0	0	112	E857 L858 M859 W863 P871	E857-N861 VanDerWaalsContact O-CG 3.28Å; E857-N861 PolarHBondContact O-N 3.25Å; E857-N861 PolarHBondContact O-ND2 2.76Å; E857-N861 VanDerWaalsContact O-ND2 3.11Å; L858-N861 WeakPolarHBondContact O-CB 3.39Å; L858-N861 PolarHBondContact O-N 2.85Å; M859-N861 VanDerWaalsContact C-N 3.27Å; M859-N861 PolarHBondContact O-N 3.04Å; N861-W863 VanDerWaalsContact C-N 3.28Å; N861-W863 PolarHBondContact O-N 2.82Å; N861-P871 HydrophobicContact CB-CG 4.41Å; N861-P871 WeakPolarHBondContact O-CD 3.32Å
862	C	97.5	Very high	92.2	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.3	-32.9	172	-63.9	0	0	0	0	112.3	V809 L858 M859 K860 R870	V809-C862 HydrophobicContact CG1-CB 4.06Å; V809-C862 WeakPolarHBondContact O-CB 3.36Å; L858-C862 PolarHBondContact O-N 3.4Å; L858-C862 PolarHBondContact O-SG 3.16Å; L858-C862 VanDerWaalsContact O-SG 3.32Å; M859-C862 WeakPolarHBondContact O-CA 3.45Å; M859-C862 VanDerWaalsContact O-CB 3.3Å; M859-C862 WeakPolarHBondContact O-CB 3.08Å; M859-C862 PolarHBondContact O-N 3.46Å; K860-C862 VanDerWaalsContact C-N 3.34Å; C862-R870 VanDerWaalsContact O-CD 3.24Å; C862-R870 WeakPolarHBondContact O-CD 3.47Å
863	W	96.4	Very high	92.7	Very high	3 Å²	3	53.7 Å²	53.7	1%	0.011	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	19.9	-178.4	-53.1	-42	0	0	0	115.4	W810 G813 I814 W817 R844 L845 Y856 M859 K860 N861 Y865	W810-W863 AromaticContact CD2-CD1 3.91Å; W810-W863 HydrophobicContact CE3-CB 4.17Å; W810-W863 HydrophobicContact CH2-CB 4.24Å; W810-W863 HydrophobicContact CZ3-CB 3.97Å; W810-W863 VanDerWaalsContact CZ3-O 3.23Å; W810-W863 WeakPolarHBondContact CZ3-O 3.28Å; G813-W863 VanDerWaalsContact C-NE1 3.35Å; G813-W863 WeakPolarHBondContact O-CZ2 3.33Å; I814-W863 HydrophobicContact CD1-CZ2 3.93Å; W817-W863 HydrophobicContact CB-CH2 4.17Å; W817-W863 HydrophobicContact CB-CZ2 4.07Å; W817-W863 HydrophobicContact CG-CH2 4.42Å; R844-W863 HydrophobicContact CB-CE3 4.22Å; R844-W863 HydrophobicContact CG-CB 4.45Å; R844-W863 PolarHBondContact NE-O 3.26Å; R844-W863 PolarHBondContact NH2-O 3.19Å; L845-W863 HydrophobicContact CB-CH2 3.9Å; L845-W863 HydrophobicContact CB-CZ2 4.45Å; L845-W863 HydrophobicContact CB-CZ3 4.3Å; L845-W863 HydrophobicContact CD1-CZ2 4.43Å; Y856-W863 HydrophobicContact CE2-CZ3 4.04Å; M859-W863 HydrophobicContact CB-CD2 4.4Å; M859-W863 HydrophobicContact CB-CE3 4.07Å; M859-W863 HydrophobicContact CB-CH2 3.63Å; M859-W863 HydrophobicContact CB-CZ2 3.99Å; M859-W863 HydrophobicContact CB-CZ3 3.67Å; M859-W863 HydrophobicContact CG-CH2 4.14Å; M859-W863 HydrophobicContact CG-CZ2 4.4Å; M859-W863 VanDerWaalsContact O-CD2 3.26Å; M859-W863 PolarHBondContact O-N 3.1Å; M859-W863 HydrophobicContact SD-CH2 3.71Å; M859-W863 HydrophobicContact SD-CZ2 4.31Å; M859-W863 HydrophobicContact SD-CZ3 4.39Å; K860-W863 CarbonylContact O-C 3.57Å; K860-W863 PolarHBondContact O-N 3.19Å; N861-W863 VanDerWaalsContact C-N 3.28Å; N861-W863 PolarHBondContact O-N 2.82Å; W863-Y865 PolarHBondContact O-N 3.37Å
864	A	93.6	Very high	93.4	Very high	20 Å²	20	59.1 Å²	59.1	17%	0.165	29%	0.285	C	S	.	.			trans	-57.5	132.3	170.4	0	0	0	0	0	110	K860 R869 R870	K860-A864 PolarHBondContact O-N 3.16Å; A864-R869 HydrophobicContact CB-CB 4.03Å; A864-R870 HydrophobicContact CB-CG 4.03Å; A864-R870 PolarHBondContact O-NE 2.97Å; A864-R870 PolarHBondContact O-NH2 3.21Å
865	Y	90.1	Very high	93.8	Very high	124 Å²	124	64.4 Å²	64.4	49%	0.486	30%	0.304	S	S	.	.	S	Bend	trans	-59.7	-51	-179.1	-172.8	-88.6	0	0	0	110.6	P795 E840 W863 R867 R870	P795-Y865 HydrophobicContact CB-CD2 4.5Å; P795-Y865 HydrophobicContact CB-CE2 4.22Å; P795-Y865 HydrophobicContact CG-CD2 4.28Å; P795-Y865 HydrophobicContact CG-CE2 4.47Å; E840-Y865 PolarHBondContact OE1-OH 3.43Å; W863-Y865 PolarHBondContact O-N 3.37Å; Y865-R867 PolarHBondContact O-N 2.88Å; Y865-R870 PolarHBondContact O-NH2 2.68Å; Y865-R870 VanDerWaalsContact O-NH2 3.17Å
866	D	90.8	Very high	94.1	Very high	82 Å²	82	64.4 Å²	64.4	44%	0.439	30%	0.304	S	S	.	.	S	Bend	trans	-70.5	117.9	171.6	179	5.7	0	0	0	111.3	A868 R869	D866-A868 PolarHBondContact O-N 3.16Å; D866-A868 WeakPolarHBondContact OD1-CB 3.19Å; D866-A868 PolarHBondContact OD1-N 3.41Å; D866-R869 HydrophobicContact CB-CG 4.17Å; D866-R869 PolarHBondContact O-N 3.44Å; D866-R869 VanDerWaalsContact O-N 3.11Å
867	R	92.9	Very high	94.3	Very high	93 Å²	93	64.5 Å²	64.5	35%	0.351	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-57.6	-31.2	179.2	71.1	-177.5	-174.7	174.5	3.6	113.5	T780 I802 A806 Y865 R869 R870	T780-R867 VanDerWaalsContact CG2-NH1 3.28Å; I802-R867 VanDerWaalsContact CG2-NH1 3.25Å; A806-R867 HydrophobicContact CB-CB 4.08Å; Y865-R867 PolarHBondContact O-N 2.88Å; R867-R869 PolarHBondContact O-N 2.8Å; R867-R870 PolarHBondContact O-N 3.18Å
868	A	92.1	Very high	94.6	Very high	85 Å²	85	62.6 Å²	62.6	70%	0.702	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-71	-18.1	-178.7	0	0	0	0	0	112.7	D866	D866-A868 PolarHBondContact O-N 3.16Å; D866-A868 WeakPolarHBondContact OD1-CB 3.19Å; D866-A868 PolarHBondContact OD1-N 3.41Å
869	R	93.2	Very high	94.6	Very high	196 Å²	196	65 Å²	65	74%	0.74	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-88.7	-9	178.5	-64.5	-179.2	61.5	-172.7	-2.8	113.3	A864 D866 R867	A864-R869 HydrophobicContact CB-CB 4.03Å; D866-R869 HydrophobicContact CB-CG 4.17Å; D866-R869 PolarHBondContact O-N 3.44Å; D866-R869 VanDerWaalsContact O-N 3.11Å; R867-R869 PolarHBondContact O-N 2.8Å
870	R	96.9	Very high	94.6	Very high	13 Å²	13	65 Å²	65	5%	0.049	32%	0.316	C	S	.	.	S	Bend	trans	-76.6	142.6	-179.4	-61.1	179.5	-165.1	151.6	11.6	110.4	E796 A806 V809 C862 A864 Y865 R867	E796-R870 IonicContact OE1-CZ 2.86Å; E796-R870 IonicContact OE1-NH1 2.91Å; E796-R870 PolarHBondContact OE1-NH1 2.78Å; E796-R870 IonicContact OE1-NH2 3.68Å; E796-R870 PolarHBondContact OE1-NH2 3.48Å; E796-R870 IonicContact OE2-CZ 3.89Å; E796-R870 IonicContact OE2-NH1 3.9Å; E796-R870 PolarHBondContact OE2-NH1 3.4Å; E796-R870 IonicContact OE2-NH2 3.95Å; E796-R870 PolarHBondContact OE2-NH2 3.08Å; A806-R870 VanDerWaalsContact O-CD 3.32Å; A806-R870 WeakPolarHBondContact O-CD 3.49Å; A806-R870 PolarHBondContact O-NH1 2.8Å; V809-R870 HydrophobicContact CG1-CB 3.95Å; C862-R870 VanDerWaalsContact O-CD 3.24Å; C862-R870 WeakPolarHBondContact O-CD 3.47Å; A864-R870 HydrophobicContact CB-CG 4.03Å; A864-R870 PolarHBondContact O-NE 2.97Å; A864-R870 PolarHBondContact O-NH2 3.21Å; Y865-R870 PolarHBondContact O-NH2 2.68Å; Y865-R870 VanDerWaalsContact O-NH2 3.17Å; R867-R870 PolarHBondContact O-N 3.18Å
871	P	96.6	Very high	94.7	Very high	18 Å²	18	65 Å²	65	12%	0.117	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-70	146	178.3	30	-35.9	0	0	0	111.8	V809 N861 K875 L876	V809-P871 HydrophobicContact CG1-CG 4.35Å; V809-P871 WeakPolarHBondContact CG1-O 3.25Å; V809-P871 VanDerWaalsContact CG2-O 3.28Å; V809-P871 WeakPolarHBondContact CG2-O 3.28Å; N861-P871 HydrophobicContact CB-CG 4.41Å; N861-P871 WeakPolarHBondContact O-CD 3.32Å; P871-K875 HydrophobicContact CB-CD 4.24Å; P871-L876 HydrophobicContact CB-CD2 4.18Å; P871-L876 HydrophobicContact CB-CG 4.29Å; P871-L876 HydrophobicContact CG-CD1 4.43Å; P871-L876 HydrophobicContact CG-CD2 3.56Å; P871-L876 HydrophobicContact CG-CG 4Å
872	H	95.6	Very high	94.6	Very high	133 Å²	133	67.1 Å²	67.1	62%	0.616	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-70.8	153.6	169.6	-65.2	-70.5	0	0	0	111.8	Q874 K875 L876	H872-Q874 PolarHBondContact O-N 2.79Å; H872-K875 WeakPolarHBondContact O-CA 3.27Å; H872-K875 WeakPolarHBondContact O-CB 3.41Å; H872-K875 PolarHBondContact O-N 2.93Å; H872-L876 PolarHBondContact O-N 3.29Å; H872-L876 VanDerWaalsContact O-N 3.11Å
873	F	97.3	Very high	94.2	Very high	2 Å²	2	67.5 Å²	67.5	1%	0.009	33%	0.326	C	S	.	.	H	α-helix	trans	-55.9	-34.7	178.9	-82.2	-69.5	0	0	0	114	M737 N738 L750 D808 V809 F812 K875 L876 Q877	M737-F873 HydrophobicContact CB-CD1 3.54Å; M737-F873 HydrophobicContact CB-CD2 4.07Å; M737-F873 HydrophobicContact CB-CE1 3.36Å; M737-F873 HydrophobicContact CB-CE2 3.91Å; M737-F873 HydrophobicContact CB-CG 3.9Å; M737-F873 HydrophobicContact CB-CZ 3.56Å; M737-F873 HydrophobicContact CE-CE2 4.07Å; M737-F873 HydrophobicContact CE-CZ 3.99Å; M737-F873 HydrophobicContact CG-CE1 3.93Å; M737-F873 HydrophobicContact CG-CZ 3.99Å; N738-F873 HydrophobicContact CB-CB 3.86Å; L750-F873 HydrophobicContact CD2-CZ 4.43Å; D808-F873 HydrophobicContact CB-CE2 3.88Å; D808-F873 HydrophobicContact CB-CZ 4.04Å; V809-F873 HydrophobicContact CG2-CD2 3.89Å; V809-F873 HydrophobicContact CG2-CE1 4.45Å; V809-F873 HydrophobicContact CG2-CE2 3.67Å; V809-F873 HydrophobicContact CG2-CG 4.37Å; V809-F873 HydrophobicContact CG2-CZ 3.97Å; F812-F873 HydrophobicContact CB-CE1 3.74Å; F812-F873 HydrophobicContact CB-CZ 4.02Å; F812-F873 HydrophobicContact CD1-CE1 4.32Å; F812-F873 HydrophobicContact CD2-CE1 4.09Å; F812-F873 AromaticContact CG-CE1 3.78Å; F812-F873 HydrophobicContact CG-CE1 3.78Å; F873-K875 VanDerWaalsContact C-N 3.27Å; F873-K875 PolarHBondContact O-N 3.05Å; F873-L876 HydrophobicContact CD1-CD1 3.86Å; F873-L876 HydrophobicContact CE1-CD1 4.14Å; F873-L876 HydrophobicContact CG-CD1 4.48Å; F873-L876 PolarHBondContact O-N 2.63Å; F873-Q877 WeakPolarHBondContact O-CB 3.45Å; F873-Q877 PolarHBondContact O-N 2.74Å
874	Q	96.1	Very high	93.9	Very high	136 Å²	136	70.1 Å²	70.1	64%	0.636	34%	0.341	S	S	*	.	H	α-helix	trans	-55.6	-42.1	172.5	-173.4	-175.8	15.3	0	0	112.4	N738 H872 A878	N738-Q874 PolarHBondContact OD1-N 2.96Å; H872-Q874 PolarHBondContact O-N 2.79Å; Q874-A878 WeakPolarHBondContact O-CB 3.45Å; Q874-A878 PolarHBondContact O-N 2.04Å; Q874-A878 VanDerWaalsContact O-N 3.16Å
