A0A3Q0KPI4_SCHMA Loading...

Eukaryotic elongation factor 2 kinase

AlphaFold DB , UniProt , Accession A0A3Q0KPI4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 845 aa.

						>A0A3Q0KPI4_SCHMA|A0A3Q0KPI4
MEGIPSESTPVDLFPQALPKIPSNASCLRYPRKLSVREIKIQRSEDGNKYAAITRHSRAKALWKTALSLISSCGDPWEKFHLQELPEETAKRYRYNAIRGKWIEDIVHVKIENSPFNRGAMRECFRAKKLSNFSHCSDWSHASNHVAKRYIEKVENHVYFDDVRLQMDAKLWGEEYSRQPSAPKKVDISQTCVLEFINRPEKPLYHLEHFIEGTYRKYNSNSGFVDDLSRNTPQAFSHFTFERSGHRLIVVDIQGVGNLWTDPQIHTFNGKSYGDGNLGIRGMALFFYTHRCNPLCLALSLSPFDLPISEKLSTPLSQLSMKAEDNQTENIDGISDNNNVELSGTVAIPASRRDRYGIRRLVSENIDSSYDLRENANKHNNDTSSDFVDPSDFVESHSVPSPKLPFLPSRSPVSCRKNILQKTDQINDHNSNVVNNGKHSTKYNTNTTTTGNNINNNDARTNDLIFGPISLHNNSNDSGISFDGPSFGSVFKAQKSLISDPGCDPVCSDLDQSNSHLNSTENSQQLSKEAELIEFFRSHQAGHRSSSIAALHGADTVILGLIHHELARLHASGRLALLHQTGYYQFKCNEVKNHQPSIDIEQELNGNQLNELNLPQNVNWESVLFHLEQSAKLGCLDAIQCLAQYYLNLMVDGPLSECPIKPDPLESRAHGFALISAAASAGDRMAMVYLAEANYHGEYYSPDTSNDINNNNNNERKQEPDWLAAAHWYEMAAKVVTYDDATEDDEMNQGNPSFVKRSRSGFHALSEWPIYRLQGRLGEMYAKGGHGLVRDRAKAYELFESAAEGAIEAHEGRIAMEYYEQAGLLEEYAAIEFDGEIGEKTEEDK
					

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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	37.2	Very low	35.6	Very low	232 Å²	232	144.2 Å²	144.2	100%	1.143	85%	0.846	S	S	*	*				0	90.1	0	-70.3	-172.8	-175.6	0	0	105.7
2	E	35.3	Very low	35.2	Very low	198 Å²	198	144.7 Å²	144.7	93%	0.925	84%	0.842	S	S	*	*				105.6	128.2	86.9	-93.6	-172.6	178.7	0	0	108
3	G	36.9	Very low	34.8	Very low	75 Å²	75	144.2 Å²	144.2	77%	0.773	83%	0.833	S	S	*	*			trans	120.7	60.9	165.7	0	0	0	0	0	115.9
4	I	39.4	Very low	34.4	Very low	166 Å²	166	147 Å²	147	85%	0.851	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-96.4	125.6	153.3	-60.8	178.2	0	0	0	106.4	S6	I4-S6 PolarHBondContact O-N 3.37Å
5	P	38	Very low	34.3	Very low	120 Å²	120	145.5 Å²	145.5	78%	0.779	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-71.9	123.9	-167.4	28.8	-33.9	0	0	0	111.1
6	S	35.5	Very low	34.2	Very low	113 Å²	113	148.6 Å²	148.6	79%	0.79	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-69.1	129.6	174.7	51.7	0	0	0	0	111.5	I4 S8	I4-S6 PolarHBondContact O-N 3.37Å; S6-S8 PolarHBondContact O-N 3.34Å
7	E	34.9	Very low	34.2	Very low	191 Å²	191	145.5 Å²	145.5	89%	0.893	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-55.3	125.9	169.8	-71.5	175.4	143.4	0	0	111.3	T9	E7-T9 PolarHBondContact O-N 2.68Å
8	S	32.6	Very low	33.8	Very low	116 Å²	116	147.1 Å²	147.1	81%	0.811	84%	0.836	S	S	*	*			trans	-80.3	105.9	174.4	44.7	0	0	0	0	110.2	S6	S6-S8 PolarHBondContact O-N 3.34Å
9	T	35.3	Very low	33.7	Very low	128 Å²	128	145 Å²	145	79%	0.785	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-65.8	128.1	168.6	44.3	0	0	0	0	110.8	E7	E7-T9 PolarHBondContact O-N 2.68Å
10	P	34	Very low	33.6	Very low	126 Å²	126	148.5 Å²	148.5	82%	0.818	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-75.3	138.4	179.5	29.5	-31.7	0	0	0	111.4	D12	P10-D12 PolarHBondContact O-N 2.86Å
11	V	32.4	Very low	33.5	Very low	121 Å²	121	148.7 Å²	148.7	73%	0.733	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-60.8	125.4	-175.9	175.2	0	0	0	0	111.7	L13	V11-L13 HydrophobicContact CG1-CD1 4.45Å; V11-L13 HydrophobicContact CG1-CG 4.22Å; V11-L13 PolarHBondContact O-N 3.3Å; V11-L13 VanDerWaalsContact O-N 3.13Å
12	D	31.4	Very low	33.3	Very low	150 Å²	150	143.2 Å²	143.2	80%	0.802	81%	0.813	S	S	*	*			trans	-71.4	95.9	177	-155	-0.2	0	0	0	110.2	P10	P10-D12 PolarHBondContact O-N 2.86Å
13	L	30.3	Very low	33	Very low	138 Å²	138	138.9 Å²	138.9	72%	0.723	81%	0.805	S	S	*	*			trans	-103.3	55.3	-178.2	-93.3	158.8	0	0	0	110.8	V11	V11-L13 HydrophobicContact CG1-CD1 4.45Å; V11-L13 HydrophobicContact CG1-CG 4.22Å; V11-L13 PolarHBondContact O-N 3.3Å; V11-L13 VanDerWaalsContact O-N 3.13Å
14	F	28	Very low	32.8	Very low	184 Å²	184	143.2 Å²	143.2	81%	0.807	81%	0.811	S	S	*	*			trans	-124.2	97.9	168.8	-79.8	-76.4	0	0	0	111.6	Q16	F14-Q16 PolarHBondContact O-N 3.01Å
15	P	33.5	Very low	32.5	Very low	124 Å²	124	139.7 Å²	139.7	81%	0.805	81%	0.807	S	S	*	*			trans	-68.2	118.5	173.4	25.7	-30	0	0	0	110.3	A17	P15-A17 PolarHBondContact O-N 3.01Å
16	Q	32.5	Very low	32.2	Very low	196 Å²	196	140.2 Å²	140.2	92%	0.916	81%	0.813	S	S	*	*			trans	-66.2	113.8	163.3	-66.1	-179.2	2.8	0	0	109.3	F14	F14-Q16 PolarHBondContact O-N 3.01Å
17	A	33.7	Very low	32.1	Very low	95 Å²	95	139.7 Å²	139.7	79%	0.785	81%	0.808	S	S	*	*			trans	167.5	93.8	142.4	0	0	0	0	0	110	P15	P15-A17 PolarHBondContact O-N 3.01Å
18	L	28.4	Very low	32	Very low	175 Å²	175	137.4 Å²	137.4	92%	0.916	80%	0.802	S	S	*	*			trans	-77.9	128.1	166.5	-83.5	161.5	0	0	0	109.5
19	P	31.8	Very low	32.2	Very low	107 Å²	107	144.1 Å²	144.1	70%	0.695	81%	0.809	S	S	*	*			trans	-69.5	135.4	178.3	-7.1	19.7	0	0	0	111.6	I21	P19-I21 PolarHBondContact O-N 3.23Å
20	K	30.4	Very low	32.3	Very low	214 Å²	214	147.4 Å²	147.4	93%	0.93	81%	0.808	S	S	*	*			trans	-65.8	108.9	170.3	-72.3	177.4	176.9	176.5	0	109.7
21	I	32.9	Very low	32.8	Very low	153 Å²	153	147 Å²	147	79%	0.785	81%	0.805	S	S	*	*			trans	-92.4	128.7	172	-61.1	175.8	0	0	0	108.7	P19	P19-I21 PolarHBondContact O-N 3.23Å
22	P	31.8	Very low	34.4	Very low	117 Å²	117	151.6 Å²	151.6	76%	0.76	81%	0.81	S	S	*	*			trans	-70.9	139.4	-170.9	26.6	-33	0	0	0	113.2	N24	P22-N24 PolarHBondContact O-N 3.05Å
23	S	29.7	Very low	35.7	Very low	108 Å²	108	153.9 Å²	153.9	76%	0.755	81%	0.812	S	S	*	*	S	Bend	trans	-66	106.9	171	51.9	0	0	0	0	110.6
24	N	32	Very low	37.3	Very low	165 Å²	165	151.2 Å²	151.2	88%	0.882	80%	0.798	S	S	*	*			trans	165.4	78.6	144.9	-85.1	-15.1	0	0	0	110.1	P22	P22-N24 PolarHBondContact O-N 3.05Å
25	A	33.5	Very low	39.1	Very low	93 Å²	93	145 Å²	145	77%	0.769	78%	0.778	S	S	*	*			trans	-141.8	100.1	159.8	0	0	0	0	0	108.2	C27	A25-C27 VanDerWaalsContact C-N 3.31Å; A25-C27 PolarHBondContact O-N 3.1Å
26	S	31.6	Very low	40.3	Very low	131 Å²	131	144.6 Å²	144.6	92%	0.916	77%	0.773	S	S	*	*			trans	-62.8	87.4	170.9	54.7	0	0	0	0	109.6
27	C	32.6	Very low	41.5	Very low	102 Å²	102	144.9 Å²	144.9	69%	0.689	77%	0.766	S	S	*	*			trans	-111	107.6	176	-150.6	0	0	0	0	109.8	A25	A25-C27 VanDerWaalsContact C-N 3.31Å; A25-C27 PolarHBondContact O-N 3.1Å
28	L	34	Very low	43.3	Very low	143 Å²	143	143.9 Å²	143.9	75%	0.749	75%	0.745	S	S	*	*			trans	9.9	117.7	152.9	-68.9	150.8	0	0	0	115.8	Y30	L28-Y30 WeakPolarHBondContact O-CD2 3.39Å; L28-Y30 PolarHBondContact O-N 2.89Å
29	R	37.1	Very low	44.8	Very low	257 Å²	257	138.5 Å²	138.5	97%	0.97	72%	0.716	S	S	*	*			trans	-55.8	90.8	175.2	-67.3	-175.5	-172.4	180	2.7	110.7
30	Y	37.1	Very low	45.8	Very low	197 Å²	197	140.8 Å²	140.8	77%	0.773	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-70.3	130	164.8	-83.7	-86.3	0	0	0	108.4	L28 R32	L28-Y30 WeakPolarHBondContact O-CD2 3.39Å; L28-Y30 PolarHBondContact O-N 2.89Å; Y30-R32 PolarHBondContact O-N 3.06Å
31	P	45	Very low	47	Very low	116 Å²	116	134.5 Å²	134.5	75%	0.753	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-58.9	126	178.9	23.1	-31.2	0	0	0	109.2	K33	P31-K33 PolarHBondContact O-N 3.33Å
32	R	65.8	Low	48.1	Very low	218 Å²	218	131.8 Å²	131.8	82%	0.823	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-53.9	126.4	177	179.8	177.9	176.2	146.1	-2.1	109	Y30 L34	Y30-R32 PolarHBondContact O-N 3.06Å; R32-L34 PolarHBondContact O-N 3.47Å