875	K	95.6	Very high	93.7	Very high	148 Å²	148	73.4 Å²	73.4	64%	0.643	37%	0.367	S	S	*	.	H	α-helix	trans	-73.4	-37.3	178.5	-173.4	176.6	179.1	-179.2	0	111.6	P871 H872 F873 H879	P871-K875 HydrophobicContact CB-CD 4.24Å; H872-K875 WeakPolarHBondContact O-CA 3.27Å; H872-K875 WeakPolarHBondContact O-CB 3.41Å; H872-K875 PolarHBondContact O-N 2.93Å; F873-K875 VanDerWaalsContact C-N 3.27Å; F873-K875 PolarHBondContact O-N 3.05Å; K875-H879 WeakPolarHBondContact O-CB 3.33Å; K875-H879 PolarHBondContact O-N 2.68Å
876	L	97	Very high	93.6	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-62.2	-48	175.6	-67.9	173.3	0	0	0	111.3	V809 F812 L858 P871 H872 F873 H879 L880	V809-L876 HydrophobicContact CG1-CD1 4.07Å; V809-L876 HydrophobicContact CG2-CD1 4.18Å; F812-L876 HydrophobicContact CD1-CD1 3.75Å; F812-L876 HydrophobicContact CE1-CB 4.4Å; F812-L876 HydrophobicContact CE1-CD1 4.1Å; L858-L876 HydrophobicContact CD1-CD2 3.55Å; L858-L876 HydrophobicContact CD2-CD2 3.94Å; L858-L876 HydrophobicContact CG-CD2 3.75Å; P871-L876 HydrophobicContact CB-CD2 4.18Å; P871-L876 HydrophobicContact CB-CG 4.29Å; P871-L876 HydrophobicContact CG-CD1 4.43Å; P871-L876 HydrophobicContact CG-CD2 3.56Å; P871-L876 HydrophobicContact CG-CG 4Å; H872-L876 PolarHBondContact O-N 3.29Å; H872-L876 VanDerWaalsContact O-N 3.11Å; F873-L876 HydrophobicContact CD1-CD1 3.86Å; F873-L876 HydrophobicContact CE1-CD1 4.14Å; F873-L876 HydrophobicContact CG-CD1 4.48Å; F873-L876 PolarHBondContact O-N 2.63Å; L876-H879 PolarHBondContact O-N 3.4Å; L876-L880 WeakPolarHBondContact O-CG 3.35Å; L876-L880 PolarHBondContact O-N 3.05Å
877	Q	95.8	Very high	92.9	Very high	32 Å²	32	71.4 Å²	71.4	15%	0.15	37%	0.37	C	S	.	.	H	α-helix	trans	-57.6	-52.8	176.5	179	-178.1	-6.1	0	0	111.2	A734 N738 F873 H879 L880 E881	A734-Q877 HydrophobicContact CB-CB 4.26Å; N738-Q877 PolarHBondContact ND2-OE1 3.16Å; F873-Q877 WeakPolarHBondContact O-CB 3.45Å; F873-Q877 PolarHBondContact O-N 2.74Å; Q877-H879 VanDerWaalsContact C-N 3.27Å; Q877-H879 PolarHBondContact O-N 2.96Å; Q877-L880 PolarHBondContact O-N 2.98Å; Q877-E881 VanDerWaalsContact CG-OE1 3.31Å; Q877-E881 WeakPolarHBondContact CG-OE1 3.45Å; Q877-E881 PolarHBondContact NE2-OE1 2.93Å; Q877-E881 WeakPolarHBondContact O-CG 3.49Å; Q877-E881 PolarHBondContact O-N 3.22Å
878	A	94.7	Very high	92.1	Very high	51 Å²	51	72.5 Å²	72.5	42%	0.421	38%	0.379	S	S	.	.	H	α-helix	trans	-59.9	-36.5	180	0	0	0	0	0	112.7	Q874 Q882	Q874-A878 WeakPolarHBondContact O-CB 3.45Å; Q874-A878 PolarHBondContact O-N 2.04Å; Q874-A878 VanDerWaalsContact O-N 3.16Å; A878-Q882 WeakPolarHBondContact O-CB 3.36Å; A878-Q882 PolarHBondContact O-N 2.8Å
879	H	93.6	Very high	91.4	Very high	63 Å²	63	70 Å²	70	29%	0.292	36%	0.356	S	S	.	.	H	α-helix	trans	-67.5	-43.3	177	-164.5	78.2	0	0	0	112.1	L858 K875 L876 Q877 Q882 V883	L858-H879 HydrophobicContact CD2-CB 4.46Å; K875-H879 WeakPolarHBondContact O-CB 3.33Å; K875-H879 PolarHBondContact O-N 2.68Å; L876-H879 PolarHBondContact O-N 3.4Å; Q877-H879 VanDerWaalsContact C-N 3.27Å; Q877-H879 PolarHBondContact O-N 2.96Å; H879-Q882 WeakPolarHBondContact O-CB 3.47Å; H879-Q882 PolarHBondContact O-N 2.84Å; H879-V883 WeakPolarHBondContact O-CG2 3.4Å; H879-V883 PolarHBondContact O-N 2.74Å
880	L	95.1	Very high	90.7	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-66.9	-37.2	178.2	-67.9	166.6	0	0	0	111.8	V727 L730 Q731 A734 F812 L855 L858 L876 Q877 Q882 V883 L884	V727-L880 HydrophobicContact CG1-CB 4.49Å; V727-L880 HydrophobicContact CG1-CD2 4.08Å; L730-L880 HydrophobicContact CB-CD1 4.05Å; L730-L880 HydrophobicContact CB-CD2 4.33Å; Q731-L880 HydrophobicContact CB-CB 3.99Å; Q731-L880 HydrophobicContact CG-CB 4.34Å; A734-L880 HydrophobicContact CB-CD1 3.96Å; F812-L880 HydrophobicContact CE1-CD1 4.31Å; F812-L880 HydrophobicContact CZ-CD1 3.85Å; L855-L880 HydrophobicContact CD2-CD2 3.81Å; L858-L880 HydrophobicContact CD2-CD2 4.22Å; L858-L880 HydrophobicContact CD2-CG 4.27Å; L876-L880 WeakPolarHBondContact O-CG 3.35Å; L876-L880 PolarHBondContact O-N 3.05Å; Q877-L880 PolarHBondContact O-N 2.98Å; L880-Q882 VanDerWaalsContact C-N 3.35Å; L880-V883 PolarHBondContact O-N 3.25Å; L880-L884 WeakPolarHBondContact O-CG 3.35Å; L880-L884 PolarHBondContact O-N 3.41Å
881	E	93.4	Very high	89.7	Confident	81 Å²	81	69.9 Å²	69.9	38%	0.379	36%	0.357	S	S	.	.	H	α-helix	trans	-61.4	-42.2	171.7	-73.1	170.2	-173.8	0	0	111.8	Q731 Q877 V883 L884 A885	Q731-E881 HydrophobicContact CG-CG 3.72Å; Q731-E881 PolarHBondContact NE2-OE1 2.79Å; Q877-E881 VanDerWaalsContact CG-OE1 3.31Å; Q877-E881 WeakPolarHBondContact CG-OE1 3.45Å; Q877-E881 PolarHBondContact NE2-OE1 2.93Å; Q877-E881 WeakPolarHBondContact O-CG 3.49Å; Q877-E881 PolarHBondContact O-N 3.22Å; E881-V883 VanDerWaalsContact C-N 3.34Å; E881-V883 PolarHBondContact O-N 2.03Å; E881-L884 PolarHBondContact O-N 3.28Å; E881-A885 WeakPolarHBondContact O-CB 3.22Å; E881-A885 PolarHBondContact O-N 3.03Å
882	Q	92.1	Very high	88.5	Confident	130 Å²	130	73.4 Å²	73.4	61%	0.607	38%	0.378	S	S	*	.	H	α-helix	trans	-63.4	-40	175.3	-173.5	-178	5.1	0	0	112.1	A878 H879 L880 A885 N886	A878-Q882 WeakPolarHBondContact O-CB 3.36Å; A878-Q882 PolarHBondContact O-N 2.8Å; H879-Q882 WeakPolarHBondContact O-CB 3.47Å; H879-Q882 PolarHBondContact O-N 2.84Å; L880-Q882 VanDerWaalsContact C-N 3.35Å; Q882-A885 PolarHBondContact O-N 3.44Å; Q882-N886 PolarHBondContact O-N 2.82Å; Q882-N886 VanDerWaalsContact O-N 3.09Å
883	V	89.9	Confident	87.6	Confident	7 Å²	7	70.8 Å²	70.8	4%	0.042	37%	0.368	C	S	.	.	H	α-helix	trans	-66.1	-40.8	176.7	172.3	0	0	0	0	111.1	V727 L855 H879 L880 E881 N886 L890	V727-V883 HydrophobicContact CG1-CB 4.37Å; V727-V883 HydrophobicContact CG1-CG1 4.05Å; V727-V883 HydrophobicContact CG2-CG1 4.36Å; L855-V883 HydrophobicContact CD2-CG1 4.28Å; H879-V883 WeakPolarHBondContact O-CG2 3.4Å; H879-V883 PolarHBondContact O-N 2.74Å; L880-V883 PolarHBondContact O-N 3.25Å; E881-V883 VanDerWaalsContact C-N 3.34Å; E881-V883 PolarHBondContact O-N 2.03Å; V883-N886 CarbonylContact O-C 3.54Å; V883-N886 VanDerWaalsContact O-C 3.23Å; V883-N886 PolarHBondContact O-N 2.8Å; V883-L890 HydrophobicContact CG1-CD1 4.33Å; V883-L890 HydrophobicContact CG1-CD2 3.33Å; V883-L890 HydrophobicContact CG1-CG 3.88Å
884	L	90.1	Very high	86.2	Confident	59 Å²	59	71.1 Å²	71.1	31%	0.309	37%	0.371	S	S	.	.	H	α-helix	trans	-63	-40.5	173.3	-75.5	168.6	0	0	0	112.4	G724 V727 A728 Q731 L880 E881 N886	G724-L884 WeakPolarHBondContact O-CD2 3.39Å; V727-L884 HydrophobicContact CB-CD2 3.78Å; V727-L884 HydrophobicContact CB-CG 4.19Å; V727-L884 HydrophobicContact CG1-CD1 4.28Å; V727-L884 HydrophobicContact CG1-CD2 3.8Å; V727-L884 HydrophobicContact CG1-CG 3.62Å; A728-L884 HydrophobicContact CB-CD1 4.32Å; A728-L884 HydrophobicContact CB-CD2 4.21Å; Q731-L884 HydrophobicContact CB-CD1 3.89Å; Q731-L884 HydrophobicContact CG-CD1 4.11Å; L880-L884 WeakPolarHBondContact O-CG 3.35Å; L880-L884 PolarHBondContact O-N 3.41Å; E881-L884 PolarHBondContact O-N 3.28Å; L884-N886 PolarHBondContact O-N 2.81Å
885	A	89.4	Confident	84.2	Confident	88 Å²	88	71.6 Å²	71.6	73%	0.727	38%	0.378	S	S	*	.	H	α-helix	trans	-69	-22	178	0	0	0	0	0	113.1	E881 Q882	E881-A885 WeakPolarHBondContact O-CB 3.22Å; E881-A885 PolarHBondContact O-N 3.03Å; Q882-A885 PolarHBondContact O-N 3.44Å
886	N	87.1	Confident	82.1	Confident	82 Å²	82	67.3 Å²	67.3	44%	0.439	36%	0.36	S	S	.	.			trans	-127.5	78.9	177.5	-173.4	4.5	0	0	0	112.4	Q882 V883 L884 H888 S889	Q882-N886 PolarHBondContact O-N 2.82Å; Q882-N886 VanDerWaalsContact O-N 3.09Å; V883-N886 CarbonylContact O-C 3.54Å; V883-N886 VanDerWaalsContact O-C 3.23Å; V883-N886 PolarHBondContact O-N 2.8Å; L884-N886 PolarHBondContact O-N 2.81Å; N886-H888 PolarHBondContact O-N 2.99Å; N886-S889 VanDerWaalsContact O-CB 3.3Å; N886-S889 WeakPolarHBondContact O-CB 3.44Å; N886-S889 PolarHBondContact O-N 2.81Å; N886-S889 PolarHBondContact O-OG 2.92Å
887	P	76.8	Confident	79.5	Confident	83 Å²	83	71.3 Å²	71.3	54%	0.539	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-60.8	-21.3	-177.1	-24.9	34.5	0	0	0	114.6	S889 L890	P887-S889 PolarHBondContact O-N 3.12Å; P887-L890 WeakPolarHBondContact O-CB 3.48Å; P887-L890 PolarHBondContact O-N 2.8Å
888	H	76.4	Confident	76.9	Confident	116 Å²	116	71.4 Å²	71.4	54%	0.537	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-64.2	-27	175.3	-65.8	-51.3	0	0	0	112.8	N886 L890 R891	N886-H888 PolarHBondContact O-N 2.99Å; H888-L890 PolarHBondContact O-N 3.26Å; H888-R891 PolarHBondContact CE1-NH2 3.38Å; H888-R891 PolarHBondContact ND1-NE 2.84Å; H888-R891 PolarHBondContact ND1-NH2 3.08Å; H888-R891 WeakPolarHBondContact O-CB 3.39Å; H888-R891 WeakPolarHBondContact O-CG 3.26Å; H888-R891 PolarHBondContact O-N 2.88Å; H888-R891 VanDerWaalsContact O-N 3.16Å
889	S	77.6	Confident	74.4	Confident	32 Å²	32	77.7 Å²	77.7	22%	0.224	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-59.4	-26.2	175.2	67.2	0	0	0	0	112.9	N886 P887 R891	N886-S889 VanDerWaalsContact O-CB 3.3Å; N886-S889 WeakPolarHBondContact O-CB 3.44Å; N886-S889 PolarHBondContact O-N 2.81Å; N886-S889 PolarHBondContact O-OG 2.92Å; P887-S889 PolarHBondContact O-N 3.12Å; S889-R891 VanDerWaalsContact C-N 3.28Å; S889-R891 PolarHBondContact O-N 2.87Å
890	L	77.9	Confident	71.8	Confident	21 Å²	21	77.8 Å²	77.8	11%	0.11	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-78.3	-7.7	-178.8	-61.6	176.6	0	0	0	113.9	P723 V727 P852 L855 V883 P887 H888 T892	P723-L890 HydrophobicContact CB-CD1 4.36Å; V727-L890 HydrophobicContact CG2-CD1 4.19Å; V727-L890 HydrophobicContact CG2-CD2 4.22Å; P852-L890 HydrophobicContact CB-CB 4.35Å; P852-L890 HydrophobicContact CB-CD2 3.71Å; P852-L890 HydrophobicContact CG-CB 4.27Å; P852-L890 HydrophobicContact CG-CD2 3.81Å; L855-L890 HydrophobicContact CD1-CD2 3.96Å; L855-L890 HydrophobicContact CG-CD2 4.26Å; V883-L890 HydrophobicContact CG1-CD1 4.33Å; V883-L890 HydrophobicContact CG1-CD2 3.33Å; V883-L890 HydrophobicContact CG1-CG 3.88Å; P887-L890 WeakPolarHBondContact O-CB 3.48Å; P887-L890 PolarHBondContact O-N 2.8Å; H888-L890 PolarHBondContact O-N 3.26Å; L890-T892 VanDerWaalsContact C-N 3.34Å; L890-T892 PolarHBondContact O-N 2.97Å
891	R	75.6	Confident	69.1	Low	185 Å²	185	80.5 Å²	80.5	70%	0.698	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-71.9	-27.4	-177.7	-68.9	-179.5	173.2	179.4	-3.4	113.6	H888 S889 I893	H888-R891 PolarHBondContact CE1-NH2 3.38Å; H888-R891 PolarHBondContact ND1-NE 2.84Å; H888-R891 PolarHBondContact ND1-NH2 3.08Å; H888-R891 WeakPolarHBondContact O-CB 3.39Å; H888-R891 WeakPolarHBondContact O-CG 3.26Å; H888-R891 PolarHBondContact O-N 2.88Å; H888-R891 VanDerWaalsContact O-N 3.16Å; S889-R891 VanDerWaalsContact C-N 3.28Å; S889-R891 PolarHBondContact O-N 2.87Å; R891-I893 PolarHBondContact O-N 2.92Å
892	T	72.4	Confident	66.6	Low	93 Å²	93	80.5 Å²	80.5	57%	0.571	42%	0.421	S	S	*	.	S	Bend	trans	-82.8	113.5	-179	-53.2	0	0	0	0	108.5	P852 A853 L890	P852-T892 CarbonylContact C-O 3.53Å; P852-T892 WeakPolarHBondContact CA-O 3.43Å; A853-T892 HydrophobicContact CB-CG2 4.15Å; A853-T892 WeakPolarHBondContact CB-O 3.4Å; A853-T892 PolarHBondContact N-O 2.85Å; L890-T892 VanDerWaalsContact C-N 3.34Å; L890-T892 PolarHBondContact O-N 2.97Å
893	I	75	Confident	63.9	Low	77 Å²	77	84.4 Å²	84.4	40%	0.395	43%	0.43	S	S	.	.	B	Isolated β-bridge	trans	-84.6	142.1	179.1	-54.5	-55.5	0	0	0	109.9	D850 R891	D850-I893 WeakPolarHBondContact O-CD1 3.47Å; R891-I893 PolarHBondContact O-N 2.92Å
894	A	69.6	Low	61.5	Low	10 Å²	10	90.4 Å²	90.4	8%	0.083	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-58.2	139.9	178.2	0	0	0	0	0	111.5	P847 C851 A853 Y856	P847-A894 HydrophobicContact CB-CB 3.86Å; P847-A894 HydrophobicContact CG-CB 4.2Å; C851-A894 PolarHBondContact O-N 2.95Å; A853-A894 HydrophobicContact CB-CB 4.38Å; Y856-A894 HydrophobicContact CD1-CB 4.16Å; Y856-A894 HydrophobicContact CG-CB 4.29Å
895	N	54	Low	58.9	Low	145 Å²	145	92.8 Å²	92.8	78%	0.775	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-66.9	139.3	174.3	-104.5	-7.7	0	0	0	110.5
896	F	51.3	Low	56	Low	59 Å²	59	92.2 Å²	92.2	26%	0.259	47%	0.471	S	S	.	.			trans	-122.3	128.6	-166.5	173.7	-99.2	0	0	0	109.5	P898 T901	F896-P898 HydrophobicContact CD1-CB 4.25Å; F896-P898 HydrophobicContact CD1-CG 3.78Å; F896-P898 HydrophobicContact CE1-CB 3.59Å; F896-P898 HydrophobicContact CE1-CG 3.6Å; F896-P898 HydrophobicContact CZ-CB 4.36Å; F896-T901 HydrophobicContact CE2-CG2 3.83Å; F896-T901 WeakPolarHBondContact CE2-OG1 3.07Å; F896-T901 HydrophobicContact CZ-CG2 4.49Å; F896-T901 VanDerWaalsContact CZ-OG1 3.23Å; F896-T901 WeakPolarHBondContact CZ-OG1 3.04Å
897	D	42.7	Very low	53.5	Low	84 Å²	84	92.5 Å²	92.5	45%	0.449	47%	0.472	S	S	.	.			trans	-99.1	108.1	164.2	-174.6	-14.3	0	0	0	108.4	R899 V900 T901	D897-R899 PolarHBondContact O-N 3.27Å; D897-R899 VanDerWaalsContact O-N 3.08Å; D897-R899 VanDerWaalsContact OD1-CB 3.3Å; D897-R899 WeakPolarHBondContact OD1-CB 3.46Å; D897-R899 PolarHBondContact OD1-N 2.72Å; D897-V900 HydrophobicContact CB-CB 4.48Å; D897-V900 HydrophobicContact CB-CG2 3.96Å; D897-V900 PolarHBondContact O-N 3.45Å; D897-T901 PolarHBondContact O-OG1 3.32Å
898	P	39.4	Very low	51.3	Low	34 Å²	34	91.3 Å²	91.3	22%	0.221	47%	0.466	C	S	.	.	H	α-helix	trans	-55.4	-27.5	-179.9	-18.3	27.3	0	0	0	113.7	F896 V900 L902 C969	F896-P898 HydrophobicContact CD1-CB 4.25Å; F896-P898 HydrophobicContact CD1-CG 3.78Å; F896-P898 HydrophobicContact CE1-CB 3.59Å; F896-P898 HydrophobicContact CE1-CG 3.6Å; F896-P898 HydrophobicContact CZ-CB 4.36Å; P898-V900 VanDerWaalsContact C-N 3.27Å; P898-V900 PolarHBondContact O-N 3.31Å; P898-L902 HydrophobicContact CB-CD1 4.49Å; P898-L902 WeakPolarHBondContact O-CB 3.47Å; P898-L902 PolarHBondContact O-N 2.81Å; P898-C969 HydrophobicContact CB-CB 4.33Å; P898-C969 HydrophobicContact CG-CB 3.82Å
899	R	42.3	Very low	49.1	Very low	183 Å²	183	86.8 Å²	86.8	69%	0.691	45%	0.45	S	S	*	.	H	α-helix	trans	-70.7	-22.6	-178.4	-61.3	-178.6	133.9	119.3	4.3	113.1	D897	D897-R899 PolarHBondContact O-N 3.27Å; D897-R899 VanDerWaalsContact O-N 3.08Å; D897-R899 VanDerWaalsContact OD1-CB 3.3Å; D897-R899 WeakPolarHBondContact OD1-CB 3.46Å; D897-R899 PolarHBondContact OD1-N 2.72Å
900	V	39.7	Very low	47.1	Very low	64 Å²	64	89.5 Å²	89.5	39%	0.388	47%	0.469	S	S	.	.	H	α-helix	trans	-90.3	-27.1	-176.1	-178.8	0	0	0	0	111.6	Y843 P846 D897 P898	Y843-V900 HydrophobicContact CE2-CG1 4.4Å; P846-V900 HydrophobicContact CB-CG1 4.36Å; D897-V900 HydrophobicContact CB-CB 4.48Å; D897-V900 HydrophobicContact CB-CG2 3.96Å; D897-V900 PolarHBondContact O-N 3.45Å; P898-V900 VanDerWaalsContact C-N 3.27Å; P898-V900 PolarHBondContact O-N 3.31Å
901	T	37.6	Very low	45	Very low	57 Å²	57	95.4 Å²	95.4	35%	0.35	50%	0.501	S	S	.	.	H	α-helix	trans	-96.9	-17.6	-176.4	-13.2	0	0	0	0	113.5	P846 F896 D897	P846-T901 HydrophobicContact CB-CG2 3.97Å; P846-T901 HydrophobicContact CG-CG2 3.67Å; F896-T901 HydrophobicContact CE2-CG2 3.83Å; F896-T901 WeakPolarHBondContact CE2-OG1 3.07Å; F896-T901 HydrophobicContact CZ-CG2 4.49Å; F896-T901 VanDerWaalsContact CZ-OG1 3.23Å; F896-T901 WeakPolarHBondContact CZ-OG1 3.04Å; D897-T901 PolarHBondContact O-OG1 3.32Å
902	L	41	Very low	43.5	Very low	81 Å²	81	90 Å²	90	42%	0.424	50%	0.502	S	S	.	.			trans	-91.1	12.1	177.6	-89.2	151.8	0	0	0	114.3	P898 L904	P898-L902 HydrophobicContact CB-CD1 4.49Å; P898-L902 WeakPolarHBondContact O-CB 3.47Å; P898-L902 PolarHBondContact O-N 2.81Å; L902-L904 VanDerWaalsContact C-N 3.26Å; L902-L904 PolarHBondContact O-N 3.39Å
903	R	36.1	Very low	42.1	Very low	213 Å²	213	87.6 Å²	87.6	80%	0.804	49%	0.486	S	S	*	.			trans	-76.7	81.8	172.6	-78.4	-163.2	169.6	157.2	-0.5	112
904	L	39.6	Very low	40.9	Very low	133 Å²	133	85.1 Å²	85.1	70%	0.696	47%	0.474	S	S	*	.			trans	74	137.1	143.2	-69.7	150.4	0	0	0	118.1	L902	L902-L904 VanDerWaalsContact C-N 3.26Å; L902-L904 PolarHBondContact O-N 3.39Å
905	P	35.4	Very low	40.3	Very low	109 Å²	109	86.6 Å²	86.6	71%	0.708	48%	0.478	S	S	*	.	S	Bend		-137.4	162.6	55.8	31.8	-11	0	0	0	118.3
906	S	29.7	Very low	40.6	Very low	76 Å²	76	88.7 Å²	88.7	53%	0.531	48%	0.475	S	S	.	.			trans	80	90.6	167.3	-154.6	0	0	0	0	118	S908	S906-S908 VanDerWaalsContact C-N 3.32Å; S906-S908 PolarHBondContact O-N 2.94Å; S906-S908 PolarHBondContact OG-OG 3.16Å
907	L	34.1	Very low	41.8	Very low	88 Å²	88	88 Å²	88	46%	0.461	48%	0.478	S	S	.	.			trans	-83.6	78.3	157	-68.1	171.8	0	0	0	108.6	I135 P914	I135-L907 WeakPolarHBondContact CD1-O 3.43Å; L907-P914 HydrophobicContact CD2-CB 3.29Å
908	S	30.1	Very low	43.6	Very low	58 Å²	58	84.3 Å²	84.3	41%	0.406	46%	0.458	S	S	.	.			trans	-97.1	27.5	174.6	-72.4	0	0	0	0	113.2	S906 R916	S906-S908 VanDerWaalsContact C-N 3.32Å; S906-S908 PolarHBondContact O-N 2.94Å; S906-S908 PolarHBondContact OG-OG 3.16Å; S908-R916 PolarHBondContact O-NE 3.14Å; S908-R916 PolarHBondContact O-NH2 2.99Å
909	G	29.6	Very low	45.3	Very low	21 Å²	21	85 Å²	85	22%	0.216	46%	0.464	C	S	.	.			trans	-107.5	115.8	171.6	0	0	0	0	0	111.2
910	S	35.3	Very low	46.6	Very low	88 Å²	88	79.8 Å²	79.8	62%	0.615	45%	0.447	S	S	*	.	S	Bend	trans	-61.2	152.9	152.5	53.7	0	0	0	0	108
911	D	34.5	Very low	48.4	Very low	146 Å²	146	76.7 Å²	76.7	78%	0.781	43%	0.429	S	S	*	.	S	Bend	trans	94.3	12.4	168.1	-40.4	-36.4	0	0	0	117.5	I913	D911-I913 PolarHBondContact O-N 2.92Å
912	G	43.4	Very low	50	Low	70 Å²	70	74 Å²	74	72%	0.722	41%	0.412	S	S	*	.	S	Bend	trans	78.2	6.5	169.9	0	0	0	0	0	114.3
913	I	44.3	Very low	51.2	Low	44 Å²	44	74.2 Å²	74.2	23%	0.226	41%	0.411	C	S	.	.			trans	-111	126	165.5	-65.3	163.6	0	0	0	107.3	D911 Y915 M942 E943	D911-I913 PolarHBondContact O-N 2.92Å; I913-Y915 WeakPolarHBondContact CG2-O 3.38Å; I913-Y915 PolarHBondContact O-N 3.15Å; I913-Y915 VanDerWaalsContact O-N 3.15Å; I913-M942 HydrophobicContact CD1-CB 4.26Å; I913-M942 HydrophobicContact CG2-CB 3.69Å; I913-M942 HydrophobicContact CG2-CG 3.28Å; I913-E943 HydrophobicContact CD1-CG 4.14Å
914	P	50.3	Low	52.2	Low	24 Å²	24	66.6 Å²	66.6	16%	0.156	39%	0.39	C	S	.	.	S	Bend	trans	-67.8	-13.2	-172.5	20.5	-28.3	0	0	0	115.1	L907 F974	L907-P914 HydrophobicContact CD2-CB 3.29Å; P914-F974 HydrophobicContact CG-CD1 3.61Å; P914-F974 HydrophobicContact CG-CE1 3.14Å; P914-F974 HydrophobicContact CG-CZ 4.01Å
915	Y	55.7	Low	53.2	Low	41 Å²	41	60.5 Å²	60.5	16%	0.161	36%	0.358	C	S	.	.			trans	-130.6	141.2	-175.2	-54.2	-74.1	0	0	0	111.3	I913 S917 E920 W921 S924 F974	I913-Y915 WeakPolarHBondContact CG2-O 3.38Å; I913-Y915 PolarHBondContact O-N 3.15Å; I913-Y915 VanDerWaalsContact O-N 3.15Å; Y915-S917 VanDerWaalsContact C-N 3.35Å; Y915-E920 HydrophobicContact CD1-CG 4.22Å; Y915-W921 HydrophobicContact CD1-CB 4.46Å; Y915-W921 HydrophobicContact CD2-CB 3.65Å; Y915-W921 AromaticContact CD2-CD1 3.51Å; Y915-W921 AromaticContact CD2-CG 3.9Å; Y915-W921 HydrophobicContact CD2-CG 3.9Å; Y915-W921 HydrophobicContact CE2-CB 4.44Å; Y915-W921 AromaticContact CE2-CD1 3.57Å; Y915-W921 HydrophobicContact CE2-CG 4.37Å; Y915-W921 HydrophobicContact CG-CB 3.67Å; Y915-W921 HydrophobicContact CG-CG 4.41Å; Y915-S924 WeakPolarHBondContact CE1-OG 3.29Å; Y915-S924 PolarHBondContact OH-OG 2.95Å; Y915-S924 VanDerWaalsContact OH-OG 3.06Å; Y915-F974 HydrophobicContact CD2-CE1 4.34Å; Y915-F974 AromaticContact CD2-CZ 3.94Å; Y915-F974 HydrophobicContact CD2-CZ 3.94Å; Y915-F974 AromaticContact CE2-CE1 3.99Å; Y915-F974 HydrophobicContact CE2-CE1 3.99Å; Y915-F974 AromaticContact CE2-CZ 3.71Å; Y915-F974 HydrophobicContact CE2-CZ 3.71Å