33	K	57.7	Low	49.1	Very low	198 Å²	198	135.2 Å²	135.2	86%	0.861	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-65.7	120.2	169.5	-75.9	-176.9	177.3	178.6	0	108.5	P31	P31-K33 PolarHBondContact O-N 3.33Å
34	L	64	Low	50.2	Low	82 Å²	82	133.4 Å²	133.4	43%	0.429	66%	0.66	S	S	.	*	P	Polyproline II helix	trans	-61.5	140.8	172.1	-67.7	166.3	0	0	0	109.6	R32 E38 I39	R32-L34 PolarHBondContact O-N 3.47Å; L34-E38 HydrophobicContact CB-CB 4.16Å; L34-E38 HydrophobicContact CD2-CB 3.99Å; L34-E38 HydrophobicContact CD2-CG 4.46Å; L34-I39 HydrophobicContact CB-CD1 4.35Å; L34-I39 HydrophobicContact CB-CG1 3.85Å
35	S	66.1	Low	51.1	Low	54 Å²	54	130.9 Å²	130.9	38%	0.378	64%	0.643	S	S	.	*	P	Polyproline II helix	trans	-65.2	157.8	170.4	67.8	0	0	0	0	110.8	R37 E38 I39	S35-R37 PolarHBondContact O-N 2.67Å; S35-R37 VanDerWaalsContact O-N 3.14Å; S35-E38 VanDerWaalsContact CB-OE2 3.3Å; S35-E38 WeakPolarHBondContact CB-OE2 3.33Å; S35-E38 PolarHBondContact N-OE2 2.71Å; S35-E38 PolarHBondContact O-N 3.32Å; S35-E38 VanDerWaalsContact O-N 3.13Å; S35-E38 WeakPolarHBondContact OG-CG 3.22Å; S35-E38 PolarHBondContact OG-N 3.46Å; S35-E38 PolarHBondContact OG-OE2 2.74Å; S35-I39 WeakPolarHBondContact O-CG1 3.49Å; S35-I39 PolarHBondContact O-N 3.02Å
36	V	59.2	Low	52	Low	116 Å²	116	130.8 Å²	130.8	70%	0.703	63%	0.63	S	S	*	*	H	α-helix	trans	-55.5	-32.3	174.9	177	0	0	0	0	111.9	K40	V36-K40 PolarHBondContact O-N 3.45Å
37	R	58	Low	52.9	Low	201 Å²	201	126.3 Å²	126.3	76%	0.758	61%	0.605	S	S	*	*	H	α-helix	trans	-69.5	-46.1	178.1	-164	176.2	-173.6	179	1.6	111.5	S35 K40 I41	S35-R37 PolarHBondContact O-N 2.67Å; S35-R37 VanDerWaalsContact O-N 3.14Å; R37-K40 PolarHBondContact O-N 2.98Å; R37-I41 HydrophobicContact CG-CD1 4.37Å; R37-I41 WeakPolarHBondContact O-CG1 3.13Å; R37-I41 PolarHBondContact O-N 3.38Å
38	E	70.6	Confident	54	Low	75 Å²	75	127.4 Å²	127.4	35%	0.35	60%	0.603	S	S	.	*	H	α-helix	trans	-62.6	-42.1	175.7	-70.9	160	138.6	0	0	111.3	L34 S35 K40 I41 Q42	L34-E38 HydrophobicContact CB-CB 4.16Å; L34-E38 HydrophobicContact CD2-CB 3.99Å; L34-E38 HydrophobicContact CD2-CG 4.46Å; S35-E38 VanDerWaalsContact CB-OE2 3.3Å; S35-E38 WeakPolarHBondContact CB-OE2 3.33Å; S35-E38 PolarHBondContact N-OE2 2.71Å; S35-E38 PolarHBondContact O-N 3.32Å; S35-E38 VanDerWaalsContact O-N 3.13Å; S35-E38 WeakPolarHBondContact OG-CG 3.22Å; S35-E38 PolarHBondContact OG-N 3.46Å; S35-E38 PolarHBondContact OG-OE2 2.74Å; E38-K40 VanDerWaalsContact C-N 3.31Å; E38-K40 PolarHBondContact O-N 3.35Å; E38-I41 PolarHBondContact O-N 3.11Å; E38-Q42 WeakPolarHBondContact O-CB 3.42Å; E38-Q42 PolarHBondContact O-N 2.72Å
39	I	59.4	Low	54.9	Low	62 Å²	62	127.1 Å²	127.1	32%	0.318	60%	0.596	S	S	.	*	H	α-helix	trans	-61.6	-38.9	175.7	-64.7	167.5	0	0	0	111.3	L34 S35 R43	L34-I39 HydrophobicContact CB-CD1 4.35Å; L34-I39 HydrophobicContact CB-CG1 3.85Å; S35-I39 WeakPolarHBondContact O-CG1 3.49Å; S35-I39 PolarHBondContact O-N 3.02Å; I39-R43 HydrophobicContact CG2-CG 4.48Å; I39-R43 WeakPolarHBondContact O-CB 3.4Å; I39-R43 VanDerWaalsContact O-CG 3.24Å; I39-R43 WeakPolarHBondContact O-CG 3.12Å; I39-R43 PolarHBondContact O-N 3.08Å
40	K	53.6	Low	55.3	Low	154 Å²	154	123.4 Å²	123.4	67%	0.67	58%	0.583	S	S	*	*	H	α-helix	trans	-66.2	-44.4	176.4	-100.4	-176.3	174.4	-178.8	0	112.3	V36 R37 E38 R43 S44	V36-K40 PolarHBondContact O-N 3.45Å; R37-K40 PolarHBondContact O-N 2.98Å; E38-K40 VanDerWaalsContact C-N 3.31Å; E38-K40 PolarHBondContact O-N 3.35Å; K40-R43 PolarHBondContact O-N 2.55Å; K40-S44 PolarHBondContact O-N 3.12Å; K40-S44 PolarHBondContact O-OG 2.84Å
41	I	55.9	Low	56.3	Low	83 Å²	83	116 Å²	116	43%	0.426	56%	0.563	S	S	.	*	H	α-helix	trans	-62.4	-49	178.1	-67.1	166.4	0	0	0	109.7	R37 E38 R43 S44 E45	R37-I41 HydrophobicContact CG-CD1 4.37Å; R37-I41 WeakPolarHBondContact O-CG1 3.13Å; R37-I41 PolarHBondContact O-N 3.38Å; E38-I41 PolarHBondContact O-N 3.11Å; I41-R43 VanDerWaalsContact C-N 3.34Å; I41-R43 PolarHBondContact O-N 3.45Å; I41-S44 PolarHBondContact O-N 2.71Å; I41-S44 PolarHBondContact O-OG 3.45Å; I41-E45 PolarHBondContact O-N 2.82Å
42	Q	56.3	Low	56.9	Low	96 Å²	96	112.8 Å²	112.8	45%	0.449	55%	0.547	S	S	.	.	H	α-helix	trans	-61.9	-40.8	179.3	-160.5	171.6	10.7	0	0	112	E38 S44 E45 D46	E38-Q42 WeakPolarHBondContact O-CB 3.42Å; E38-Q42 PolarHBondContact O-N 2.72Å; Q42-S44 VanDerWaalsContact C-N 3.32Å; Q42-S44 PolarHBondContact O-N 3.09Å; Q42-E45 PolarHBondContact O-N 3Å; Q42-D46 VanDerWaalsContact O-CB 3.31Å; Q42-D46 WeakPolarHBondContact O-CB 3.35Å; Q42-D46 PolarHBondContact O-N 3.17Å
43	R	51.2	Low	56.5	Low	189 Å²	189	107.6 Å²	107.6	71%	0.713	53%	0.534	S	S	*	.	H	α-helix	trans	-63.1	-34.4	172.7	-77.7	177.3	179.2	177	0.8	113.2	I39 K40 I41 G47	I39-R43 HydrophobicContact CG2-CG 4.48Å; I39-R43 WeakPolarHBondContact O-CB 3.4Å; I39-R43 VanDerWaalsContact O-CG 3.24Å; I39-R43 WeakPolarHBondContact O-CG 3.12Å; I39-R43 PolarHBondContact O-N 3.08Å; K40-R43 PolarHBondContact O-N 2.55Å; I41-R43 VanDerWaalsContact C-N 3.34Å; I41-R43 PolarHBondContact O-N 3.45Å; R43-G47 WeakPolarHBondContact O-CA 3.26Å; R43-G47 PolarHBondContact O-N 3.05Å
44	S	53.4	Low	57	Low	70 Å²	70	101.7 Å²	101.7	49%	0.49	52%	0.515	S	S	.	.	H	α-helix	trans	-72.3	-38.3	175.6	63.6	0	0	0	0	112.7	K40 I41 Q42 N48	K40-S44 PolarHBondContact O-N 3.12Å; K40-S44 PolarHBondContact O-OG 2.84Å; I41-S44 PolarHBondContact O-N 2.71Å; I41-S44 PolarHBondContact O-OG 3.45Å; Q42-S44 VanDerWaalsContact C-N 3.32Å; Q42-S44 PolarHBondContact O-N 3.09Å; S44-N48 WeakPolarHBondContact O-CB 3.33Å; S44-N48 PolarHBondContact O-N 3.03Å; S44-N48 VanDerWaalsContact O-N 3.08Å
45	E	51.8	Low	57.5	Low	111 Å²	111	106.3 Å²	106.3	52%	0.519	53%	0.526	S	S	.	.	H	α-helix	trans	-73.2	-46.6	178.5	-70.4	-175.9	-178	0	0	112.3	I41 Q42 G47 N48 K49	I41-E45 PolarHBondContact O-N 2.82Å; Q42-E45 PolarHBondContact O-N 3Å; E45-G47 VanDerWaalsContact C-N 3.34Å; E45-N48 PolarHBondContact O-N 3.22Å; E45-K49 PolarHBondContact O-N 3.06Å
46	D	51.1	Low	58	Low	91 Å²	91	110 Å²	110	49%	0.487	54%	0.537	S	S	.	.	H	α-helix	trans	-66.2	-39.5	177	-70.2	-25	0	0	0	110.9	Q42 N48 K49 Y50	Q42-D46 VanDerWaalsContact O-CB 3.31Å; Q42-D46 WeakPolarHBondContact O-CB 3.35Å; Q42-D46 PolarHBondContact O-N 3.17Å; D46-N48 VanDerWaalsContact C-N 3.32Å; D46-N48 PolarHBondContact O-N 3.14Å; D46-K49 PolarHBondContact O-N 3.12Å; D46-Y50 WeakPolarHBondContact O-CB 3.43Å; D46-Y50 PolarHBondContact O-N 3.08Å
47	G	51.1	Low	59.1	Low	38 Å²	38	107.7 Å²	107.7	39%	0.392	53%	0.526	S	S	.	.	H	α-helix	trans	-58.7	-42.3	173.5	0	0	0	0	0	112.2	R43 E45 A51	R43-G47 WeakPolarHBondContact O-CA 3.26Å; R43-G47 PolarHBondContact O-N 3.05Å; E45-G47 VanDerWaalsContact C-N 3.34Å; G47-A51 WeakPolarHBondContact O-CB 3.38Å; G47-A51 PolarHBondContact O-N 3Å
48	N	55	Low	60.3	Low	124 Å²	124	106.7 Å²	106.7	66%	0.663	52%	0.523	S	S	*	.	H	α-helix	trans	-68.9	-43.1	177.4	-97.6	-5.2	0	0	0	112.8	S44 E45 D46 A52	S44-N48 WeakPolarHBondContact O-CB 3.33Å; S44-N48 PolarHBondContact O-N 3.03Å; S44-N48 VanDerWaalsContact O-N 3.08Å; E45-N48 PolarHBondContact O-N 3.22Å; D46-N48 VanDerWaalsContact C-N 3.32Å; D46-N48 PolarHBondContact O-N 3.14Å; N48-A52 VanDerWaalsContact O-CB 3.26Å; N48-A52 WeakPolarHBondContact O-CB 3.33Å; N48-A52 PolarHBondContact O-N 3.03Å