916	R	60.9	Low	54.1	Low	190 Å²	190	61.2 Å²	61.2	72%	0.717	35%	0.347	S	S	*	.	S	Bend	trans	-82.1	-12.5	-175.8	-59.1	-179.2	179.8	-170.9	-0.9	113.6	S908 E920	S908-R916 PolarHBondContact O-NE 3.14Å; S908-R916 PolarHBondContact O-NH2 2.99Å; R916-E920 WeakPolarHBondContact CB-OE2 3.32Å; R916-E920 PolarHBondContact N-OE2 2.62Å
917	S	76	Confident	56	Low	45 Å²	45	57.8 Å²	57.8	32%	0.315	32%	0.322	S	S	.	.	S	Bend	trans	-153.2	157.8	177.5	65.2	0	0	0	0	111.2	Y915 S919 E920 W921	Y915-S917 VanDerWaalsContact C-N 3.35Å; S917-S919 PolarHBondContact O-N 3.43Å; S917-E920 PolarHBondContact O-N 2.81Å; S917-E920 WeakPolarHBondContact OG-CB 3.19Å; S917-E920 PolarHBondContact OG-N 2.95Å; S917-E920 VanDerWaalsContact OG-N 3.12Å; S917-W921 PolarHBondContact O-N 2.81Å
918	V	79.7	Confident	57.6	Low	6 Å²	6	59.6 Å²	59.6	4%	0.036	33%	0.326	C	S	.	.	H	α-helix	trans	-58.7	-33.8	172.6	178.9	0	0	0	0	110.9	W921 L922 F934 T941 M942 V945	V918-W921 HydrophobicContact CG1-CE3 4.02Å; V918-W921 HydrophobicContact CG1-CZ3 4.24Å; V918-W921 PolarHBondContact O-N 3.36Å; V918-L922 HydrophobicContact CG1-CD1 3.81Å; V918-L922 HydrophobicContact CG1-CG 4.23Å; V918-L922 WeakPolarHBondContact O-CB 3.27Å; V918-L922 VanDerWaalsContact O-CG 3.24Å; V918-L922 WeakPolarHBondContact O-CG 3.44Å; V918-L922 PolarHBondContact O-N 3.01Å; V918-F934 HydrophobicContact CG1-CB 3.93Å; V918-F934 HydrophobicContact CG1-CD1 3.68Å; V918-F934 HydrophobicContact CG1-CE1 4.5Å; V918-F934 HydrophobicContact CG1-CG 4.02Å; V918-T941 WeakPolarHBondContact CG2-O 3.46Å; V918-M942 HydrophobicContact CG2-SD 4.44Å; V918-V945 HydrophobicContact CB-CG2 4.49Å; V918-V945 HydrophobicContact CG1-CG2 4.04Å; V918-V945 HydrophobicContact CG2-CG2 3.62Å
919	S	75.9	Confident	59.6	Low	48 Å²	48	62.6 Å²	62.6	34%	0.336	33%	0.329	S	S	.	.	H	α-helix	trans	-63.8	-47.8	176.3	-57.5	0	0	0	0	113	S917 W921 L922 E923 I931	S917-S919 PolarHBondContact O-N 3.43Å; S919-W921 VanDerWaalsContact C-N 3.35Å; S919-L922 PolarHBondContact O-N 3.01Å; S919-E923 WeakPolarHBondContact O-CB 3.45Å; S919-E923 VanDerWaalsContact O-CG 3.31Å; S919-E923 WeakPolarHBondContact O-CG 3.29Å; S919-E923 PolarHBondContact O-N 3.47Å; S919-I931 WeakPolarHBondContact OG-CG2 3.47Å
920	E	70.4	Confident	62.1	Low	73 Å²	73	62.3 Å²	62.3	34%	0.341	32%	0.322	S	S	.	.	H	α-helix	trans	-65.1	-40.2	178.1	-173.6	-178.1	-162.6	0	0	111.4	Y915 R916 S917 E923 S924	Y915-E920 HydrophobicContact CD1-CG 4.22Å; R916-E920 WeakPolarHBondContact CB-OE2 3.32Å; R916-E920 PolarHBondContact N-OE2 2.62Å; S917-E920 PolarHBondContact O-N 2.81Å; S917-E920 WeakPolarHBondContact OG-CB 3.19Å; S917-E920 PolarHBondContact OG-N 2.95Å; S917-E920 VanDerWaalsContact OG-N 3.12Å; E920-E923 PolarHBondContact O-N 3.26Å; E920-S924 WeakPolarHBondContact O-CB 3.4Å; E920-S924 PolarHBondContact O-N 3.06Å
921	W	76.8	Confident	64.3	Low	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-52.5	173.3	166.5	55	0	0	0	111.7	Y915 S917 V918 S919 E923 S924 I925 F934 M942 V945 I967 S970 I971 F974	Y915-W921 HydrophobicContact CD1-CB 4.46Å; Y915-W921 HydrophobicContact CD2-CB 3.65Å; Y915-W921 AromaticContact CD2-CD1 3.51Å; Y915-W921 AromaticContact CD2-CG 3.9Å; Y915-W921 HydrophobicContact CD2-CG 3.9Å; Y915-W921 HydrophobicContact CE2-CB 4.44Å; Y915-W921 AromaticContact CE2-CD1 3.57Å; Y915-W921 HydrophobicContact CE2-CG 4.37Å; Y915-W921 HydrophobicContact CG-CB 3.67Å; Y915-W921 HydrophobicContact CG-CG 4.41Å; S917-W921 PolarHBondContact O-N 2.81Å; V918-W921 HydrophobicContact CG1-CE3 4.02Å; V918-W921 HydrophobicContact CG1-CZ3 4.24Å; V918-W921 PolarHBondContact O-N 3.36Å; S919-W921 VanDerWaalsContact C-N 3.35Å; W921-E923 PolarHBondContact O-N 3.04Å; W921-S924 WeakPolarHBondContact O-CB 3.39Å; W921-S924 PolarHBondContact O-N 2.89Å; W921-S924 PolarHBondContact O-OG 2.95Å; W921-I925 HydrophobicContact CD2-CD1 4.5Å; W921-I925 HydrophobicContact CH2-CD1 4.45Å; W921-I925 HydrophobicContact CZ2-CD1 3.74Å; W921-I925 WeakPolarHBondContact O-CG1 3.47Å; W921-I925 PolarHBondContact O-N 2.84Å; W921-F934 HydrophobicContact CH2-CE1 4.23Å; W921-F934 HydrophobicContact CH2-CZ 4.35Å; W921-F934 HydrophobicContact CZ3-CD1 4.37Å; W921-F934 AromaticContact CZ3-CE1 3.74Å; W921-F934 HydrophobicContact CZ3-CE1 3.74Å; W921-F934 HydrophobicContact CZ3-CZ 4.11Å; W921-M942 HydrophobicContact CB-SD 3.99Å; W921-M942 HydrophobicContact CD2-CE 3.61Å; W921-M942 HydrophobicContact CD2-SD 3.85Å; W921-M942 HydrophobicContact CE3-CE 3.95Å; W921-M942 HydrophobicContact CE3-SD 3.84Å; W921-M942 HydrophobicContact CG-CE 3.87Å; W921-M942 HydrophobicContact CG-SD 3.94Å; W921-M942 HydrophobicContact CZ2-CE 4.28Å; W921-M942 HydrophobicContact CZ3-CE 4.42Å; W921-V945 HydrophobicContact CE3-CG1 3.98Å; W921-V945 HydrophobicContact CH2-CG1 3.23Å; W921-V945 HydrophobicContact CZ2-CG1 4.06Å; W921-V945 HydrophobicContact CZ3-CB 4.32Å; W921-V945 HydrophobicContact CZ3-CG1 3.22Å; W921-V945 HydrophobicContact CZ3-CG2 4.16Å; W921-I967 HydrophobicContact CH2-CG2 3.76Å; W921-I967 HydrophobicContact CZ2-CG2 4.32Å; W921-S970 PolarHBondContact NE1-OG 2.8Å; W921-I971 HydrophobicContact CH2-CD1 4.01Å; W921-I971 HydrophobicContact CH2-CG1 3.91Å; W921-I971 HydrophobicContact CZ2-CD1 4.37Å; W921-I971 HydrophobicContact CZ2-CG1 3.83Å; W921-F974 AromaticContact CD1-CE2 3.8Å; W921-F974 AromaticContact CD1-CZ 3.56Å; W921-F974 HydrophobicContact CD2-CE2 4.5Å; W921-F974 AromaticContact CE2-CE2 3.83Å; W921-F974 HydrophobicContact CG-CE2 4.44Å; W921-F974 HydrophobicContact CG-CZ 4.46Å; W921-F974 HydrophobicContact CZ2-CE2 4.32Å; W921-F974 AromaticContact NE1-CE2 3.37Å; W921-F974 AromaticContact NE1-CZ 3.45Å
922	L	70.4	Confident	66.4	Low	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.1	-37.3	178.3	-73.3	171	0	0	0	111.2	V918 S919 I925 R926 M927 K928 I931 F934	V918-L922 HydrophobicContact CG1-CD1 3.81Å; V918-L922 HydrophobicContact CG1-CG 4.23Å; V918-L922 WeakPolarHBondContact O-CB 3.27Å; V918-L922 VanDerWaalsContact O-CG 3.24Å; V918-L922 WeakPolarHBondContact O-CG 3.44Å; V918-L922 PolarHBondContact O-N 3.01Å; S919-L922 PolarHBondContact O-N 3.01Å; L922-I925 HydrophobicContact CD2-CD1 4.36Å; L922-I925 CarbonylContact O-C 3.59Å; L922-R926 CarbonylContact O-C 3.44Å; L922-R926 PolarHBondContact O-N 3.42Å; L922-R926 VanDerWaalsContact O-N 3.12Å; L922-M927 HydrophobicContact CB-CB 4.35Å; L922-M927 HydrophobicContact CD2-CB 3.69Å; L922-M927 CarbonylContact O-C 3.57Å; L922-M927 WeakPolarHBondContact O-CA 3.49Å; L922-M927 PolarHBondContact O-N 3.34Å; L922-K928 PolarHBondContact O-N 2.94Å; L922-I931 HydrophobicContact CB-CG1 4.05Å; L922-I931 HydrophobicContact CD1-CB 4.48Å; L922-I931 HydrophobicContact CD1-CG1 3.87Å; L922-F934 HydrophobicContact CD1-CB 4.15Å; L922-F934 HydrophobicContact CD1-CD1 4.45Å; L922-F934 HydrophobicContact CD1-CD2 3.77Å; L922-F934 HydrophobicContact CD1-CE2 4.26Å; L922-F934 HydrophobicContact CD1-CG 3.87Å; L922-F934 HydrophobicContact CD2-CD2 4.35Å; L922-F934 HydrophobicContact CD2-CE2 4Å; L922-F934 HydrophobicContact CD2-CZ 4.22Å
923	E	67.4	Low	68.4	Low	86 Å²	86	59.3 Å²	59.3	40%	0.402	28%	0.278	S	S	.	.	H	α-helix	trans	-63.2	-43.6	172.6	-75.8	-177.8	171.3	0	0	112.5	S919 E920 W921 I925 R926 K928 I931	S919-E923 WeakPolarHBondContact O-CB 3.45Å; S919-E923 VanDerWaalsContact O-CG 3.31Å; S919-E923 WeakPolarHBondContact O-CG 3.29Å; S919-E923 PolarHBondContact O-N 3.47Å; E920-E923 PolarHBondContact O-N 3.26Å; W921-E923 PolarHBondContact O-N 3.04Å; E923-I925 VanDerWaalsContact C-N 3.32Å; E923-I925 PolarHBondContact O-N 3.29Å; E923-R926 WeakPolarHBondContact O-CA 3.46Å; E923-R926 PolarHBondContact O-N 3Å; E923-K928 HydrophobicContact CG-CB 3.91Å; E923-K928 HydrophobicContact CG-CD 3.91Å; E923-K928 HydrophobicContact CG-CG 3.72Å; E923-K928 WeakPolarHBondContact OE1-CD 3.37Å; E923-K928 WeakPolarHBondContact OE1-CE 3.36Å; E923-K928 IonicContact OE1-NZ 2.75Å; E923-K928 PolarHBondContact OE1-NZ 2.97Å; E923-I931 HydrophobicContact CG-CD1 4.14Å
924	S	57.4	Low	70.6	Confident	52 Å²	52	57.2 Å²	57.2	36%	0.364	27%	0.268	S	S	.	.	H	α-helix	trans	-64.3	-34.2	179.7	79.4	0	0	0	0	113.4	Y915 E920 W921 R926	Y915-S924 WeakPolarHBondContact CE1-OG 3.29Å; Y915-S924 PolarHBondContact OH-OG 2.95Å; Y915-S924 VanDerWaalsContact OH-OG 3.06Å; E920-S924 WeakPolarHBondContact O-CB 3.4Å; E920-S924 PolarHBondContact O-N 3.06Å; W921-S924 WeakPolarHBondContact O-CB 3.39Å; W921-S924 PolarHBondContact O-N 2.89Å; W921-S924 PolarHBondContact O-OG 2.95Å; S924-R926 VanDerWaalsContact C-N 3.28Å
925	I	59.1	Low	72.2	Confident	6 Å²	6	62.7 Å²	62.7	3%	0.031	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	16.6	172.9	66.8	162.3	0	0	0	111.9	W921 L922 E923 M927 R966 I967	W921-I925 HydrophobicContact CD2-CD1 4.5Å; W921-I925 HydrophobicContact CH2-CD1 4.45Å; W921-I925 HydrophobicContact CZ2-CD1 3.74Å; W921-I925 WeakPolarHBondContact O-CG1 3.47Å; W921-I925 PolarHBondContact O-N 2.84Å; L922-I925 HydrophobicContact CD2-CD1 4.36Å; L922-I925 CarbonylContact O-C 3.59Å; E923-I925 VanDerWaalsContact C-N 3.32Å; E923-I925 PolarHBondContact O-N 3.29Å; I925-M927 HydrophobicContact CD1-CB 4.14Å; I925-M927 HydrophobicContact CD1-CG 3.76Å; I925-M927 HydrophobicContact CG1-CB 3.98Å; I925-M927 HydrophobicContact CG1-CG 3.83Å; I925-M927 WeakPolarHBondContact O-CG 3.39Å; I925-M927 PolarHBondContact O-N 3.38Å; I925-M927 VanDerWaalsContact O-N 3.12Å; I925-R966 WeakPolarHBondContact O-CD 3.36Å; I925-R966 PolarHBondContact O-NE 3.2Å; I925-R966 PolarHBondContact O-NH1 2.78Å; I925-R966 PolarHBondContact O-NH2 3.02Å; I925-I967 HydrophobicContact CD1-CG1 4.02Å