49	K	52.8	Low	61	Low	138 Å²	138	105.1 Å²	105.1	60%	0.6	52%	0.522	S	S	*	.	H	α-helix	trans	-64.7	-46	177.2	-73.1	-179.7	-177.8	171.3	0	111.6	E45 D46 A52 I53	E45-K49 PolarHBondContact O-N 3.06Å; D46-K49 PolarHBondContact O-N 3.12Å; K49-A52 PolarHBondContact O-N 2.71Å; K49-I53 VanDerWaalsContact O-CG1 3.32Å; K49-I53 WeakPolarHBondContact O-CG1 3.41Å; K49-I53 PolarHBondContact O-N 2.84Å
50	Y	46.9	Very low	62.4	Low	178 Å²	178	108 Å²	108	70%	0.698	53%	0.532	S	S	*	.	H	α-helix	trans	-65.7	-41.2	179.5	-149.8	-87.2	0	0	0	111.5	D46 I53 T54	D46-Y50 WeakPolarHBondContact O-CB 3.43Å; D46-Y50 PolarHBondContact O-N 3.08Å; Y50-I53 PolarHBondContact O-N 2.92Å; Y50-T54 WeakPolarHBondContact O-CB 3.28Å; Y50-T54 PolarHBondContact O-N 2.77Å; Y50-T54 PolarHBondContact O-OG1 3.11Å
51	A	57.1	Low	64.1	Low	42 Å²	42	103 Å²	103	35%	0.347	52%	0.52	S	S	.	.	H	α-helix	trans	-62.4	-41.3	173.7	0	0	0	0	0	111.9	G47 T54 R55	G47-A51 WeakPolarHBondContact O-CB 3.38Å; G47-A51 PolarHBondContact O-N 3Å; A51-T54 PolarHBondContact O-N 3.37Å; A51-R55 VanDerWaalsContact O-CB 3.24Å; A51-R55 WeakPolarHBondContact O-CB 3.46Å; A51-R55 PolarHBondContact O-N 3.44Å
52	A	57.1	Low	65.6	Low	49 Å²	49	104 Å²	104	41%	0.405	53%	0.526	S	S	.	.	H	α-helix	trans	-65.2	-46.5	177.3	0	0	0	0	0	112.5	N48 K49 T54 R55 H56	N48-A52 VanDerWaalsContact O-CB 3.26Å; N48-A52 WeakPolarHBondContact O-CB 3.33Å; N48-A52 PolarHBondContact O-N 3.03Å; K49-A52 PolarHBondContact O-N 2.71Å; A52-T54 VanDerWaalsContact C-N 3.34Å; A52-T54 PolarHBondContact O-N 3.25Å; A52-R55 PolarHBondContact O-N 2.88Å; A52-H56 WeakPolarHBondContact O-CB 3.46Å; A52-H56 PolarHBondContact O-N 2.88Å
53	I	59	Low	67.2	Low	108 Å²	108	108.6 Å²	108.6	55%	0.554	54%	0.539	S	S	*	.	H	α-helix	trans	-61.8	-43.6	176.8	-67.1	165.8	0	0	0	110.7	K49 Y50 R55 H56 S57	K49-I53 VanDerWaalsContact O-CG1 3.32Å; K49-I53 WeakPolarHBondContact O-CG1 3.41Å; K49-I53 PolarHBondContact O-N 2.84Å; Y50-I53 PolarHBondContact O-N 2.92Å; I53-R55 VanDerWaalsContact C-N 3.34Å; I53-R55 PolarHBondContact O-N 2.66Å; I53-H56 PolarHBondContact O-N 3.15Å; I53-S57 WeakPolarHBondContact O-CB 3.49Å; I53-S57 PolarHBondContact O-N 2.77Å; I53-S57 PolarHBondContact O-OG 3.13Å
54	T	68.2	Low	69.1	Low	75 Å²	75	106.2 Å²	106.2	46%	0.46	53%	0.534	S	S	.	.	H	α-helix	trans	-63.8	-41.3	177.5	-53.7	0	0	0	0	111	Y50 A51 A52 S57 R58	Y50-T54 WeakPolarHBondContact O-CB 3.28Å; Y50-T54 PolarHBondContact O-N 2.77Å; Y50-T54 PolarHBondContact O-OG1 3.11Å; A51-T54 PolarHBondContact O-N 3.37Å; A52-T54 VanDerWaalsContact C-N 3.34Å; A52-T54 PolarHBondContact O-N 3.25Å; T54-S57 PolarHBondContact O-N 2.85Å; T54-R58 WeakPolarHBondContact O-CB 3.37Å; T54-R58 PolarHBondContact O-N 3.26Å
55	R	73.4	Confident	70.8	Confident	179 Å²	179	106.8 Å²	106.8	68%	0.675	53%	0.534	S	S	*	.	H	α-helix	trans	-63.9	-44.4	176.7	-166.2	-177.8	-69.6	133	-4.7	111.5	A51 A52 I53 R58 A59	A51-R55 VanDerWaalsContact O-CB 3.24Å; A51-R55 WeakPolarHBondContact O-CB 3.46Å; A51-R55 PolarHBondContact O-N 3.44Å; A52-R55 PolarHBondContact O-N 2.88Å; I53-R55 VanDerWaalsContact C-N 3.34Å; I53-R55 PolarHBondContact O-N 2.66Å; R55-R58 PolarHBondContact O-N 3.01Å; R55-A59 WeakPolarHBondContact O-CB 3.44Å; R55-A59 PolarHBondContact O-N 2.81Å
56	H	77.7	Confident	72.4	Confident	131 Å²	131	103.1 Å²	103.1	61%	0.606	52%	0.523	S	S	*	.	H	α-helix	trans	-63.3	-43.6	175.8	-177.7	-82.1	0	0	0	112	A52 I53 R58 A59 K60	A52-H56 WeakPolarHBondContact O-CB 3.46Å; A52-H56 PolarHBondContact O-N 2.88Å; I53-H56 PolarHBondContact O-N 3.15Å; H56-R58 PolarHBondContact O-N 2.9Å; H56-A59 PolarHBondContact O-N 2.93Å; H56-K60 WeakPolarHBondContact O-CB 3.11Å; H56-K60 PolarHBondContact O-N 2.77Å
57	S	81.9	Confident	74.1	Confident	67 Å²	67	104.1 Å²	104.1	47%	0.469	53%	0.528	S	S	.	.	H	α-helix	trans	-64.6	-41.6	179.2	-56	0	0	0	0	111.6	I53 T54 K60 A61	I53-S57 WeakPolarHBondContact O-CB 3.49Å; I53-S57 PolarHBondContact O-N 2.77Å; I53-S57 PolarHBondContact O-OG 3.13Å; T54-S57 PolarHBondContact O-N 2.85Å; S57-K60 PolarHBondContact O-N 2.68Å; S57-A61 PolarHBondContact O-N 3.48Å
58	R	83.4	Confident	75.8	Confident	181 Å²	181	106 Å²	106	68%	0.683	54%	0.536	S	S	*	.	H	α-helix	trans	-63.7	-45.6	172.7	-179.3	176.7	176	162.3	-0.5	111.8	T54 R55 H56 K60 A61 L62	T54-R58 WeakPolarHBondContact O-CB 3.37Å; T54-R58 PolarHBondContact O-N 3.26Å; R55-R58 PolarHBondContact O-N 3.01Å; H56-R58 PolarHBondContact O-N 2.9Å; R58-K60 VanDerWaalsContact C-N 3.34Å; R58-K60 PolarHBondContact O-N 2.85Å; R58-A61 WeakPolarHBondContact O-CB 3.34Å; R58-A61 PolarHBondContact O-N 3.27Å; R58-L62 HydrophobicContact CG-CD1 4.25Å; R58-L62 WeakPolarHBondContact O-CG 3.48Å; R58-L62 PolarHBondContact O-N 3.48Å
59	A	84.4	Confident	77.2	Confident	41 Å²	41	105 Å²	105	34%	0.339	53%	0.53	S	S	.	.	H	α-helix	trans	-59.1	-46	177.5	0	0	0	0	0	111.2	R55 H56 A61 L62 W63	R55-A59 WeakPolarHBondContact O-CB 3.44Å; R55-A59 PolarHBondContact O-N 2.81Å; H56-A59 PolarHBondContact O-N 2.93Å; A59-A61 VanDerWaalsContact C-N 3.32Å; A59-A61 PolarHBondContact O-N 3.2Å; A59-L62 PolarHBondContact O-N 2.82Å; A59-W63 PolarHBondContact O-N 3.23Å
60	K	88.6	Confident	78.5	Confident	122 Å²	122	104 Å²	104	53%	0.53	53%	0.529	S	S	.	.	H	α-helix	trans	-60.8	-39.3	175.5	-171.2	173.2	-175.8	172.9	0	112.5	H56 S57 R58 W63 K64	H56-K60 WeakPolarHBondContact O-CB 3.11Å; H56-K60 PolarHBondContact O-N 2.77Å; S57-K60 PolarHBondContact O-N 2.68Å; R58-K60 VanDerWaalsContact C-N 3.34Å; R58-K60 PolarHBondContact O-N 2.85Å; K60-W63 PolarHBondContact O-N 3.12Å; K60-K64 WeakPolarHBondContact O-CG 3.16Å; K60-K64 PolarHBondContact O-N 3.18Å
61	A	90.6	Very high	80.1	Confident	51 Å²	51	99.9 Å²	99.9	42%	0.421	53%	0.527	S	S	.	.	H	α-helix	trans	-63.9	-44.7	175.2	0	0	0	0	0	111.7	S57 R58 A59 W63 K64 T65	S57-A61 PolarHBondContact O-N 3.48Å; R58-A61 WeakPolarHBondContact O-CB 3.34Å; R58-A61 PolarHBondContact O-N 3.27Å; A59-A61 VanDerWaalsContact C-N 3.32Å; A59-A61 PolarHBondContact O-N 3.2Å; A61-W63 PolarHBondContact O-N 2.71Å; A61-K64 PolarHBondContact O-N 2.86Å; A61-T65 PolarHBondContact O-N 3.18Å; A61-T65 PolarHBondContact O-OG1 3.18Å
62	L	87.7	Confident	81.2	Confident	103 Å²	103	102.1 Å²	102.1	54%	0.539	54%	0.54	S	S	.	.	H	α-helix	trans	-61.5	-42.7	175.9	-69.4	171.6	0	0	0	112	R58 A59 K64 T65 A66	R58-L62 HydrophobicContact CG-CD1 4.25Å; R58-L62 WeakPolarHBondContact O-CG 3.48Å; R58-L62 PolarHBondContact O-N 3.48Å; A59-L62 PolarHBondContact O-N 2.82Å; L62-K64 PolarHBondContact O-N 3.05Å; L62-T65 PolarHBondContact O-N 2.7Å; L62-A66 WeakPolarHBondContact O-CB 3.18Å; L62-A66 PolarHBondContact O-N 3.05Å
63	W	89.9	Confident	82.1	Confident	193 Å²	193	103.2 Å²	103.2	73%	0.731	54%	0.544	S	S	*	.	H	α-helix	trans	-62.5	-39.9	175	-83.1	113.8	0	0	0	112.9	A59 K60 A61 A66 L67	A59-W63 PolarHBondContact O-N 3.23Å; K60-W63 PolarHBondContact O-N 3.12Å; A61-W63 PolarHBondContact O-N 2.71Å; W63-A66 PolarHBondContact O-N 2.99Å; W63-L67 WeakPolarHBondContact O-CB 3.12Å; W63-L67 PolarHBondContact O-N 3.23Å
64	K	91.1	Very high	83.3	Confident	138 Å²	138	101 Å²	101	60%	0.6	55%	0.547	S	S	*	.	H	α-helix	trans	-63.7	-42.1	173.8	-75.5	-179	175	-167.5	0	112	K60 A61 L62 S68	K60-K64 WeakPolarHBondContact O-CG 3.16Å; K60-K64 PolarHBondContact O-N 3.18Å; A61-K64 PolarHBondContact O-N 2.86Å; L62-K64 PolarHBondContact O-N 3.05Å; K64-S68 WeakPolarHBondContact O-CB 3.4Å; K64-S68 PolarHBondContact O-N 2.85Å
65	T	87.8	Confident	84.2	Confident	82 Å²	82	99.4 Å²	99.4	50%	0.503	54%	0.536	S	S	.	.	H	α-helix	trans	-63.9	-45.5	175.3	-59.1	0	0	0	0	111	A61 L62 S68 L69	A61-T65 PolarHBondContact O-N 3.18Å; A61-T65 PolarHBondContact O-OG1 3.18Å; L62-T65 PolarHBondContact O-N 2.7Å; T65-S68 PolarHBondContact O-N 2.9Å; T65-L69 HydrophobicContact CG2-CD1 4.1Å; T65-L69 HydrophobicContact CG2-CG 4.48Å; T65-L69 VanDerWaalsContact O-CG 3.31Å; T65-L69 WeakPolarHBondContact O-CG 3.27Å; T65-L69 PolarHBondContact O-N 2.94Å
66	A	85.6	Confident	84.8	Confident	35 Å²	35	93.5 Å²	93.5	29%	0.289	52%	0.521	S	S	.	.	H	α-helix	trans	-59.7	-47.6	176.4	0	0	0	0	0	111.5	L62 W63 S68 L69 I70	L62-A66 WeakPolarHBondContact O-CB 3.18Å; L62-A66 PolarHBondContact O-N 3.05Å; W63-A66 PolarHBondContact O-N 2.99Å; A66-S68 VanDerWaalsContact C-N 3.32Å; A66-S68 PolarHBondContact O-N 2.88Å; A66-L69 PolarHBondContact O-N 3.43Å; A66-I70 VanDerWaalsContact O-CG1 3.26Å; A66-I70 WeakPolarHBondContact O-CG1 3.49Å; A66-I70 PolarHBondContact O-N 3.1Å
67	L	86.2	Confident	85.4	Confident	111 Å²	111	87.8 Å²	87.8	58%	0.581	49%	0.494	S	S	*	.	H	α-helix	trans	-61	-40.6	176.3	-177.8	63.4	0	0	0	112	W63 I70 S71	W63-L67 WeakPolarHBondContact O-CB 3.12Å; W63-L67 PolarHBondContact O-N 3.23Å; L67-I70 PolarHBondContact O-N 3.29Å; L67-S71 VanDerWaalsContact O-CB 3.29Å; L67-S71 WeakPolarHBondContact O-CB 3.33Å; L67-S71 PolarHBondContact O-N 3.04Å; L67-S71 PolarHBondContact O-OG 2.8Å
68	S	87.4	Confident	85.8	Confident	79 Å²	79	90.5 Å²	90.5	55%	0.552	50%	0.499	S	S	*	.	H	α-helix	trans	-64.5	-39.5	176.3	-175.6	0	0	0	0	112.4	K64 T65 A66 S72	K64-S68 WeakPolarHBondContact O-CB 3.4Å; K64-S68 PolarHBondContact O-N 2.85Å; T65-S68 PolarHBondContact O-N 2.9Å; A66-S68 VanDerWaalsContact C-N 3.32Å; A66-S68 PolarHBondContact O-N 2.88Å; S68-S72 PolarHBondContact O-N 3.38Å; S68-S72 PolarHBondContact O-OG 2.75Å
69	L	84	Confident	86.3	Confident	103 Å²	103	88.1 Å²	88.1	54%	0.539	49%	0.493	S	S	.	.	H	α-helix	trans	-67.4	-46.6	176.6	-70.8	169.4	0	0	0	110.6	T65 A66 S71 S72 C73	T65-L69 HydrophobicContact CG2-CD1 4.1Å; T65-L69 HydrophobicContact CG2-CG 4.48Å; T65-L69 VanDerWaalsContact O-CG 3.31Å; T65-L69 WeakPolarHBondContact O-CG 3.27Å; T65-L69 PolarHBondContact O-N 2.94Å; A66-L69 PolarHBondContact O-N 3.43Å; L69-S71 PolarHBondContact O-N 3.19Å; L69-S72 WeakPolarHBondContact CA-OG 3.29Å; L69-S72 PolarHBondContact O-N 3.46Å; L69-S72 PolarHBondContact O-OG 3.01Å; L69-C73 PolarHBondContact O-N 2.65Å; L69-C73 VanDerWaalsContact O-N 3.12Å; L69-C73 PolarHBondContact O-SG 2.86Å
70	I	81.2	Confident	86.7	Confident	116 Å²	116	88.7 Å²	88.7	60%	0.595	49%	0.488	S	S	*	.	H	α-helix	trans	-63.4	-42.9	177.7	-65	162.9	0	0	0	110.7	A66 L67 S72 C73	A66-I70 VanDerWaalsContact O-CG1 3.26Å; A66-I70 WeakPolarHBondContact O-CG1 3.49Å; A66-I70 PolarHBondContact O-N 3.1Å; L67-I70 PolarHBondContact O-N 3.29Å; I70-S72 PolarHBondContact O-N 2.77Å; I70-C73 CarbonylContact O-C 3.48Å; I70-C73 PolarHBondContact O-N 3.39Å
71	S	80.6	Confident	86.9	Confident	91 Å²	91	87.5 Å²	87.5	64%	0.636	49%	0.485	S	S	*	.	H	α-helix	trans	-67.6	-22.5	179.3	-53.6	0	0	0	0	112.8	L67 L69	L67-S71 VanDerWaalsContact O-CB 3.29Å; L67-S71 WeakPolarHBondContact O-CB 3.33Å; L67-S71 PolarHBondContact O-N 3.04Å; L67-S71 PolarHBondContact O-OG 2.8Å; L69-S71 PolarHBondContact O-N 3.19Å
72	S	79.7	Confident	87	Confident	90 Å²	90	85.1 Å²	85.1	63%	0.629	47%	0.465	S	S	*	.	H	α-helix	trans	-85.3	-16.1	173.1	60.6	0	0	0	0	113.5	S68 L69 I70	S68-S72 PolarHBondContact O-N 3.38Å; S68-S72 PolarHBondContact O-OG 2.75Å; L69-S72 WeakPolarHBondContact CA-OG 3.29Å; L69-S72 PolarHBondContact O-N 3.46Å; L69-S72 PolarHBondContact O-OG 3.01Å; I70-S72 PolarHBondContact O-N 2.77Å
73	C	76.5	Confident	87.1	Confident	72 Å²	72	82.6 Å²	82.6	49%	0.486	45%	0.45	S	S	.	.	S	Bend	trans	-93.9	123.7	174.6	-63.4	0	0	0	0	108.7	L69 I70	L69-C73 PolarHBondContact O-N 2.65Å; L69-C73 VanDerWaalsContact O-N 3.12Å; L69-C73 PolarHBondContact O-SG 2.86Å; I70-C73 CarbonylContact O-C 3.48Å; I70-C73 PolarHBondContact O-N 3.39Å
74	G	82.9	Confident	87.3	Confident	60 Å²	60	80.1 Å²	80.1	62%	0.619	45%	0.447	S	S	*	.			trans	-67.2	175.8	167.9	0	0	0	0	0	111.5	P76	G74-P76 WeakPolarHBondContact O-CD 3.3Å
75	D	86.8	Confident	87.5	Confident	43 Å²	43	75.9 Å²	75.9	23%	0.23	43%	0.43	C	S	.	.			trans	-70	115.6	169.1	172.2	1.6	0	0	0	108.8	W77 E78 K128 N144	D75-W77 PolarHBondContact O-N 2.76Å; D75-W77 WeakPolarHBondContact OD1-CA 3.49Å; D75-W77 PolarHBondContact OD1-N 2.94Å; D75-E78 HydrophobicContact CB-CB 4.04Å; D75-E78 WeakPolarHBondContact O-CB 3.42Å; D75-E78 PolarHBondContact O-N 3.41Å; D75-E78 PolarHBondContact OD1-N 2.88Å; D75-K128 WeakPolarHBondContact OD2-CE 3.24Å; D75-K128 IonicContact OD2-NZ 3.37Å; D75-K128 PolarHBondContact OD2-NZ 3.49Å; D75-N144 PolarHBondContact OD1-ND2 3.45Å
76	P	87.2	Confident	87.8	Confident	54 Å²	54	76.3 Å²	76.3	35%	0.351	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-16.6	-177.3	26.9	-35.5	0	0	0	113.1	G74 F210	G74-P76 WeakPolarHBondContact O-CD 3.3Å; P76-F210 HydrophobicContact CB-CE1 4.23Å; P76-F210 HydrophobicContact CG-CD1 4.13Å; P76-F210 HydrophobicContact CG-CE1 3.84Å
77	W	90.9	Very high	88.2	Confident	12 Å²	12	79 Å²	79	5%	0.045	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	11.5	179.2	-72.1	-0.3	0	0	0	113.5	D75 K79 F80 L82 F116 R126 N144 H145 V146 F210	D75-W77 PolarHBondContact O-N 2.76Å; D75-W77 WeakPolarHBondContact OD1-CA 3.49Å; D75-W77 PolarHBondContact OD1-N 2.94Å; W77-K79 PolarHBondContact O-N 3.34Å; W77-K79 VanDerWaalsContact O-N 3.17Å; W77-F80 HydrophobicContact CB-CD2 3.8Å; W77-F80 HydrophobicContact CB-CE2 4.41Å; W77-F80 AromaticContact CD1-CE2 3.8Å; W77-F80 AromaticContact CG-CD2 3.95Å; W77-F80 HydrophobicContact CG-CD2 3.95Å; W77-F80 HydrophobicContact CG-CE2 4.18Å; W77-F80 PolarHBondContact O-N 3.41Å; W77-L82 HydrophobicContact CB-CD1 4.29Å; W77-L82 HydrophobicContact CD2-CD1 4.4Å; W77-L82 HydrophobicContact CE3-CD1 3.58Å; W77-L82 HydrophobicContact CZ3-CD1 4.25Å; W77-F116 HydrophobicContact CZ2-CE1 4.48Å; W77-F116 HydrophobicContact CZ2-CZ 4.31Å; W77-R126 HydrophobicContact CD2-CB 4.49Å; W77-R126 HydrophobicContact CD2-CG 4.27Å; W77-R126 HydrophobicContact CE3-CB 3.94Å; W77-R126 HydrophobicContact CE3-CG 4.19Å; W77-R126 HydrophobicContact CH2-CB 3.87Å; W77-R126 HydrophobicContact CH2-CG 3.79Å; W77-R126 HydrophobicContact CZ2-CB 4.44Å; W77-R126 HydrophobicContact CZ2-CG 3.88Å; W77-R126 HydrophobicContact CZ3-CB 3.6Å; W77-R126 HydrophobicContact CZ3-CG 3.96Å; W77-N144 HydrophobicContact CD2-CB 4.3Å; W77-N144 HydrophobicContact CE3-CB 3.69Å; W77-N144 HydrophobicContact CZ3-CB 3.97Å; W77-H145 VanDerWaalsContact CH2-O 3.27Å; W77-H145 WeakPolarHBondContact CH2-O 3.32Å; W77-H145 WeakPolarHBondContact CZ3-O 3.31Å; W77-V146 HydrophobicContact CH2-CG2 3.87Å; W77-V146 HydrophobicContact CZ2-CG2 4.29Å; W77-F210 AromaticContact CE2-CD2 3.81Å; W77-F210 AromaticContact CE2-CE2 3.98Å; W77-F210 AromaticContact CE2-CG 3.91Å; W77-F210 HydrophobicContact CH2-CB 3.97Å; W77-F210 AromaticContact CH2-CD2 3.95Å; W77-F210 HydrophobicContact CH2-CD2 3.95Å; W77-F210 HydrophobicContact CH2-CG 4.06Å; W77-F210 HydrophobicContact CZ2-CB 4.04Å; W77-F210 HydrophobicContact CZ2-CD1 4.33Å; W77-F210 AromaticContact CZ2-CD2 3.24Å; W77-F210 HydrophobicContact CZ2-CD2 3.24Å; W77-F210 AromaticContact CZ2-CE2 3.7Å; W77-F210 HydrophobicContact CZ2-CE2 3.7Å; W77-F210 AromaticContact CZ2-CG 3.6Å; W77-F210 HydrophobicContact CZ2-CG 3.6Å; W77-F210 HydrophobicContact CZ2-CZ 4.41Å; W77-F210 HydrophobicContact CZ3-CB 4.42Å; W77-F210 AromaticContact NE1-CE1 3.9Å; W77-F210 AromaticContact NE1-CE2 3.83Å; W77-F210 AromaticContact NE1-CZ 3.71Å