926	R	55.2	Low	73.5	Confident	124 Å²	124	65.3 Å²	65.3	47%	0.468	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	33.2	177	-58.1	-101.8	-173.8	145.9	7.5	113.9	D824 L922 E923 S924	D824-R926 VanDerWaalsContact CG-NH2 3.27Å; D824-R926 IonicContact OD1-CZ 2.81Å; D824-R926 IonicContact OD1-NH1 3.46Å; D824-R926 PolarHBondContact OD1-NH1 2.8Å; D824-R926 IonicContact OD1-NH2 3.2Å; D824-R926 PolarHBondContact OD1-NH2 3.08Å; D824-R926 IonicContact OD2-CZ 3.53Å; D824-R926 IonicContact OD2-NH1 3.5Å; D824-R926 IonicContact OD2-NH2 3.43Å; D824-R926 PolarHBondContact OD2-NH2 2.99Å; D824-R926 VanDerWaalsContact OD2-NH2 3.07Å; L922-R926 CarbonylContact O-C 3.44Å; L922-R926 PolarHBondContact O-N 3.42Å; L922-R926 VanDerWaalsContact O-N 3.12Å; E923-R926 WeakPolarHBondContact O-CA 3.46Å; E923-R926 PolarHBondContact O-N 3Å; S924-R926 VanDerWaalsContact C-N 3.28Å
927	M	69.6	Low	74.6	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.02	30%	0.301	C	S	.	.			trans	-107.5	24.1	174.7	-66.5	-66.1	101.9	0	0	111.9	L922 I925 R929 Y930 H963 I967	L922-M927 HydrophobicContact CB-CB 4.35Å; L922-M927 HydrophobicContact CD2-CB 3.69Å; L922-M927 CarbonylContact O-C 3.57Å; L922-M927 WeakPolarHBondContact O-CA 3.49Å; L922-M927 PolarHBondContact O-N 3.34Å; I925-M927 HydrophobicContact CD1-CB 4.14Å; I925-M927 HydrophobicContact CD1-CG 3.76Å; I925-M927 HydrophobicContact CG1-CB 3.98Å; I925-M927 HydrophobicContact CG1-CG 3.83Å; I925-M927 WeakPolarHBondContact O-CG 3.39Å; I925-M927 PolarHBondContact O-N 3.38Å; I925-M927 VanDerWaalsContact O-N 3.12Å; M927-R929 PolarHBondContact O-N 3.28Å; M927-Y930 HydrophobicContact CB-CD2 4.11Å; M927-Y930 PolarHBondContact O-N 2.93Å; M927-Y930 HydrophobicContact SD-CD2 3.98Å; M927-Y930 HydrophobicContact SD-CE2 3.89Å; M927-H963 HydrophobicContact SD-CB 3.79Å; M927-I967 HydrophobicContact CB-CG1 4.43Å; M927-I967 HydrophobicContact CG-CD1 4.22Å; M927-I967 HydrophobicContact CG-CG1 3.83Å; M927-I967 HydrophobicContact SD-CD1 4.32Å; M927-I967 HydrophobicContact SD-CG1 4.28Å
928	K	68.4	Low	74.9	Confident	125 Å²	125	58.9 Å²	58.9	54%	0.543	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-48.5	-34.1	-178.8	-174.2	179.3	178.1	133.5	0	113.7	L922 E923 Y930 I931	L922-K928 PolarHBondContact O-N 2.94Å; E923-K928 HydrophobicContact CG-CB 3.91Å; E923-K928 HydrophobicContact CG-CD 3.91Å; E923-K928 HydrophobicContact CG-CG 3.72Å; E923-K928 WeakPolarHBondContact OE1-CD 3.37Å; E923-K928 WeakPolarHBondContact OE1-CE 3.36Å; E923-K928 IonicContact OE1-NZ 2.75Å; E923-K928 PolarHBondContact OE1-NZ 2.97Å; K928-Y930 PolarHBondContact O-N 3.13Å; K928-Y930 VanDerWaalsContact O-N 3.12Å; K928-I931 HydrophobicContact CB-CD1 4.32Å; K928-I931 HydrophobicContact CG-CD1 3.62Å; K928-I931 WeakPolarHBondContact O-CB 3.48Å; K928-I931 WeakPolarHBondContact O-CD1 3.28Å; K928-I931 WeakPolarHBondContact O-CG1 3.32Å; K928-I931 PolarHBondContact O-N 2.88Å; K928-I931 VanDerWaalsContact O-N 3.12Å
929	R	71.1	Confident	75.1	Confident	121 Å²	121	59.7 Å²	59.7	46%	0.457	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-59.3	-23.6	178.3	69.2	178.1	67	-175.4	7.2	113.8	D719 M927	D719-R929 IonicContact OD1-CZ 3.26Å; D719-R929 VanDerWaalsContact OD1-CZ 3.26Å; D719-R929 IonicContact OD1-NH1 3.55Å; D719-R929 IonicContact OD1-NH2 2.72Å; D719-R929 PolarHBondContact OD1-NH2 3.15Å; M927-R929 PolarHBondContact O-N 3.28Å
930	Y	82	Confident	75.2	Confident	16 Å²	16	62.7 Å²	62.7	6%	0.063	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-91.6	-0.1	-178.6	-61.2	-59.2	0	0	0	114	M927 K928 L932 H933 F934 I958 H963 I967	M927-Y930 HydrophobicContact CB-CD2 4.11Å; M927-Y930 PolarHBondContact O-N 2.93Å; M927-Y930 HydrophobicContact SD-CD2 3.98Å; M927-Y930 HydrophobicContact SD-CE2 3.89Å; K928-Y930 PolarHBondContact O-N 3.13Å; K928-Y930 VanDerWaalsContact O-N 3.12Å; Y930-L932 VanDerWaalsContact C-N 3.26Å; Y930-L932 PolarHBondContact O-N 2.94Å; Y930-H933 HydrophobicContact CD1-CB 4.5Å; Y930-H933 AromaticContact CD1-CD2 3.8Å; Y930-H933 WeakPolarHBondContact O-CA 3.41Å; Y930-H933 WeakPolarHBondContact O-CB 3.43Å; Y930-H933 PolarHBondContact O-N 3.42Å; Y930-F934 WeakPolarHBondContact O-CD2 3.1Å; Y930-F934 PolarHBondContact O-N 3.42Å; Y930-I958 HydrophobicContact CD1-CB 4.39Å; Y930-I958 HydrophobicContact CD1-CD1 3.74Å; Y930-I958 HydrophobicContact CD1-CG1 3.53Å; Y930-I958 HydrophobicContact CD1-CG2 4.31Å; Y930-I958 HydrophobicContact CD2-CD1 4.35Å; Y930-I958 HydrophobicContact CD2-CG2 4.42Å; Y930-I958 HydrophobicContact CE1-CB 4.16Å; Y930-I958 HydrophobicContact CE1-CD1 4.36Å; Y930-I958 HydrophobicContact CE1-CG1 3.77Å; Y930-I958 HydrophobicContact CE1-CG2 3.91Å; Y930-I958 HydrophobicContact CE2-CG2 4.03Å; Y930-I958 HydrophobicContact CG-CD1 3.73Å; Y930-I958 HydrophobicContact CG-CG1 4.05Å; Y930-H963 HydrophobicContact CE2-CB 3.88Å; Y930-H963 AromaticContact CE2-CG 3.86Å; Y930-H963 AromaticContact CE2-ND1 3.26Å; Y930-H963 VanDerWaalsContact CE2-ND1 3.26Å; Y930-H963 WeakPolarHBondContact CE2-ND1 3.38Å; Y930-H963 AromaticContact CZ-ND1 3.41Å; Y930-H963 PolarHBondContact OH-ND1 3.02Å; Y930-I967 HydrophobicContact CD2-CD1 4.23Å
931	I	81.8	Confident	75.6	Confident	34 Å²	34	62 Å²	62	17%	0.174	33%	0.328	C	S	.	.	H	α-helix	trans	-53.2	-45.5	178.7	-70.2	174.1	0	0	0	111.6	S919 L922 E923 K928 H933 F934 H935	S919-I931 WeakPolarHBondContact OG-CG2 3.47Å; L922-I931 HydrophobicContact CB-CG1 4.05Å; L922-I931 HydrophobicContact CD1-CB 4.48Å; L922-I931 HydrophobicContact CD1-CG1 3.87Å; E923-I931 HydrophobicContact CG-CD1 4.14Å; K928-I931 HydrophobicContact CB-CD1 4.32Å; K928-I931 HydrophobicContact CG-CD1 3.62Å; K928-I931 WeakPolarHBondContact O-CB 3.48Å; K928-I931 WeakPolarHBondContact O-CD1 3.28Å; K928-I931 WeakPolarHBondContact O-CG1 3.32Å; K928-I931 PolarHBondContact O-N 2.88Å; K928-I931 VanDerWaalsContact O-N 3.12Å; I931-H933 VanDerWaalsContact C-N 3.32Å; I931-H933 PolarHBondContact O-N 3Å; I931-F934 PolarHBondContact O-N 3.24Å; I931-H935 WeakPolarHBondContact O-CB 3.48Å; I931-H935 PolarHBondContact O-N 2.87Å
932	L	78.5	Confident	75.5	Confident	137 Å²	137	62.6 Å²	62.6	72%	0.717	33%	0.33	S	S	*	.	H	α-helix	trans	-68.2	-31.2	178.6	-68.3	174.3	0	0	0	112.8	Y930 S936	Y930-L932 VanDerWaalsContact C-N 3.26Å; Y930-L932 PolarHBondContact O-N 2.94Å; L932-S936 VanDerWaalsContact O-CB 3.32Å; L932-S936 WeakPolarHBondContact O-CB 3.01Å; L932-S936 PolarHBondContact O-N 3.08Å; L932-S936 PolarHBondContact O-OG 2.92Å; L932-S936 VanDerWaalsContact O-OG 3.08Å
933	H	86.1	Confident	75.8	Confident	69 Å²	69	69.3 Å²	69.3	32%	0.319	36%	0.362	S	S	.	.	H	α-helix	trans	-70.5	-39.9	176.2	-69.3	-95.2	0	0	0	111.8	Y930 I931 S936 A937 M956	Y930-H933 HydrophobicContact CD1-CB 4.5Å; Y930-H933 AromaticContact CD1-CD2 3.8Å; Y930-H933 WeakPolarHBondContact O-CA 3.41Å; Y930-H933 WeakPolarHBondContact O-CB 3.43Å; Y930-H933 PolarHBondContact O-N 3.42Å; I931-H933 VanDerWaalsContact C-N 3.32Å; I931-H933 PolarHBondContact O-N 3Å; H933-S936 PolarHBondContact O-OG 2.96Å; H933-S936 VanDerWaalsContact O-OG 3.04Å; H933-A937 WeakPolarHBondContact O-CB 3.4Å; H933-A937 PolarHBondContact O-N 2.68Å; H933-M956 PolarHBondContact ND1-O 3.22Å
934	F	89.4	Confident	76.2	Confident	1 Å²	1	68.1 Å²	68.1	0%	0.004	36%	0.362	C	S	.	.	H	α-helix	trans	-69	-42.1	174.3	-84.2	-108.1	0	0	0	111.5	V918 W921 L922 Y930 I931 A937 G938 L939 V945 L948 L953 M956 I958 I967	V918-F934 HydrophobicContact CG1-CB 3.93Å; V918-F934 HydrophobicContact CG1-CD1 3.68Å; V918-F934 HydrophobicContact CG1-CE1 4.5Å; V918-F934 HydrophobicContact CG1-CG 4.02Å; W921-F934 HydrophobicContact CH2-CE1 4.23Å; W921-F934 HydrophobicContact CH2-CZ 4.35Å; W921-F934 HydrophobicContact CZ3-CD1 4.37Å; W921-F934 AromaticContact CZ3-CE1 3.74Å; W921-F934 HydrophobicContact CZ3-CE1 3.74Å; W921-F934 HydrophobicContact CZ3-CZ 4.11Å; L922-F934 HydrophobicContact CD1-CB 4.15Å; L922-F934 HydrophobicContact CD1-CD1 4.45Å; L922-F934 HydrophobicContact CD1-CD2 3.77Å; L922-F934 HydrophobicContact CD1-CE2 4.26Å; L922-F934 HydrophobicContact CD1-CG 3.87Å; L922-F934 HydrophobicContact CD2-CD2 4.35Å; L922-F934 HydrophobicContact CD2-CE2 4Å; L922-F934 HydrophobicContact CD2-CZ 4.22Å; Y930-F934 WeakPolarHBondContact O-CD2 3.1Å; Y930-F934 PolarHBondContact O-N 3.42Å; I931-F934 PolarHBondContact O-N 3.24Å; F934-A937 PolarHBondContact O-N 3.27Å; F934-G938 PolarHBondContact O-N 2.83Å; F934-L939 HydrophobicContact CB-CB 4.42Å; F934-L939 HydrophobicContact CD1-CB 4.06Å; F934-L939 HydrophobicContact CD1-CD1 3.95Å; F934-L939 HydrophobicContact CE1-CD1 4.33Å; F934-L939 WeakPolarHBondContact O-CB 3.41Å; F934-L939 PolarHBondContact O-N 2.82Å; F934-V945 HydrophobicContact CD1-CG2 4.12Å; F934-V945 HydrophobicContact CE1-CG1 4.36Å; F934-V945 HydrophobicContact CE1-CG2 4.15Å; F934-L948 HydrophobicContact CD1-CD1 4.34Å; F934-L948 HydrophobicContact CE1-CD1 3.45Å; F934-L948 VanDerWaalsContact CE1-CD1 3.45Å; F934-L948 HydrophobicContact CZ-CD1 4.06Å; F934-L953 HydrophobicContact CE2-CD2 4.31Å; F934-L953 HydrophobicContact CZ-CD2 3.8Å; F934-M956 HydrophobicContact CB-CE 4.25Å; F934-M956 HydrophobicContact CD1-CE 3.99Å; F934-M956 HydrophobicContact CD2-CE 3.53Å; F934-M956 HydrophobicContact CE1-CE 4.21Å; F934-M956 HydrophobicContact CE2-CE 3.79Å; F934-M956 HydrophobicContact CG-CE 3.65Å; F934-M956 HydrophobicContact CZ-CE 4.11Å; F934-I958 HydrophobicContact CD2-CD1 4.18Å; F934-I958 HydrophobicContact CE2-CD1 3.51Å; F934-I958 HydrophobicContact CZ-CD1 4.41Å; F934-I967 HydrophobicContact CE2-CD1 4.13Å; F934-I967 HydrophobicContact CZ-CD1 4.28Å; F934-I967 HydrophobicContact CZ-CG2 3.87Å