78	E	90.2	Very high	88.7	Confident	123 Å²	123	75.5 Å²	75.5	58%	0.575	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-52.4	-41.2	179.2	-170.4	172.5	-170.6	0	0	112	D75 F80 H81	D75-E78 HydrophobicContact CB-CB 4.04Å; D75-E78 WeakPolarHBondContact O-CB 3.42Å; D75-E78 PolarHBondContact O-N 3.41Å; D75-E78 PolarHBondContact OD1-N 2.88Å; E78-F80 PolarHBondContact O-N 3Å; E78-F80 VanDerWaalsContact O-N 3.1Å; E78-H81 PolarHBondContact O-N 2.79Å
79	K	92.4	Very high	89.1	Confident	131 Å²	131	73.7 Å²	73.7	57%	0.57	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-61.7	-16.8	179.9	68.4	178.1	-178.6	177	0	115.3	W77 H81	W77-K79 PolarHBondContact O-N 3.34Å; W77-K79 VanDerWaalsContact O-N 3.17Å; K79-H81 PolarHBondContact O-CD2 3.41Å; K79-H81 VanDerWaalsContact O-CD2 3.23Å
80	F	93	Very high	89.7	Confident	53 Å²	53	68.8 Å²	68.8	23%	0.232	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-90.6	-5.1	178.7	-58	-68.9	0	0	0	112.6	W77 E78 L82 R126	W77-F80 HydrophobicContact CB-CD2 3.8Å; W77-F80 HydrophobicContact CB-CE2 4.41Å; W77-F80 AromaticContact CD1-CE2 3.8Å; W77-F80 AromaticContact CG-CD2 3.95Å; W77-F80 HydrophobicContact CG-CD2 3.95Å; W77-F80 HydrophobicContact CG-CE2 4.18Å; W77-F80 PolarHBondContact O-N 3.41Å; E78-F80 PolarHBondContact O-N 3Å; E78-F80 VanDerWaalsContact O-N 3.1Å; F80-L82 HydrophobicContact CB-CD2 3.93Å; F80-L82 HydrophobicContact CB-CG 4.05Å; F80-L82 PolarHBondContact O-N 3.47Å; F80-L82 VanDerWaalsContact O-N 3.11Å; F80-R126 VanDerWaalsContact CZ-CZ 3.44Å; F80-R126 VanDerWaalsContact CZ-NH2 3.29Å
81	H	93.5	Very high	90.5	Very high	98 Å²	98	65.2 Å²	65.2	45%	0.454	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	36.4	175.6	-59.5	-83.9	0	0	0	114	E78 K79 Q83 E84	E78-H81 PolarHBondContact O-N 2.79Å; K79-H81 PolarHBondContact O-CD2 3.41Å; K79-H81 VanDerWaalsContact O-CD2 3.23Å; H81-Q83 PolarHBondContact O-N 2.99Å; H81-E84 HydrophobicContact CB-CG 4.27Å; H81-E84 IonicContact CG-OE1 2.63Å; H81-E84 IonicContact ND1-OE1 3.8Å; H81-E84 PolarHBondContact ND1-OE1 2.92Å; H81-E84 WeakPolarHBondContact O-CB 3.47Å; H81-E84 PolarHBondContact O-N 3.41Å
82	L	93.2	Very high	91.4	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.005	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-57.8	-24.7	-175.9	-57.7	179.9	0	0	0	113.1	W77 F80 E84 L85 K110 E112 R126 K128	W77-L82 HydrophobicContact CB-CD1 4.29Å; W77-L82 HydrophobicContact CD2-CD1 4.4Å; W77-L82 HydrophobicContact CE3-CD1 3.58Å; W77-L82 HydrophobicContact CZ3-CD1 4.25Å; F80-L82 HydrophobicContact CB-CD2 3.93Å; F80-L82 HydrophobicContact CB-CG 4.05Å; F80-L82 PolarHBondContact O-N 3.47Å; F80-L82 VanDerWaalsContact O-N 3.11Å; L82-E84 PolarHBondContact O-N 3.24Å; L82-L85 HydrophobicContact CB-CD1 4.4Å; L82-L85 HydrophobicContact CD2-CD1 3.78Å; L82-L85 WeakPolarHBondContact O-CB 3.43Å; L82-L85 PolarHBondContact O-N 2.86Å; L82-K110 WeakPolarHBondContact O-CD 3.35Å; L82-E112 HydrophobicContact CD2-CG 3.56Å; L82-R126 HydrophobicContact CD1-CB 3.95Å; L82-R126 HydrophobicContact CD2-CB 4.15Å; L82-K128 HydrophobicContact CB-CD 4.06Å; L82-K128 HydrophobicContact CB-CG 3.97Å; L82-K128 HydrophobicContact CD1-CG 4.08Å
83	Q	89.5	Confident	92.3	Very high	49 Å²	49	58.8 Å²	58.8	23%	0.229	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-64.7	-18.4	174	69.7	-77.8	-3.5	0	0	114	H81 K110 W139	H81-Q83 PolarHBondContact O-N 2.99Å; Q83-K110 PolarHBondContact O-NZ 2.88Å; Q83-W139 HydrophobicContact CB-CB 3.7Å
84	E	93.1	Very high	93.3	Very high	142 Å²	142	58.3 Å²	58.3	66%	0.664	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-91.1	-15	-179.1	-59.9	177.6	-161.6	0	0	112.2	H81 L82	H81-E84 HydrophobicContact CB-CG 4.27Å; H81-E84 IonicContact CG-OE1 2.63Å; H81-E84 IonicContact ND1-OE1 3.8Å; H81-E84 PolarHBondContact ND1-OE1 2.92Å; H81-E84 WeakPolarHBondContact O-CB 3.47Å; H81-E84 PolarHBondContact O-N 3.41Å; L82-E84 PolarHBondContact O-N 3.24Å
85	L	95.5	Very high	94	Very high	48 Å²	48	56.3 Å²	56.3	25%	0.251	27%	0.272	S	S	.	.	S	Bend	trans	-62.4	155.4	176.2	-63.2	177.8	0	0	0	111.7	L82 E87 K110 E112	L82-L85 HydrophobicContact CB-CD1 4.4Å; L82-L85 HydrophobicContact CD2-CD1 3.78Å; L82-L85 WeakPolarHBondContact O-CB 3.43Å; L82-L85 PolarHBondContact O-N 2.86Å; L85-E87 PolarHBondContact O-N 3.36Å; L85-K110 HydrophobicContact CB-CB 4.18Å; L85-K110 HydrophobicContact CB-CD 4.47Å; L85-K110 VanDerWaalsContact O-CD 3.22Å; L85-K110 WeakPolarHBondContact O-CD 3.23Å; L85-K110 WeakPolarHBondContact O-CE 3.22Å; L85-K110 PolarHBondContact O-NZ 3.21Å; L85-E112 HydrophobicContact CD1-CG 4Å
86	P	95.2	Very high	94.3	Very high	91 Å²	91	55.6 Å²	55.6	59%	0.591	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-60.7	137.5	174.5	25.6	-34.2	0	0	0	111
87	E	94.3	Very high	94.5	Very high	92 Å²	92	53.4 Å²	53.4	43%	0.43	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-74.3	133.3	172.4	179.7	179.6	141.5	0	0	110.2	L85 H108 W139	L85-E87 PolarHBondContact O-N 3.36Å; E87-H108 HydrophobicContact CG-CB 4.25Å; E87-H108 IonicContact OE1-CE1 3.62Å; E87-H108 IonicContact OE1-CG 2.85Å; E87-H108 IonicContact OE1-ND1 2.84Å; E87-H108 PolarHBondContact OE1-ND1 2.92Å; E87-W139 HydrophobicContact CB-CZ2 4.36Å; E87-W139 HydrophobicContact CG-CH2 4.41Å; E87-W139 HydrophobicContact CG-CZ2 3.71Å; E87-W139 PolarHBondContact OE2-NE1 3.28Å
88	E	96.1	Very high	94.3	Very high	38 Å²	38	54.4 Å²	54.4	18%	0.178	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	141.2	177.2	-68	-174.9	-105.5	0	0	111.6	H108 V109 F196 R199	E88-H108 WeakPolarHBondContact O-CA 3.25Å; E88-V109 HydrophobicContact CB-CG2 4.43Å; E88-V109 PolarHBondContact N-O 3.03Å; E88-V109 PolarHBondContact O-N 2.75Å; E88-F196 HydrophobicContact CB-CD1 4.31Å; E88-F196 HydrophobicContact CB-CE1 4.2Å; E88-R199 VanDerWaalsContact CD-NH2 3.33Å; E88-R199 IonicContact OE1-CZ 2.82Å; E88-R199 IonicContact OE1-NE 2.71Å; E88-R199 IonicContact OE1-NH2 3.6Å; E88-R199 PolarHBondContact OE1-NH2 2.93Å; E88-R199 IonicContact OE2-CZ 2.91Å; E88-R199 IonicContact OE2-NE 3.68Å; E88-R199 PolarHBondContact OE2-NE 3.07Å; E88-R199 IonicContact OE2-NH2 3.07Å; E88-R199 PolarHBondContact OE2-NH2 2.79Å
89	T	95.3	Very high	94.3	Very high	40 Å²	40	56.4 Å²	56.4	25%	0.245	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	126.8	174.4	-52	0	0	0	0	109.8	I106 I197	T89-I106 HydrophobicContact CG2-CG2 3.43Å; T89-I106 VanDerWaalsContact CG2-CG2 3.43Å; T89-I197 HydrophobicContact CG2-CD1 4.35Å
90	A	97.5	Very high	94.2	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	149.8	176.5	0	0	0	0	0	110.9	V107 V109 L194 E195 F196	A90-V107 HydrophobicContact CB-CG2 4.19Å; A90-V107 PolarHBondContact N-O 2.8Å; A90-V107 PolarHBondContact O-N 2.93Å; A90-V109 HydrophobicContact CB-CG2 4.33Å; A90-L194 HydrophobicContact CB-CB 4.43Å; A90-L194 HydrophobicContact CB-CD2 4.34Å; A90-E195 CarbonylContact C-O 3.4Å; A90-E195 VanDerWaalsContact CA-O 3.31Å; A90-E195 WeakPolarHBondContact CA-O 3.3Å; A90-F196 HydrophobicContact CB-CD1 4.34Å; A90-F196 HydrophobicContact CB-CE1 4.48Å
91	K	98.1	Very high	94.3	Very high	42 Å²	42	55.7 Å²	55.7	18%	0.183	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	122.3	169.3	-174.3	173.1	178.7	-173.2	0	108.5	Y93 E104 I106 L194 E195 I197	K91-Y93 HydrophobicContact CB-CE2 4.39Å; K91-Y93 HydrophobicContact CD-CE1 4.44Å; K91-Y93 HydrophobicContact CD-CE2 4.13Å; K91-Y93 WeakPolarHBondContact CD-OH 3.16Å; K91-Y93 VanDerWaalsContact CE-OH 3.32Å; K91-Y93 WeakPolarHBondContact CE-OH 3.47Å; K91-Y93 HydrophobicContact CG-CE2 3.95Å; K91-Y93 PolarHBondContact NZ-OH 2.94Å; K91-E104 WeakPolarHBondContact CE-OE1 3.43Å; K91-E104 WeakPolarHBondContact CE-OE2 3.26Å; K91-E104 IonicContact NZ-OE1 3.63Å; K91-E104 PolarHBondContact NZ-OE1 3.3Å; K91-E104 IonicContact NZ-OE2 2.65Å; K91-E104 PolarHBondContact NZ-OE2 2.77Å; K91-I106 HydrophobicContact CB-CD1 4.06Å; K91-I106 HydrophobicContact CG-CD1 4.17Å; K91-L194 CarbonylContact O-C 3.56Å; K91-L194 WeakPolarHBondContact O-CA 2.96Å; K91-E195 HydrophobicContact CB-CB 4.34Å; K91-E195 PolarHBondContact N-O 3.04Å; K91-E195 PolarHBondContact O-N 3.17Å; K91-I197 HydrophobicContact CB-CG2 3.88Å
92	R	98.2	Very high	94.5	Very high	14 Å²	14	55.5 Å²	55.5	5%	0.053	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	129.2	-178.9	-178.8	175	67.3	168.5	-4.5	109.9	R94 E104 D105 V107 C192 V193 L194 D477	R92-R94 HydrophobicContact CG-CG 4.12Å; R92-E104 CarbonylContact O-C 3.57Å; R92-E104 VanDerWaalsContact O-CA 3.23Å; R92-E104 WeakPolarHBondContact O-CA 3.3Å; R92-D105 IonicContact CZ-OD1 3.65Å; R92-D105 IonicContact CZ-OD2 2.83Å; R92-D105 PolarHBondContact N-O 2.8Å; R92-D105 IonicContact NE-OD1 2.78Å; R92-D105 PolarHBondContact NE-OD1 3.36Å; R92-D105 VanDerWaalsContact NE-OD1 3.13Å; R92-D105 IonicContact NE-OD2 3.25Å; R92-D105 PolarHBondContact NE-OD2 2.91Å; R92-D105 IonicContact NH2-OD1 3.15Å; R92-D105 PolarHBondContact NH2-OD1 3.13Å; R92-D105 IonicContact NH2-OD2 2.95Å; R92-D105 PolarHBondContact NH2-OD2 2.84Å; R92-D105 PolarHBondContact O-N 2.76Å; R92-V107 HydrophobicContact CB-CG1 3.81Å; R92-V107 HydrophobicContact CB-CG2 3.91Å; R92-V107 HydrophobicContact CG-CG1 4.47Å; R92-C192 HydrophobicContact CG-CB 4.09Å; R92-V193 CarbonylContact C-O 3.56Å; R92-V193 WeakPolarHBondContact CA-O 3.32Å; R92-L194 HydrophobicContact CB-CD2 3.76Å; R92-L194 HydrophobicContact CG-CD2 3.97Å; R92-D477 IonicContact CZ-OD1 2.66Å; R92-D477 IonicContact NH1-OD1 2.8Å; R92-D477 PolarHBondContact NH1-OD1 2.97Å; R92-D477 VanDerWaalsContact NH1-OD1 3.13Å; R92-D477 IonicContact NH1-OD2 3.76Å; R92-D477 IonicContact NH2-OD1 3.58Å; R92-D477 PolarHBondContact NH2-OD1 2.81Å
93	Y	98.7	Very high	94.6	Very high	31 Å²	31	59.1 Å²	59.1	12%	0.122	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	121.9	173.4	-59.1	-93.3	0	0	0	110.2	K91 E104 F160 C192 V193 E195	K91-Y93 HydrophobicContact CB-CE2 4.39Å; K91-Y93 HydrophobicContact CD-CE1 4.44Å; K91-Y93 HydrophobicContact CD-CE2 4.13Å; K91-Y93 WeakPolarHBondContact CD-OH 3.16Å; K91-Y93 VanDerWaalsContact CE-OH 3.32Å; K91-Y93 WeakPolarHBondContact CE-OH 3.47Å; K91-Y93 HydrophobicContact CG-CE2 3.95Å; K91-Y93 PolarHBondContact NZ-OH 2.94Å; Y93-E104 HydrophobicContact CD1-CB 4.04Å; Y93-E104 HydrophobicContact CE1-CB 4.17Å; Y93-E104 WeakPolarHBondContact CE1-OE2 3.33Å; Y93-F160 AromaticContact CD1-CE1 3.87Å; Y93-F160 HydrophobicContact CD1-CE1 3.87Å; Y93-F160 HydrophobicContact CD1-CZ 4.36Å; Y93-F160 HydrophobicContact CD2-CE1 4.13Å; Y93-F160 HydrophobicContact CD2-CZ 4.09Å; Y93-F160 HydrophobicContact CE1-CE1 4.41Å; Y93-F160 HydrophobicContact CE2-CZ 4.31Å; Y93-F160 AromaticContact CG-CE1 3.69Å; Y93-F160 HydrophobicContact CG-CE1 3.69Å; Y93-F160 HydrophobicContact CG-CZ 4.12Å; Y93-C192 WeakPolarHBondContact O-CA 3.43Å; Y93-C192 VanDerWaalsContact O-CB 3.23Å; Y93-C192 WeakPolarHBondContact O-CB 3.13Å; Y93-V193 HydrophobicContact CD2-CB 4.31Å; Y93-V193 HydrophobicContact CD2-CG1 4.47Å; Y93-V193 PolarHBondContact N-O 3.46Å; Y93-V193 PolarHBondContact O-N 2.74Å; Y93-E195 HydrophobicContact CE2-CB 3.94Å; Y93-E195 PolarHBondContact OH-OE2 2.81Å
94	R	97.4	Very high	94.9	Very high	62 Å²	62	62.2 Å²	62.2	23%	0.234	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	134.2	179	-69.5	179	-70.9	140.2	1.5	110.2	R92 W102 I103 D105 C192	R92-R94 HydrophobicContact CG-CG 4.12Å; R94-W102 CarbonylContact O-C 3.52Å; R94-W102 WeakPolarHBondContact O-CA 3.01Å; R94-I103 PolarHBondContact N-O 3.12Å; R94-I103 PolarHBondContact O-N 3.25Å; R94-D105 IonicContact CZ-OD1 3.41Å; R94-D105 IonicContact NE-OD1 3.77Å; R94-D105 PolarHBondContact NE-OD1 2.96Å; R94-D105 IonicContact NH2-OD1 2.65Å; R94-D105 PolarHBondContact NH2-OD1 3.06Å; R94-D105 IonicContact NH2-OD2 2.84Å; R94-C192 HydrophobicContact CG-CB 3.87Å
95	Y	97.3	Very high	95	Very high	18 Å²	18	57 Å²	57	7%	0.071	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	127	177.3	-178.6	-110.3	0	0	0	111.2	A97 W102 R164 M167 D168	Y95-A97 HydrophobicContact CD1-CB 4.19Å; Y95-A97 VanDerWaalsContact CE1-CA 3.45Å; Y95-A97 HydrophobicContact CE1-CB 3.84Å; Y95-W102 AromaticContact CD2-CD2 3.97Å; Y95-W102 HydrophobicContact CD2-CD2 3.97Å; Y95-W102 AromaticContact CD2-CE2 3.62Å; Y95-W102 HydrophobicContact CD2-CG 4.2Å; Y95-W102 HydrophobicContact CD2-CZ2 4.04Å; Y95-W102 AromaticContact CD2-NE1 3.65Å; Y95-W102 HydrophobicContact CG-CD2 4.48Å; Y95-W102 HydrophobicContact CG-CZ2 4.2Å; Y95-R164 HydrophobicContact CD1-CB 4.28Å; Y95-R164 HydrophobicContact CD1-CG 4.27Å; Y95-R164 HydrophobicContact CE1-CB 4.21Å; Y95-R164 HydrophobicContact CE1-CG 3.7Å; Y95-R164 HydrophobicContact CE2-CG 4.44Å; Y95-M167 HydrophobicContact CD1-CB 3.88Å; Y95-D168 WeakPolarHBondContact CE1-OD1 3.37Å
96	N	92.8	Very high	95	Very high	28 Å²	28	58.8 Å²	58.8	15%	0.15	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	102.3	169.8	-176	-36.7	0	0	0	109	I98 R99 G100 K101	N96-I98 VanDerWaalsContact C-N 3.33Å; N96-I98 PolarHBondContact O-N 2.78Å; N96-I98 PolarHBondContact OD1-N 3.01Å; N96-I98 VanDerWaalsContact OD1-N 3.11Å; N96-R99 HydrophobicContact CB-CB 4.38Å; N96-R99 PolarHBondContact O-N 2.71Å; N96-R99 PolarHBondContact OD1-N 3.2Å; N96-G100 WeakPolarHBondContact O-CA 3.34Å; N96-G100 PolarHBondContact O-N 3.47Å; N96-K101 PolarHBondContact N-O 3.04Å; N96-K101 PolarHBondContact O-N 3.13Å