935	H	83.7	Confident	77.4	Confident	138 Å²	138	65.7 Å²	65.7	64%	0.639	35%	0.345	S	S	*	.	H	α-helix	trans	-64.4	-40.6	176.2	-172.5	-70.6	0	0	0	112.5	I931 A937 G938	I931-H935 WeakPolarHBondContact O-CB 3.48Å; I931-H935 PolarHBondContact O-N 2.87Å; H935-A937 VanDerWaalsContact C-N 3.28Å; H935-A937 PolarHBondContact O-N 2.88Å; H935-G938 PolarHBondContact O-N 2.81Å
936	S	84.3	Confident	78.2	Confident	97 Å²	97	67.4 Å²	67.4	68%	0.678	35%	0.354	S	S	*	.	H	α-helix	trans	-70.6	-24.7	178.2	64.5	0	0	0	0	113.3	L932 H933 G938	L932-S936 VanDerWaalsContact O-CB 3.32Å; L932-S936 WeakPolarHBondContact O-CB 3.01Å; L932-S936 PolarHBondContact O-N 3.08Å; L932-S936 PolarHBondContact O-OG 2.92Å; L932-S936 VanDerWaalsContact O-OG 3.08Å; H933-S936 PolarHBondContact O-OG 2.96Å; H933-S936 VanDerWaalsContact O-OG 3.04Å; S936-G938 VanDerWaalsContact C-N 3.28Å
937	A	84.5	Confident	79.4	Confident	51 Å²	51	68 Å²	68	42%	0.421	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-0.6	173.5	0	0	0	0	0	113.9	H933 F934 H935 L939 M956	H933-A937 WeakPolarHBondContact O-CB 3.4Å; H933-A937 PolarHBondContact O-N 2.68Å; F934-A937 PolarHBondContact O-N 3.27Å; H935-A937 VanDerWaalsContact C-N 3.28Å; H935-A937 PolarHBondContact O-N 2.88Å; A937-L939 VanDerWaalsContact C-N 3.35Å; A937-L939 HydrophobicContact CB-CD1 3.97Å; A937-L939 HydrophobicContact CB-CG 4.19Å; A937-M956 HydrophobicContact CB-CE 3.91Å; A937-M956 HydrophobicContact CB-CG 3.9Å; A937-M956 HydrophobicContact CB-SD 4.13Å
938	G	80.5	Confident	80.1	Confident	49 Å²	49	68.9 Å²	68.9	51%	0.505	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	23.3	-177.7	0	0	0	0	0	114	F934 H935 S936	F934-G938 PolarHBondContact O-N 2.83Å; H935-G938 PolarHBondContact O-N 2.81Å; S936-G938 VanDerWaalsContact C-N 3.28Å
939	L	84.4	Confident	80.9	Confident	23 Å²	23	66.1 Å²	66.1	12%	0.12	36%	0.361	C	S	.	.			trans	-101.3	73	178.4	-58.2	165.8	0	0	0	109.2	F934 A937 C944 V945 L948 M956	F934-L939 HydrophobicContact CB-CB 4.42Å; F934-L939 HydrophobicContact CD1-CB 4.06Å; F934-L939 HydrophobicContact CD1-CD1 3.95Å; F934-L939 HydrophobicContact CE1-CD1 4.33Å; F934-L939 WeakPolarHBondContact O-CB 3.41Å; F934-L939 PolarHBondContact O-N 2.82Å; A937-L939 VanDerWaalsContact C-N 3.35Å; A937-L939 HydrophobicContact CB-CD1 3.97Å; A937-L939 HydrophobicContact CB-CG 4.19Å; L939-C944 HydrophobicContact CD2-CB 3.74Å; L939-V945 HydrophobicContact CB-CG2 4.46Å; L939-L948 HydrophobicContact CD1-CD1 3.93Å; L939-L948 HydrophobicContact CD1-CD2 3.63Å; L939-L948 HydrophobicContact CD1-CG 4.34Å; L939-L948 HydrophobicContact CD2-CD2 4.23Å; L939-M956 HydrophobicContact CD1-CE 3.6Å; L939-M956 HydrophobicContact CD1-SD 3.64Å
940	D	77.3	Confident	81.1	Confident	110 Å²	110	62.5 Å²	62.5	59%	0.588	36%	0.356	S	S	*	.			trans	-96.2	-18.7	-175.9	58.3	-10	0	0	0	113.5
941	T	79.1	Confident	81.2	Confident	60 Å²	60	68.7 Å²	68.7	37%	0.368	39%	0.386	S	S	.	.	S	Bend	trans	-110.5	151.1	176	67.4	0	0	0	0	112.1	V918 E943 C944	V918-T941 WeakPolarHBondContact CG2-O 3.46Å; T941-E943 VanDerWaalsContact C-N 3.26Å; T941-E943 PolarHBondContact O-N 2.8Å; T941-C944 PolarHBondContact O-N 2.68Å; T941-C944 PolarHBondContact OG1-SG 2.81Å
942	M	75.7	Confident	81.4	Confident	11 Å²	11	69.7 Å²	69.7	5%	0.054	39%	0.392	C	S	.	.	H	α-helix	trans	-72.7	-19.8	-176.6	-162.3	59	-153	0	0	113.1	I913 V918 W921 V945 F974	I913-M942 HydrophobicContact CD1-CB 4.26Å; I913-M942 HydrophobicContact CG2-CB 3.69Å; I913-M942 HydrophobicContact CG2-CG 3.28Å; V918-M942 HydrophobicContact CG2-SD 4.44Å; W921-M942 HydrophobicContact CB-SD 3.99Å; W921-M942 HydrophobicContact CD2-CE 3.61Å; W921-M942 HydrophobicContact CD2-SD 3.85Å; W921-M942 HydrophobicContact CE3-CE 3.95Å; W921-M942 HydrophobicContact CE3-SD 3.84Å; W921-M942 HydrophobicContact CG-CE 3.87Å; W921-M942 HydrophobicContact CG-SD 3.94Å; W921-M942 HydrophobicContact CZ2-CE 4.28Å; W921-M942 HydrophobicContact CZ3-CE 4.42Å; M942-V945 HydrophobicContact CE-CB 4.13Å; M942-V945 HydrophobicContact CE-CG1 3.72Å; M942-V945 PolarHBondContact O-N 3.13Å; M942-V945 HydrophobicContact SD-CB 4.15Å; M942-V945 HydrophobicContact SD-CG1 4.2Å; M942-V945 HydrophobicContact SD-CG2 4.36Å; M942-F974 HydrophobicContact CE-CD2 3.43Å; M942-F974 VanDerWaalsContact CE-CD2 3.43Å; M942-F974 HydrophobicContact CE-CE2 3.12Å; M942-F974 HydrophobicContact CE-CZ 4.05Å
943	E	75.8	Confident	81.7	Confident	142 Å²	142	63.1 Å²	63.1	66%	0.664	36%	0.358	S	S	*	.	H	α-helix	trans	-66.8	-41.5	172.1	-67.5	173.5	178.6	0	0	111.7	I913 T941 V945 L946	I913-E943 HydrophobicContact CD1-CG 4.14Å; T941-E943 VanDerWaalsContact C-N 3.26Å; T941-E943 PolarHBondContact O-N 2.8Å; E943-V945 PolarHBondContact O-N 2.85Å; E943-L946 PolarHBondContact O-N 3.07Å
944	C	77.1	Confident	81.5	Confident	61 Å²	61	63 Å²	63	41%	0.412	36%	0.362	S	S	.	.	H	α-helix	trans	-64.6	-24.8	177.7	-66.4	0	0	0	0	113.1	L939 T941	L939-C944 HydrophobicContact CD2-CB 3.74Å; T941-C944 PolarHBondContact O-N 2.68Å; T941-C944 PolarHBondContact OG1-SG 2.81Å
945	V	81.3	Confident	81.3	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-77.8	-23.5	-178.1	170.9	0	0	0	0	112.3	V918 W921 F934 L939 M942 E943 E947 L948 I971	V918-V945 HydrophobicContact CB-CG2 4.49Å; V918-V945 HydrophobicContact CG1-CG2 4.04Å; V918-V945 HydrophobicContact CG2-CG2 3.62Å; W921-V945 HydrophobicContact CE3-CG1 3.98Å; W921-V945 HydrophobicContact CH2-CG1 3.23Å; W921-V945 HydrophobicContact CZ2-CG1 4.06Å; W921-V945 HydrophobicContact CZ3-CB 4.32Å; W921-V945 HydrophobicContact CZ3-CG1 3.22Å; W921-V945 HydrophobicContact CZ3-CG2 4.16Å; F934-V945 HydrophobicContact CD1-CG2 4.12Å; F934-V945 HydrophobicContact CE1-CG1 4.36Å; F934-V945 HydrophobicContact CE1-CG2 4.15Å; L939-V945 HydrophobicContact CB-CG2 4.46Å; M942-V945 HydrophobicContact CE-CB 4.13Å; M942-V945 HydrophobicContact CE-CG1 3.72Å; M942-V945 PolarHBondContact O-N 3.13Å; M942-V945 HydrophobicContact SD-CB 4.15Å; M942-V945 HydrophobicContact SD-CG1 4.2Å; M942-V945 HydrophobicContact SD-CG2 4.36Å; E943-V945 PolarHBondContact O-N 2.85Å; V945-E947 VanDerWaalsContact C-N 3.29Å; V945-E947 PolarHBondContact O-N 3.1Å; V945-L948 HydrophobicContact CB-CD1 4.27Å; V945-L948 HydrophobicContact CG1-CD1 4.01Å; V945-L948 HydrophobicContact CG2-CD1 4.42Å; V945-L948 WeakPolarHBondContact O-CG 3.32Å; V945-L948 PolarHBondContact O-N 2.95Å; V945-I971 HydrophobicContact CG1-CD1 3.84Å; V945-I971 HydrophobicContact CG1-CG1 3.82Å; V945-I971 VanDerWaalsContact O-CD1 3.31Å; V945-I971 WeakPolarHBondContact O-CD1 3.36Å
946	L	77.6	Confident	81.4	Confident	42 Å²	42	65.3 Å²	65.3	22%	0.22	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-33.3	-174.4	-65.3	175	0	0	0	112.4	E943 L948 I971 F974 K975	E943-L946 PolarHBondContact O-N 3.07Å; L946-L948 PolarHBondContact O-N 2.94Å; L946-I971 WeakPolarHBondContact O-CG2 3.49Å; L946-F974 HydrophobicContact CD2-CB 3.52Å; L946-F974 HydrophobicContact CD2-CD2 4.03Å; L946-F974 HydrophobicContact CD2-CG 4.23Å; L946-K975 WeakPolarHBondContact O-CE 2.88Å; L946-K975 PolarHBondContact O-NZ 2.72Å
947	E	79.1	Confident	80.9	Confident	138 Å²	138	62.7 Å²	62.7	65%	0.645	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	10	-176.1	-61.9	-52.9	140.5	0	0	115.1	V945 K975	V945-E947 VanDerWaalsContact C-N 3.29Å; V945-E947 PolarHBondContact O-N 3.1Å; E947-K975 VanDerWaalsContact CD-NZ 3.27Å; E947-K975 WeakPolarHBondContact OE1-CE 3.34Å; E947-K975 IonicContact OE1-NZ 3.14Å; E947-K975 PolarHBondContact OE1-NZ 2.82Å; E947-K975 VanDerWaalsContact OE1-NZ 3.14Å; E947-K975 IonicContact OE2-NZ 2.93Å; E947-K975 PolarHBondContact OE2-NZ 3.45Å
948	L	85.6	Confident	80.8	Confident	21 Å²	21	60.2 Å²	60.2	11%	0.11	34%	0.341	C	S	.	.			trans	-69.4	136.3	-179	-66.2	168.9	0	0	0	112.6	F934 L939 V945 L946 D952 L953 M956 L968 I971	F934-L948 HydrophobicContact CD1-CD1 4.34Å; F934-L948 HydrophobicContact CE1-CD1 3.45Å; F934-L948 VanDerWaalsContact CE1-CD1 3.45Å; F934-L948 HydrophobicContact CZ-CD1 4.06Å; L939-L948 HydrophobicContact CD1-CD1 3.93Å; L939-L948 HydrophobicContact CD1-CD2 3.63Å; L939-L948 HydrophobicContact CD1-CG 4.34Å; L939-L948 HydrophobicContact CD2-CD2 4.23Å; V945-L948 HydrophobicContact CB-CD1 4.27Å; V945-L948 HydrophobicContact CG1-CD1 4.01Å; V945-L948 HydrophobicContact CG2-CD1 4.42Å; V945-L948 WeakPolarHBondContact O-CG 3.32Å; V945-L948 PolarHBondContact O-N 2.95Å; L946-L948 PolarHBondContact O-N 2.94Å; L948-D952 HydrophobicContact CD2-CB 4.03Å; L948-L953 HydrophobicContact CD1-CD2 4.26Å; L948-M956 HydrophobicContact CD2-SD 4.39Å; L948-L968 WeakPolarHBondContact O-CD2 3.4Å; L948-I971 HydrophobicContact CB-CD1 4.03Å; L948-I971 HydrophobicContact CD1-CD1 4.18Å
949	T	84.6	Confident	80.2	Confident	67 Å²	67	62.4 Å²	62.4	41%	0.411	35%	0.345	S	S	.	.			trans	-105.4	168.2	174.1	72.4	0	0	0	0	111.8	E951 D952 L953	T949-E951 PolarHBondContact O-N 3.48Å; T949-E951 PolarHBondContact OG1-N 2.83Å; T949-D952 WeakPolarHBondContact CB-OD2 3.48Å; T949-D952 PolarHBondContact N-OD2 3.37Å; T949-D952 PolarHBondContact O-N 3.14Å; T949-D952 VanDerWaalsContact OG1-CG 3.22Å; T949-D952 PolarHBondContact OG1-N 2.77Å; T949-D952 PolarHBondContact OG1-OD2 2.99Å; T949-L953 PolarHBondContact O-N 2.73Å