97	A	91.5	Very high	95	Very high	9 Å²	9	54.5 Å²	54.5	7%	0.074	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-31.2	-177.7	0	0	0	0	0	114.2	Y95 M167 D168 L171	Y95-A97 HydrophobicContact CD1-CB 4.19Å; Y95-A97 VanDerWaalsContact CE1-CA 3.45Å; Y95-A97 HydrophobicContact CE1-CB 3.84Å; A97-M167 HydrophobicContact CB-CB 4.31Å; A97-D168 WeakPolarHBondContact CB-OD1 3.31Å; A97-L171 HydrophobicContact CB-CD1 3.51Å; A97-L171 HydrophobicContact CB-CD2 4.23Å; A97-L171 HydrophobicContact CB-CG 3.74Å
98	I	88.1	Confident	95	Very high	32 Å²	32	53.2 Å²	53.2	16%	0.164	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-43.5	177.8	-60.1	175.5	0	0	0	110.4	N96 L171 E531 L532	N96-I98 VanDerWaalsContact C-N 3.33Å; N96-I98 PolarHBondContact O-N 2.78Å; N96-I98 PolarHBondContact OD1-N 3.01Å; N96-I98 VanDerWaalsContact OD1-N 3.11Å; I98-L171 HydrophobicContact CD1-CD2 4.43Å; I98-L171 HydrophobicContact CG1-CD1 4.02Å; I98-L171 HydrophobicContact CG1-CD2 3.9Å; I98-E531 HydrophobicContact CG2-CB 4.21Å; I98-L532 HydrophobicContact CD1-CB 4.35Å; I98-L532 HydrophobicContact CD1-CD1 4.01Å; I98-L532 HydrophobicContact CG1-CD1 4.1Å
99	R	88.9	Confident	95	Very high	165 Å²	165	51.4 Å²	51.4	62%	0.623	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-12.6	-177	-61.2	-176.2	75.9	-176.5	6.1	113.4	N96 K101	N96-R99 HydrophobicContact CB-CB 4.38Å; N96-R99 PolarHBondContact O-N 2.71Å; N96-R99 PolarHBondContact OD1-N 3.2Å; R99-K101 VanDerWaalsContact C-N 3.27Å; R99-K101 HydrophobicContact CB-CB 4.41Å; R99-K101 HydrophobicContact CB-CG 4.48Å; R99-K101 PolarHBondContact O-N 2.97Å
100	G	90.2	Very high	95	Very high	44 Å²	44	50.5 Å²	50.5	45%	0.454	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	32	-172.3	0	0	0	0	0	113.4	N96	N96-G100 WeakPolarHBondContact O-CA 3.34Å; N96-G100 PolarHBondContact O-N 3.47Å
101	K	95.1	Very high	95.1	Very high	126 Å²	126	50.8 Å²	50.8	55%	0.548	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	140.9	-172.5	-71.3	-172.5	-178.5	-168.7	0	112.9	N96 R99	N96-K101 PolarHBondContact N-O 3.04Å; N96-K101 PolarHBondContact O-N 3.13Å; R99-K101 VanDerWaalsContact C-N 3.27Å; R99-K101 HydrophobicContact CB-CB 4.41Å; R99-K101 HydrophobicContact CB-CG 4.48Å; R99-K101 PolarHBondContact O-N 2.97Å
102	W	97.6	Very high	95	Very high	94 Å²	94	50.4 Å²	50.4	36%	0.356	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	143	170.7	-69.7	94.2	0	0	0	111.3	R94 Y95 F160 V163	R94-W102 CarbonylContact O-C 3.52Å; R94-W102 WeakPolarHBondContact O-CA 3.01Å; Y95-W102 AromaticContact CD2-CD2 3.97Å; Y95-W102 HydrophobicContact CD2-CD2 3.97Å; Y95-W102 AromaticContact CD2-CE2 3.62Å; Y95-W102 HydrophobicContact CD2-CG 4.2Å; Y95-W102 HydrophobicContact CD2-CZ2 4.04Å; Y95-W102 AromaticContact CD2-NE1 3.65Å; Y95-W102 HydrophobicContact CG-CD2 4.48Å; Y95-W102 HydrophobicContact CG-CZ2 4.2Å; W102-F160 HydrophobicContact CD2-CD1 4.2Å; W102-F160 HydrophobicContact CE3-CD1 4.05Å; W102-F160 HydrophobicContact CE3-CE1 4.45Å; W102-F160 HydrophobicContact CH2-CB 3.87Å; W102-F160 AromaticContact CH2-CD1 3.53Å; W102-F160 HydrophobicContact CH2-CD1 3.53Å; W102-F160 HydrophobicContact CH2-CG 4.12Å; W102-F160 WeakPolarHBondContact CH2-O 3.38Å; W102-F160 HydrophobicContact CZ2-CB 3.69Å; W102-F160 AromaticContact CZ2-CD1 3.73Å; W102-F160 HydrophobicContact CZ2-CD1 3.73Å; W102-F160 HydrophobicContact CZ2-CG 4.2Å; W102-F160 WeakPolarHBondContact CZ2-O 3.32Å; W102-F160 AromaticContact CZ3-CD1 3.71Å; W102-F160 HydrophobicContact CZ3-CD1 3.71Å; W102-F160 HydrophobicContact CZ3-CE1 4.3Å; W102-V163 HydrophobicContact CH2-CB 3.86Å; W102-V163 HydrophobicContact CH2-CG1 3.65Å; W102-V163 HydrophobicContact CZ3-CB 4.47Å; W102-V163 HydrophobicContact CZ3-CG1 3.9Å
103	I	95.9	Very high	94.8	Very high	77 Å²	77	56.2 Å²	56.2	40%	0.395	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	133	174.1	-57.1	172	0	0	0	106.9	R94	R94-I103 PolarHBondContact N-O 3.12Å; R94-I103 PolarHBondContact O-N 3.25Å
104	E	95.9	Very high	94.6	Very high	114 Å²	114	58.8 Å²	58.8	53%	0.533	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	144.3	176.7	58.2	179.5	-127.7	0	0	112	K91 R92 Y93	K91-E104 WeakPolarHBondContact CE-OE1 3.43Å; K91-E104 WeakPolarHBondContact CE-OE2 3.26Å; K91-E104 IonicContact NZ-OE1 3.63Å; K91-E104 PolarHBondContact NZ-OE1 3.3Å; K91-E104 IonicContact NZ-OE2 2.65Å; K91-E104 PolarHBondContact NZ-OE2 2.77Å; R92-E104 CarbonylContact O-C 3.57Å; R92-E104 VanDerWaalsContact O-CA 3.23Å; R92-E104 WeakPolarHBondContact O-CA 3.3Å; Y93-E104 HydrophobicContact CD1-CB 4.04Å; Y93-E104 HydrophobicContact CE1-CB 4.17Å; Y93-E104 WeakPolarHBondContact CE1-OE2 3.33Å
105	D	95.3	Very high	94.6	Very high	31 Å²	31	58.6 Å²	58.6	17%	0.166	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	159.3	173.8	62.3	-71	0	0	0	111.1	R92 R94 N132	R92-D105 IonicContact CZ-OD1 3.65Å; R92-D105 IonicContact CZ-OD2 2.83Å; R92-D105 PolarHBondContact N-O 2.8Å; R92-D105 IonicContact NE-OD1 2.78Å; R92-D105 PolarHBondContact NE-OD1 3.36Å; R92-D105 VanDerWaalsContact NE-OD1 3.13Å; R92-D105 IonicContact NE-OD2 3.25Å; R92-D105 PolarHBondContact NE-OD2 2.91Å; R92-D105 IonicContact NH2-OD1 3.15Å; R92-D105 PolarHBondContact NH2-OD1 3.13Å; R92-D105 IonicContact NH2-OD2 2.95Å; R92-D105 PolarHBondContact NH2-OD2 2.84Å; R92-D105 PolarHBondContact O-N 2.76Å; R94-D105 IonicContact CZ-OD1 3.41Å; R94-D105 IonicContact NE-OD1 3.77Å; R94-D105 PolarHBondContact NE-OD1 2.96Å; R94-D105 IonicContact NH2-OD1 2.65Å; R94-D105 PolarHBondContact NH2-OD1 3.06Å; R94-D105 IonicContact NH2-OD2 2.84Å; D105-N132 PolarHBondContact OD2-ND2 3.15Å
106	I	95.4	Very high	94.4	Very high	87 Å²	87	60.9 Å²	60.9	45%	0.446	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	135.6	175.5	-59.2	-58.8	0	0	0	109.4	T89 K91 N132	T89-I106 HydrophobicContact CG2-CG2 3.43Å; T89-I106 VanDerWaalsContact CG2-CG2 3.43Å; K91-I106 HydrophobicContact CB-CD1 4.06Å; K91-I106 HydrophobicContact CG-CD1 4.17Å; I106-N132 PolarHBondContact O-ND2 2.99Å
107	V	95.1	Very high	94.4	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	155.2	178.3	-60.5	0	0	0	0	110.8	A90 R92 V109 L194	A90-V107 HydrophobicContact CB-CG2 4.19Å; A90-V107 PolarHBondContact N-O 2.8Å; A90-V107 PolarHBondContact O-N 2.93Å; R92-V107 HydrophobicContact CB-CG1 3.81Å; R92-V107 HydrophobicContact CB-CG2 3.91Å; R92-V107 HydrophobicContact CG-CG1 4.47Å; V107-V109 HydrophobicContact CG2-CG1 4.23Å; V107-L194 HydrophobicContact CG2-CD2 3.68Å
108	H	93.9	Very high	94.3	Very high	65 Å²	65	71.9 Å²	71.9	30%	0.301	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.8	174.2	-63.9	-100.2	0	0	0	108.5	E87 E88 L130 W139	E87-H108 HydrophobicContact CG-CB 4.25Å; E87-H108 IonicContact OE1-CE1 3.62Å; E87-H108 IonicContact OE1-CG 2.85Å; E87-H108 IonicContact OE1-ND1 2.84Å; E87-H108 PolarHBondContact OE1-ND1 2.92Å; E88-H108 WeakPolarHBondContact O-CA 3.25Å; H108-L130 PolarHBondContact O-N 2.92Å; H108-L130 VanDerWaalsContact O-N 3.15Å; H108-W139 HydrophobicContact CB-CH2 4.15Å; H108-W139 HydrophobicContact CB-CZ2 4.17Å; H108-W139 WeakPolarHBondContact O-CH2 3.5Å