950	A	75.6	Confident	78.8	Confident	45 Å²	45	65.2 Å²	65.2	37%	0.372	36%	0.359	S	S	.	.	H	α-helix	trans	-61.1	-31.1	174.7	0	0	0	0	0	112.9	T954 L968	A950-T954 PolarHBondContact O-N 2.85Å; A950-T954 VanDerWaalsContact O-N 3.16Å; A950-T954 PolarHBondContact O-OG1 3.01Å; A950-L968 HydrophobicContact CB-CD1 3.69Å
951	E	82.8	Confident	77.6	Confident	146 Å²	146	64.7 Å²	64.7	68%	0.682	36%	0.362	S	S	*	.	H	α-helix	trans	-69.2	-40.5	176.5	-72.6	178.2	172.8	0	0	111	T949 T954 Q955	T949-E951 PolarHBondContact O-N 3.48Å; T949-E951 PolarHBondContact OG1-N 2.83Å; E951-T954 WeakPolarHBondContact O-CB 3.39Å; E951-T954 PolarHBondContact O-N 2.83Å; E951-Q955 WeakPolarHBondContact O-CG 3.33Å; E951-Q955 PolarHBondContact O-N 2.86Å
952	D	86.5	Confident	76.1	Confident	55 Å²	55	62.8 Å²	62.8	29%	0.294	35%	0.354	S	S	.	.	H	α-helix	trans	-62.6	-45.6	177	-56.8	-46.8	0	0	0	111.6	L948 T949 T954 Q955 M956	L948-D952 HydrophobicContact CD2-CB 4.03Å; T949-D952 WeakPolarHBondContact CB-OD2 3.48Å; T949-D952 PolarHBondContact N-OD2 3.37Å; T949-D952 PolarHBondContact O-N 3.14Å; T949-D952 VanDerWaalsContact OG1-CG 3.22Å; T949-D952 PolarHBondContact OG1-N 2.77Å; T949-D952 PolarHBondContact OG1-OD2 2.99Å; D952-T954 PolarHBondContact O-N 3.13Å; D952-Q955 PolarHBondContact O-N 2.81Å; D952-Q955 VanDerWaalsContact O-N 3.11Å; D952-M956 VanDerWaalsContact O-CG 3.23Å; D952-M956 WeakPolarHBondContact O-CG 3.25Å; D952-M956 PolarHBondContact O-N 3.08Å
953	L	85.1	Confident	75.6	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-61.2	-36.6	176.4	-62.4	-179.6	0	0	0	111.8	F934 L948 T949 M956 G957 I958 Q964 I967 L968	F934-L953 HydrophobicContact CE2-CD2 4.31Å; F934-L953 HydrophobicContact CZ-CD2 3.8Å; L948-L953 HydrophobicContact CD1-CD2 4.26Å; T949-L953 PolarHBondContact O-N 2.73Å; L953-M956 HydrophobicContact CD2-SD 4.23Å; L953-M956 PolarHBondContact O-N 3.28Å; L953-G957 PolarHBondContact O-N 2.92Å; L953-I958 HydrophobicContact CB-CB 4.31Å; L953-I958 HydrophobicContact CD2-CD1 4.13Å; L953-I958 WeakPolarHBondContact O-CA 3.27Å; L953-I958 VanDerWaalsContact O-CB 3.26Å; L953-I958 WeakPolarHBondContact O-CB 3.32Å; L953-I958 PolarHBondContact O-N 2.94Å; L953-Q964 HydrophobicContact CB-CG 4.16Å; L953-Q964 HydrophobicContact CD1-CB 4.22Å; L953-Q964 HydrophobicContact CD1-CG 4.41Å; L953-I967 HydrophobicContact CD1-CB 4Å; L953-I967 HydrophobicContact CD1-CG2 3.72Å; L953-I967 HydrophobicContact CD2-CG2 3.89Å; L953-I967 HydrophobicContact CG-CG2 4.48Å; L953-L968 HydrophobicContact CD1-CD1 4.18Å; L953-L968 HydrophobicContact CD1-CD2 3.94Å; L953-L968 HydrophobicContact CD1-CG 3.7Å
954	T	82	Confident	75.2	Confident	67 Å²	67	57.3 Å²	57.3	41%	0.411	33%	0.328	S	S	.	.	H	α-helix	trans	-65.3	-42.4	175.6	-52.7	0	0	0	0	111.1	A950 E951 D952 M956 G957 Q964	A950-T954 PolarHBondContact O-N 2.85Å; A950-T954 VanDerWaalsContact O-N 3.16Å; A950-T954 PolarHBondContact O-OG1 3.01Å; E951-T954 WeakPolarHBondContact O-CB 3.39Å; E951-T954 PolarHBondContact O-N 2.83Å; D952-T954 PolarHBondContact O-N 3.13Å; T954-M956 VanDerWaalsContact C-N 3.29Å; T954-M956 PolarHBondContact O-N 2.84Å; T954-G957 PolarHBondContact O-N 2.94Å; T954-G957 VanDerWaalsContact O-N 3.13Å; T954-Q964 PolarHBondContact OG1-NE2 3.37Å
955	Q	84.3	Confident	74.3	Confident	161 Å²	161	59.1 Å²	59.1	75%	0.752	33%	0.329	S	S	*	.	H	α-helix	trans	-66.8	-29.4	176.6	-68.9	179.8	21.1	0	0	112.8	E951 D952 G957	E951-Q955 WeakPolarHBondContact O-CG 3.33Å; E951-Q955 PolarHBondContact O-N 2.86Å; D952-Q955 PolarHBondContact O-N 2.81Å; D952-Q955 VanDerWaalsContact O-N 3.11Å; Q955-G957 PolarHBondContact O-N 2.96Å
956	M	86.3	Confident	73.1	Confident	26 Å²	26	61.8 Å²	61.8	13%	0.128	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-0.8	173.8	-66	167.9	60.1	0	0	113.8	H933 F934 A937 L939 L948 D952 L953 T954 I958	H933-M956 PolarHBondContact ND1-O 3.22Å; F934-M956 HydrophobicContact CB-CE 4.25Å; F934-M956 HydrophobicContact CD1-CE 3.99Å; F934-M956 HydrophobicContact CD2-CE 3.53Å; F934-M956 HydrophobicContact CE1-CE 4.21Å; F934-M956 HydrophobicContact CE2-CE 3.79Å; F934-M956 HydrophobicContact CG-CE 3.65Å; F934-M956 HydrophobicContact CZ-CE 4.11Å; A937-M956 HydrophobicContact CB-CE 3.91Å; A937-M956 HydrophobicContact CB-CG 3.9Å; A937-M956 HydrophobicContact CB-SD 4.13Å; L939-M956 HydrophobicContact CD1-CE 3.6Å; L939-M956 HydrophobicContact CD1-SD 3.64Å; L948-M956 HydrophobicContact CD2-SD 4.39Å; D952-M956 VanDerWaalsContact O-CG 3.23Å; D952-M956 WeakPolarHBondContact O-CG 3.25Å; D952-M956 PolarHBondContact O-N 3.08Å; L953-M956 HydrophobicContact CD2-SD 4.23Å; L953-M956 PolarHBondContact O-N 3.28Å; T954-M956 VanDerWaalsContact C-N 3.29Å; T954-M956 PolarHBondContact O-N 2.84Å; M956-I958 HydrophobicContact CB-CG1 4.41Å; M956-I958 HydrophobicContact CE-CD1 4.49Å
957	G	74.9	Confident	72.8	Confident	41 Å²	41	59.8 Å²	59.8	42%	0.423	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	11.9	-179.2	0	0	0	0	0	114.3	L953 T954 Q955 T959	L953-G957 PolarHBondContact O-N 2.92Å; T954-G957 PolarHBondContact O-N 2.94Å; T954-G957 VanDerWaalsContact O-N 3.13Å; Q955-G957 PolarHBondContact O-N 2.96Å; G957-T959 PolarHBondContact O-N 2.78Å
958	I	80.9	Confident	72.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.309	C	S	.	.			trans	-92.4	85.9	175.5	-48.9	-177.1	0	0	0	107.5	Y930 F934 L953 M956 H963 Q964 I967	Y930-I958 HydrophobicContact CD1-CB 4.39Å; Y930-I958 HydrophobicContact CD1-CD1 3.74Å; Y930-I958 HydrophobicContact CD1-CG1 3.53Å; Y930-I958 HydrophobicContact CD1-CG2 4.31Å; Y930-I958 HydrophobicContact CD2-CD1 4.35Å; Y930-I958 HydrophobicContact CD2-CG2 4.42Å; Y930-I958 HydrophobicContact CE1-CB 4.16Å; Y930-I958 HydrophobicContact CE1-CD1 4.36Å; Y930-I958 HydrophobicContact CE1-CG1 3.77Å; Y930-I958 HydrophobicContact CE1-CG2 3.91Å; Y930-I958 HydrophobicContact CE2-CG2 4.03Å; Y930-I958 HydrophobicContact CG-CD1 3.73Å; Y930-I958 HydrophobicContact CG-CG1 4.05Å; F934-I958 HydrophobicContact CD2-CD1 4.18Å; F934-I958 HydrophobicContact CE2-CD1 3.51Å; F934-I958 HydrophobicContact CZ-CD1 4.41Å; L953-I958 HydrophobicContact CB-CB 4.31Å; L953-I958 HydrophobicContact CD2-CD1 4.13Å; L953-I958 WeakPolarHBondContact O-CA 3.27Å; L953-I958 VanDerWaalsContact O-CB 3.26Å; L953-I958 WeakPolarHBondContact O-CB 3.32Å; L953-I958 PolarHBondContact O-N 2.94Å; M956-I958 HydrophobicContact CB-CG1 4.41Å; M956-I958 HydrophobicContact CE-CD1 4.49Å; I958-H963 HydrophobicContact CG2-CB 4.19Å; I958-Q964 HydrophobicContact CG2-CG 4.2Å; I958-Q964 WeakPolarHBondContact O-CG 3.33Å; I958-Q964 PolarHBondContact O-NE2 2.93Å; I958-I967 HydrophobicContact CD1-CD1 4.01Å; I958-I967 HydrophobicContact CG2-CD1 4.35Å
959	T	69.5	Low	71.1	Confident	95 Å²	95	55.8 Å²	55.8	58%	0.583	31%	0.314	S	S	*	.			trans	-96.6	-6.6	-172.2	55.2	0	0	0	0	114.4	G957 P961	G957-T959 PolarHBondContact O-N 2.78Å; T959-P961 WeakPolarHBondContact O-CD 3.28Å
960	L	54.7	Low	70.2	Confident	82 Å²	82	52.9 Å²	52.9	43%	0.429	30%	0.296	S	S	.	.			trans	-78.2	117.2	-179.8	-70.5	173.1	0	0	0	110.4	G962 H963 Q964	L960-G962 VanDerWaalsContact C-N 3.29Å; L960-G962 PolarHBondContact O-N 2.85Å; L960-H963 HydrophobicContact CB-CB 4.07Å; L960-H963 VanDerWaalsContact CD1-CE1 3.47Å; L960-H963 WeakPolarHBondContact CD1-CE1 3.46Å; L960-H963 WeakPolarHBondContact CD1-ND1 3.16Å; L960-H963 PolarHBondContact O-N 3.38Å; L960-H963 VanDerWaalsContact O-N 3.12Å; L960-Q964 WeakPolarHBondContact O-CG 3.17Å; L960-Q964 PolarHBondContact O-N 2.74Å
961	P	52.5	Low	70.1	Confident	98 Å²	98	51 Å²	51	64%	0.636	28%	0.28	S	S	*	.	H	α-helix	trans	-59.7	-34.7	-173.6	-26.5	35.1	0	0	0	114.3	T959 K965	T959-P961 WeakPolarHBondContact O-CD 3.28Å; P961-K965 VanDerWaalsContact O-CB 3.31Å; P961-K965 WeakPolarHBondContact O-CB 3.29Å; P961-K965 PolarHBondContact O-N 2.9Å
962	G	47	Very low	69.1	Low	20 Å²	20	48.6 Å²	48.6	21%	0.206	27%	0.269	C	S	.	.	H	α-helix	trans	-68.6	-39.3	177.4	0	0	0	0	0	113.1	D850 L960 K965 R966	D850-G962 WeakPolarHBondContact OD1-CA 3.43Å; L960-G962 VanDerWaalsContact C-N 3.29Å; L960-G962 PolarHBondContact O-N 2.85Å; G962-K965 PolarHBondContact O-N 3.47Å; G962-R966 WeakPolarHBondContact O-CB 3.25Å; G962-R966 PolarHBondContact O-N 3.35Å
963	H	64.4	Low	67.6	Low	11 Å²	11	48.1 Å²	48.1	5%	0.051	28%	0.276	C	S	.	.	H	α-helix	trans	-68.4	-43.8	175.9	-65.2	-175.9	0	0	0	111.5	D850 M927 Y930 I958 L960 K965 R966 I967	D850-H963 IonicContact OD2-CD2 2.7Å; D850-H963 PolarHBondContact OD2-CD2 2.78Å; D850-H963 IonicContact OD2-NE2 2.61Å; D850-H963 PolarHBondContact OD2-NE2 3.35Å; M927-H963 HydrophobicContact SD-CB 3.79Å; Y930-H963 HydrophobicContact CE2-CB 3.88Å; Y930-H963 AromaticContact CE2-CG 3.86Å; Y930-H963 AromaticContact CE2-ND1 3.26Å; Y930-H963 VanDerWaalsContact CE2-ND1 3.26Å; Y930-H963 WeakPolarHBondContact CE2-ND1 3.38Å; Y930-H963 AromaticContact CZ-ND1 3.41Å; Y930-H963 PolarHBondContact OH-ND1 3.02Å; I958-H963 HydrophobicContact CG2-CB 4.19Å; L960-H963 HydrophobicContact CB-CB 4.07Å; L960-H963 VanDerWaalsContact CD1-CE1 3.47Å; L960-H963 WeakPolarHBondContact CD1-CE1 3.46Å; L960-H963 WeakPolarHBondContact CD1-ND1 3.16Å; L960-H963 PolarHBondContact O-N 3.38Å; L960-H963 VanDerWaalsContact O-N 3.12Å; H963-K965 VanDerWaalsContact C-N 3.34Å; H963-K965 PolarHBondContact O-N 3.35Å; H963-R966 PolarHBondContact O-N 2.93Å; H963-I967 WeakPolarHBondContact O-CB 3.46Å; H963-I967 VanDerWaalsContact O-CG1 3.28Å; H963-I967 WeakPolarHBondContact O-CG1 3.26Å; H963-I967 PolarHBondContact O-N 3.07Å
964	Q	66.9	Low	66.4	Low	28 Å²	28	50.6 Å²	50.6	13%	0.131	29%	0.287	C	S	.	.	H	α-helix	trans	-56.6	-49	172.9	-68.3	-178.7	-8.9	0	0	111.1	L953 T954 I958 L960 R966 I967 L968	L953-Q964 HydrophobicContact CB-CG 4.16Å; L953-Q964 HydrophobicContact CD1-CB 4.22Å; L953-Q964 HydrophobicContact CD1-CG 4.41Å; T954-Q964 PolarHBondContact OG1-NE2 3.37Å; I958-Q964 HydrophobicContact CG2-CG 4.2Å; I958-Q964 WeakPolarHBondContact O-CG 3.33Å; I958-Q964 PolarHBondContact O-NE2 2.93Å; L960-Q964 WeakPolarHBondContact O-CG 3.17Å; L960-Q964 PolarHBondContact O-N 2.74Å; Q964-R966 PolarHBondContact O-N 2.87Å; Q964-I967 PolarHBondContact O-N 2.75Å; Q964-L968 WeakPolarHBondContact O-CB 3.49Å; Q964-L968 VanDerWaalsContact O-CG 3.22Å; Q964-L968 WeakPolarHBondContact O-CG 3.33Å; Q964-L968 PolarHBondContact O-N 2.66Å
965	K	58.5	Low	65.2	Low	98 Å²	98	51.6 Å²	51.6	43%	0.426	29%	0.286	S	S	.	.	H	α-helix	trans	-61	-41.3	179.1	-171.1	177.2	-178.5	-178.4	0	112.1	P961 G962 H963 C969	P961-K965 VanDerWaalsContact O-CB 3.31Å; P961-K965 WeakPolarHBondContact O-CB 3.29Å; P961-K965 PolarHBondContact O-N 2.9Å; G962-K965 PolarHBondContact O-N 3.47Å; H963-K965 VanDerWaalsContact C-N 3.34Å; H963-K965 PolarHBondContact O-N 3.35Å; K965-C969 WeakPolarHBondContact O-CB 3.39Å; K965-C969 PolarHBondContact O-N 2.78Å; K965-C969 PolarHBondContact O-SG 3.21Å
966	R	55.8	Low	63.2	Low	57 Å²	57	50.8 Å²	50.8	22%	0.215	29%	0.287	C	S	.	.	H	α-helix	trans	-64.8	-45	179.1	-170.5	175.1	-169.4	176.7	-2.2	112.5	I925 G962 H963 Q964 S970	I925-R966 WeakPolarHBondContact O-CD 3.36Å; I925-R966 PolarHBondContact O-NE 3.2Å; I925-R966 PolarHBondContact O-NH1 2.78Å; I925-R966 PolarHBondContact O-NH2 3.02Å; G962-R966 WeakPolarHBondContact O-CB 3.25Å; G962-R966 PolarHBondContact O-N 3.35Å; H963-R966 PolarHBondContact O-N 2.93Å; Q964-R966 PolarHBondContact O-N 2.87Å; R966-S970 WeakPolarHBondContact O-CB 3.39Å; R966-S970 PolarHBondContact O-N 3.11Å
967	I	71	Confident	62	Low	0 Å²	0	52 Å²	52	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.1	-50.7	176.9	-69	172	0	0	0	109.6	W921 I925 M927 Y930 F934 L953 I958 H963 Q964 S970 I971	W921-I967 HydrophobicContact CH2-CG2 3.76Å; W921-I967 HydrophobicContact CZ2-CG2 4.32Å; I925-I967 HydrophobicContact CD1-CG1 4.02Å; M927-I967 HydrophobicContact CB-CG1 4.43Å; M927-I967 HydrophobicContact CG-CD1 4.22Å; M927-I967 HydrophobicContact CG-CG1 3.83Å; M927-I967 HydrophobicContact SD-CD1 4.32Å; M927-I967 HydrophobicContact SD-CG1 4.28Å; Y930-I967 HydrophobicContact CD2-CD1 4.23Å; F934-I967 HydrophobicContact CE2-CD1 4.13Å; F934-I967 HydrophobicContact CZ-CD1 4.28Å; F934-I967 HydrophobicContact CZ-CG2 3.87Å; L953-I967 HydrophobicContact CD1-CB 4Å; L953-I967 HydrophobicContact CD1-CG2 3.72Å; L953-I967 HydrophobicContact CD2-CG2 3.89Å; L953-I967 HydrophobicContact CG-CG2 4.48Å; I958-I967 HydrophobicContact CD1-CD1 4.01Å; I958-I967 HydrophobicContact CG2-CD1 4.35Å; H963-I967 WeakPolarHBondContact O-CB 3.46Å; H963-I967 VanDerWaalsContact O-CG1 3.28Å; H963-I967 WeakPolarHBondContact O-CG1 3.26Å; H963-I967 PolarHBondContact O-N 3.07Å; Q964-I967 PolarHBondContact O-N 2.75Å; I967-S970 PolarHBondContact O-N 2.81Å; I967-I971 HydrophobicContact CG2-CD1 3.85Å; I967-I971 WeakPolarHBondContact O-CD1 3.49Å; I967-I971 VanDerWaalsContact O-CG1 3.24Å; I967-I971 WeakPolarHBondContact O-CG1 3.28Å; I967-I971 PolarHBondContact O-N 2.77Å
968	L	73	Confident	61.4	Low	43 Å²	43	52.6 Å²	52.6	23%	0.225	29%	0.288	C	S	.	.	H	α-helix	trans	-66.1	-39.2	-179.8	-66.3	168.8	0	0	0	113.3	L948 A950 L953 Q964 I971 Q972	L948-L968 WeakPolarHBondContact O-CD2 3.4Å; A950-L968 HydrophobicContact CB-CD1 3.69Å; L953-L968 HydrophobicContact CD1-CD1 4.18Å; L953-L968 HydrophobicContact CD1-CD2 3.94Å; L953-L968 HydrophobicContact CD1-CG 3.7Å; Q964-L968 WeakPolarHBondContact O-CB 3.49Å; Q964-L968 VanDerWaalsContact O-CG 3.22Å; Q964-L968 WeakPolarHBondContact O-CG 3.33Å; Q964-L968 PolarHBondContact O-N 2.66Å; L968-I971 WeakPolarHBondContact O-CB 3.45Å; L968-I971 PolarHBondContact O-N 3.11Å; L968-Q972 WeakPolarHBondContact O-CB 3Å; L968-Q972 PolarHBondContact O-N 3.01Å
969	C	57.9	Low	60.3	Low	32 Å²	32	55.5 Å²	55.5	22%	0.216	30%	0.304	C	S	.	.	H	α-helix	trans	-67.1	-36.7	175.3	-76.3	0	0	0	0	111.9	P898 K965 I971 G973	P898-C969 HydrophobicContact CB-CB 4.33Å; P898-C969 HydrophobicContact CG-CB 3.82Å; K965-C969 WeakPolarHBondContact O-CB 3.39Å; K965-C969 PolarHBondContact O-N 2.78Å; K965-C969 PolarHBondContact O-SG 3.21Å; C969-I971 VanDerWaalsContact C-N 3.34Å; C969-G973 PolarHBondContact O-N 2.6Å
970	S	64.1	Low	59.7	Low	5 Å²	5	53.2 Å²	53.2	4%	0.035	29%	0.287	C	S	.	.	H	α-helix	trans	-66.1	-38.8	172.7	-175.1	0	0	0	0	111.5	W921 R966 I967 G973 F974	W921-S970 PolarHBondContact NE1-OG 2.8Å; R966-S970 WeakPolarHBondContact O-CB 3.39Å; R966-S970 PolarHBondContact O-N 3.11Å; I967-S970 PolarHBondContact O-N 2.81Å; S970-G973 PolarHBondContact O-N 2.97Å; S970-F974 VanDerWaalsContact O-CD2 3.26Å; S970-F974 WeakPolarHBondContact O-CD2 3.46Å; S970-F974 VanDerWaalsContact O-CE2 3.32Å; S970-F974 WeakPolarHBondContact O-CE2 3.18Å; S970-F974 PolarHBondContact O-N 3.01Å; S970-F974 WeakPolarHBondContact OG-CZ 3.31Å
971	I	73.3	Confident	60.1	Low	5 Å²	5	51.4 Å²	51.4	3%	0.026	28%	0.278	C	S	.	.	H	α-helix	trans	-63.5	-46	175.5	-71.6	163.9	0	0	0	111	W921 V945 L946 L948 I967 L968 C969 G973 F974 K975	W921-I971 HydrophobicContact CH2-CD1 4.01Å; W921-I971 HydrophobicContact CH2-CG1 3.91Å; W921-I971 HydrophobicContact CZ2-CD1 4.37Å; W921-I971 HydrophobicContact CZ2-CG1 3.83Å; V945-I971 HydrophobicContact CG1-CD1 3.84Å; V945-I971 HydrophobicContact CG1-CG1 3.82Å; V945-I971 VanDerWaalsContact O-CD1 3.31Å; V945-I971 WeakPolarHBondContact O-CD1 3.36Å; L946-I971 WeakPolarHBondContact O-CG2 3.49Å; L948-I971 HydrophobicContact CB-CD1 4.03Å; L948-I971 HydrophobicContact CD1-CD1 4.18Å; I967-I971 HydrophobicContact CG2-CD1 3.85Å; I967-I971 WeakPolarHBondContact O-CD1 3.49Å; I967-I971 VanDerWaalsContact O-CG1 3.24Å; I967-I971 WeakPolarHBondContact O-CG1 3.28Å; I967-I971 PolarHBondContact O-N 2.77Å; L968-I971 WeakPolarHBondContact O-CB 3.45Å; L968-I971 PolarHBondContact O-N 3.11Å; C969-I971 VanDerWaalsContact C-N 3.34Å; I971-G973 PolarHBondContact O-N 3.3Å; I971-F974 WeakPolarHBondContact O-CB 3.22Å; I971-F974 PolarHBondContact O-N 2.92Å; I971-K975 PolarHBondContact O-N 3.18Å
972	Q	62.3	Low	60.6	Low	97 Å²	97	48.3 Å²	48.3	45%	0.453	26%	0.255	S	S	.	.	H	α-helix	trans	-59	-37.7	175.5	-171.3	63.3	42	0	0	111.4	L968 F974 K975 D976	L968-Q972 WeakPolarHBondContact O-CB 3Å; L968-Q972 PolarHBondContact O-N 3.01Å; Q972-F974 PolarHBondContact O-N 3.23Å; Q972-K975 PolarHBondContact O-N 3.39Å; Q972-D976 PolarHBondContact NE2-OD1 2.88Å; Q972-D976 PolarHBondContact O-N 2.95Å; Q972-D976 VanDerWaalsContact O-N 3.12Å
973	G	55.5	Low	61.5	Low	44 Å²	44	50.3 Å²	50.3	45%	0.454	26%	0.258	S	S	.	.	H	α-helix	trans	-65.6	-13.1	174	0	0	0	0	0	115.3	C969 S970 I971	C969-G973 PolarHBondContact O-N 2.6Å; S970-G973 PolarHBondContact O-N 2.97Å; I971-G973 PolarHBondContact O-N 3.3Å
974	F	60.6	Low	61.3	Low	52 Å²	52	53.3 Å²	53.3	23%	0.228	27%	0.274	C	S	.	.	H	α-helix	trans	-94.1	-17.4	169.2	-54.8	-42.9	0	0	0	113.1	P914 Y915 W921 M942 L946 S970 I971 Q972	P914-F974 HydrophobicContact CG-CD1 3.61Å; P914-F974 HydrophobicContact CG-CE1 3.14Å; P914-F974 HydrophobicContact CG-CZ 4.01Å; Y915-F974 HydrophobicContact CD2-CE1 4.34Å; Y915-F974 AromaticContact CD2-CZ 3.94Å; Y915-F974 HydrophobicContact CD2-CZ 3.94Å; Y915-F974 AromaticContact CE2-CE1 3.99Å; Y915-F974 HydrophobicContact CE2-CE1 3.99Å; Y915-F974 AromaticContact CE2-CZ 3.71Å; Y915-F974 HydrophobicContact CE2-CZ 3.71Å; W921-F974 AromaticContact CD1-CE2 3.8Å; W921-F974 AromaticContact CD1-CZ 3.56Å; W921-F974 HydrophobicContact CD2-CE2 4.5Å; W921-F974 AromaticContact CE2-CE2 3.83Å; W921-F974 HydrophobicContact CG-CE2 4.44Å; W921-F974 HydrophobicContact CG-CZ 4.46Å; W921-F974 HydrophobicContact CZ2-CE2 4.32Å; W921-F974 AromaticContact NE1-CE2 3.37Å; W921-F974 AromaticContact NE1-CZ 3.45Å; M942-F974 HydrophobicContact CE-CD2 3.43Å; M942-F974 VanDerWaalsContact CE-CD2 3.43Å; M942-F974 HydrophobicContact CE-CE2 3.12Å; M942-F974 HydrophobicContact CE-CZ 4.05Å; L946-F974 HydrophobicContact CD2-CB 3.52Å; L946-F974 HydrophobicContact CD2-CD2 4.03Å; L946-F974 HydrophobicContact CD2-CG 4.23Å; S970-F974 VanDerWaalsContact O-CD2 3.26Å; S970-F974 WeakPolarHBondContact O-CD2 3.46Å; S970-F974 VanDerWaalsContact O-CE2 3.32Å; S970-F974 WeakPolarHBondContact O-CE2 3.18Å; S970-F974 PolarHBondContact O-N 3.01Å; S970-F974 WeakPolarHBondContact OG-CZ 3.31Å; I971-F974 WeakPolarHBondContact O-CB 3.22Å; I971-F974 PolarHBondContact O-N 2.92Å; Q972-F974 PolarHBondContact O-N 3.23Å
975	K	56.4	Low	60.8	Low	89 Å²	89	55.4 Å²	55.4	39%	0.387	29%	0.286	S	S	.	.	H	α-helix	trans	-86.5	-30.5	178.4	-71.4	-169.2	171.5	177.9	0	113	L946 E947 I971 Q972	L946-K975 WeakPolarHBondContact O-CE 2.88Å; L946-K975 PolarHBondContact O-NZ 2.72Å; E947-K975 VanDerWaalsContact CD-NZ 3.27Å; E947-K975 WeakPolarHBondContact OE1-CE 3.34Å; E947-K975 IonicContact OE1-NZ 3.14Å; E947-K975 PolarHBondContact OE1-NZ 2.82Å; E947-K975 VanDerWaalsContact OE1-NZ 3.14Å; E947-K975 IonicContact OE2-NZ 2.93Å; E947-K975 PolarHBondContact OE2-NZ 3.45Å; I971-K975 PolarHBondContact O-N 3.18Å; Q972-K975 PolarHBondContact O-N 3.39Å
976	D	41.7	Very low	61.1	Low	143 Å²	143	51.5 Å²	51.5	77%	0.765	27%	0.273	S	S	*	.			trans	-86.1	0	174.8	-62.2	-8.9	0	0	0	111.4	Q972	Q972-D976 PolarHBondContact NE2-OD1 2.88Å; Q972-D976 PolarHBondContact O-N 2.95Å; Q972-D976 VanDerWaalsContact O-N 3.12Å

Retrieved 976 of 976 residues in 2242 ms (Link to these results)

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