109	V	96.2	Very high	94.2	Very high	1 Å²	1	72.5 Å²	72.5	1%	0.006	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	152.5	-177.2	-64	0	0	0	0	110.9	E88 A90 V107 K128 K129 L194 F196	E88-V109 HydrophobicContact CB-CG2 4.43Å; E88-V109 PolarHBondContact N-O 3.03Å; E88-V109 PolarHBondContact O-N 2.75Å; A90-V109 HydrophobicContact CB-CG2 4.33Å; V107-V109 HydrophobicContact CG2-CG1 4.23Å; V109-K128 CarbonylContact C-O 3.56Å; V109-K128 VanDerWaalsContact CA-O 3.28Å; V109-K128 WeakPolarHBondContact CA-O 3.39Å; V109-K129 HydrophobicContact CG1-CB 4.21Å; V109-K129 HydrophobicContact CG1-CG 4.11Å; V109-L194 HydrophobicContact CG1-CD1 4.14Å; V109-F196 HydrophobicContact CG2-CE1 3.54Å; V109-F196 HydrophobicContact CG2-CZ 3.81Å
110	K	96.9	Very high	94	Very high	21 Å²	21	68.1 Å²	68.1	9%	0.091	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	122	166.8	-71.5	-171.3	176.8	-148.3	0	107	L82 Q83 L85 A127 K128 W139	L82-K110 WeakPolarHBondContact O-CD 3.35Å; Q83-K110 PolarHBondContact O-NZ 2.88Å; L85-K110 HydrophobicContact CB-CB 4.18Å; L85-K110 HydrophobicContact CB-CD 4.47Å; L85-K110 VanDerWaalsContact O-CD 3.22Å; L85-K110 WeakPolarHBondContact O-CD 3.23Å; L85-K110 WeakPolarHBondContact O-CE 3.22Å; L85-K110 PolarHBondContact O-NZ 3.21Å; K110-A127 CarbonylContact O-C 3.5Å; K110-A127 WeakPolarHBondContact O-CA 3.41Å; K110-K128 PolarHBondContact N-O 3.25Å; K110-K128 PolarHBondContact O-N 3.48Å; K110-W139 HydrophobicContact CB-CE3 4.39Å; K110-W139 HydrophobicContact CB-CZ3 4.15Å; K110-W139 HydrophobicContact CD-CD2 3.7Å; K110-W139 HydrophobicContact CD-CE3 3.76Å; K110-W139 HydrophobicContact CD-CG 4.07Å; K110-W139 HydrophobicContact CD-CZ2 4.49Å; K110-W139 HydrophobicContact CD-CZ3 4.17Å; K110-W139 VanDerWaalsContact CE-CE2 3.48Å; K110-W139 HydrophobicContact CG-CD2 4.15Å; K110-W139 HydrophobicContact CG-CE3 3.88Å; K110-W139 HydrophobicContact CG-CH2 3.91Å; K110-W139 HydrophobicContact CG-CZ2 4.21Å; K110-W139 HydrophobicContact CG-CZ3 3.75Å
111	I	97.6	Very high	94	Very high	5 Å²	5	71.9 Å²	71.9	3%	0.026	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139.3	-171.1	-175.5	174	0	0	0	109.9	F125 R126 A127 A147 F196 Y205	I111-F125 HydrophobicContact CD1-CB 3.93Å; I111-F125 HydrophobicContact CD1-CG 4.4Å; I111-F125 HydrophobicContact CG1-CB 3.9Å; I111-R126 WeakPolarHBondContact CA-O 3.12Å; I111-A127 HydrophobicContact CB-CB 4.1Å; I111-A127 HydrophobicContact CG1-CB 4.13Å; I111-A147 HydrophobicContact CD1-CB 3.48Å; I111-A147 VanDerWaalsContact CD1-CB 3.48Å; I111-A147 HydrophobicContact CG1-CB 4.4Å; I111-F196 HydrophobicContact CD1-CE2 4.49Å; I111-F196 HydrophobicContact CD1-CZ 4.05Å; I111-F196 HydrophobicContact CG2-CE1 3.98Å; I111-F196 HydrophobicContact CG2-CZ 3.96Å; I111-Y205 HydrophobicContact CD1-CD1 4.35Å; I111-Y205 HydrophobicContact CD1-CE1 4.23Å
112	E	97	Very high	94	Very high	34 Å²	34	68 Å²	68	16%	0.159	36%	0.356	C	S	.	.			trans	-66.5	145	172.6	-71.9	-176.1	148.3	0	0	111.1	L82 L85 F125 R126	L82-E112 HydrophobicContact CD2-CG 3.56Å; L85-E112 HydrophobicContact CD1-CG 4Å; E112-F125 WeakPolarHBondContact O-CD1 3.13Å; E112-R126 HydrophobicContact CG-CB 4.17Å; E112-R126 PolarHBondContact N-O 3.41Å; E112-R126 IonicContact OE1-NH1 3.53Å; E112-R126 WeakPolarHBondContact OE2-CB 3.13Å; E112-R126 WeakPolarHBondContact OE2-CD 3.37Å; E112-R126 VanDerWaalsContact OE2-CG 3.26Å; E112-R126 WeakPolarHBondContact OE2-CG 3.31Å; E112-R126 IonicContact OE2-CZ 2.81Å; E112-R126 IonicContact OE2-NH1 2.72Å; E112-R126 PolarHBondContact OE2-NH1 2.82Å
113	N	93.3	Very high	94	Very high	136 Å²	136	65 Å²	65	73%	0.727	35%	0.346	S	S	*	.	S	Bend	trans	-75.4	-27.5	177	-71.5	-33.6	0	0	0	112.9	F125	N113-F125 WeakPolarHBondContact O-CE1 3.21Å
114	S	95.4	Very high	94	Very high	86 Å²	86	62.2 Å²	62.2	60%	0.601	33%	0.333	S	S	*	.	S	Bend	trans	-104.6	137.1	-178.5	-58.1	0	0	0	0	110.2
115	P	96.4	Very high	94.1	Very high	58 Å²	58	56.9 Å²	56.9	38%	0.377	31%	0.309	S	S	.	.			trans	-68	143.6	174.1	31.4	-36.1	0	0	0	109.9	E123 C124 F125	P115-E123 HydrophobicContact CB-CB 3.94Å; P115-E123 HydrophobicContact CG-CB 4.45Å; P115-E123 WeakPolarHBondContact CG-OE2 3.22Å; P115-C124 CarbonylContact C-O 3.58Å; P115-C124 WeakPolarHBondContact CA-O 3.19Å; P115-C124 WeakPolarHBondContact CB-O 3.28Å; P115-F125 HydrophobicContact CB-CD1 4.21Å; P115-F125 HydrophobicContact CB-CE1 3.91Å; P115-F125 HydrophobicContact CB-CE2 4.31Å; P115-F125 HydrophobicContact CB-CZ 3.96Å; P115-F125 HydrophobicContact CG-CE1 4.28Å; P115-F125 HydrophobicContact CG-CZ 4.36Å
116	F	94.8	Very high	94.2	Very high	66 Å²	66	56.5 Å²	56.5	29%	0.289	31%	0.305	S	S	.	.	S	Bend	trans	-96.2	-15.7	175.8	78.1	-88	0	0	0	113.2	W77 C124 R126 V146	W77-F116 HydrophobicContact CZ2-CE1 4.48Å; W77-F116 HydrophobicContact CZ2-CZ 4.31Å; F116-C124 HydrophobicContact CD1-CB 4.32Å; F116-C124 WeakPolarHBondContact CD1-O 3.42Å; F116-C124 HydrophobicContact CE1-CB 3.8Å; F116-C124 HydrophobicContact CZ-CB 4.14Å; F116-C124 PolarHBondContact N-O 2.87Å; F116-R126 HydrophobicContact CB-CG 4.39Å; F116-R126 HydrophobicContact CD1-CB 4.49Å; F116-R126 HydrophobicContact CD1-CG 3.49Å; F116-R126 VanDerWaalsContact CD1-CG 3.49Å; F116-R126 HydrophobicContact CE1-CG 3.89Å; F116-R126 HydrophobicContact CG-CG 3.99Å; F116-V146 HydrophobicContact CE1-CG1 4.25Å; F116-V146 HydrophobicContact CE1-CG2 4.47Å; F116-V146 HydrophobicContact CZ-CG1 4.47Å; F116-V146 HydrophobicContact CZ-CG2 4.3Å
117	N	91.7	Very high	94.3	Very high	100 Å²	100	52.5 Å²	52.5	54%	0.535	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	162.9	177.8	-151.2	-30.1	0	0	0	109.8	C124	N117-C124 HydrophobicContact CB-CB 4.33Å; N117-C124 PolarHBondContact O-N 3.41Å
118	R	90.4	Very high	94.3	Very high	167 Å²	167	52.5 Å²	52.5	63%	0.63	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142	136.5	174.8	66.1	-173.8	-173	-144.7	1.8	110.5	E123 E341	R118-E123 HydrophobicContact CB-CB 4.3Å; R118-E341 IonicContact NH2-OE1 3.38Å; R118-E341 PolarHBondContact NH2-OE1 3.06Å
119	G	84.4	Confident	94.3	Very high	46 Å²	46	49.5 Å²	49.5	47%	0.474	27%	0.27	S	S	.	.			trans	-90.1	-166.4	165	0	0	0	0	0	111	M121 R122	G119-M121 VanDerWaalsContact C-N 3.33Å; G119-M121 PolarHBondContact O-N 3.42Å; G119-R122 PolarHBondContact N-O 2.79Å
120	A	85.2	Confident	94	Very high	72 Å²	72	50.5 Å²	50.5	60%	0.595	28%	0.276	S	S	*	.	S	Bend	trans	-65.8	-33.1	-179.7	0	0	0	0	0	113.6
121	M	91.4	Very high	93.3	Very high	123 Å²	123	51.8 Å²	51.8	61%	0.606	29%	0.287	S	S	*	.	S	Bend	trans	-120.1	-22.9	-174.2	-66	177.4	170.7	0	0	113.8	G119 Y150 I151	G119-M121 VanDerWaalsContact C-N 3.33Å; G119-M121 PolarHBondContact O-N 3.42Å; M121-Y150 HydrophobicContact CB-CD1 4.27Å; M121-Y150 HydrophobicContact CB-CE1 4.16Å; M121-Y150 WeakPolarHBondContact O-CA 3.47Å; M121-I151 PolarHBondContact O-N 2.9Å
122	R	94.9	Very high	92.3	Very high	44 Å²	44	54.9 Å²	54.9	17%	0.166	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	139.7	-169.2	-70.6	174.2	-75.4	155.5	2.3	111	G119 K148 R149 Y150 D262	G119-R122 PolarHBondContact N-O 2.79Å; R122-K148 HydrophobicContact CB-CB 4.46Å; R122-R149 CarbonylContact C-O 3.58Å; R122-R149 WeakPolarHBondContact CA-O 3.44Å; R122-R149 WeakPolarHBondContact CB-O 3.46Å; R122-Y150 HydrophobicContact CG-CD1 3.82Å; R122-Y150 HydrophobicContact CG-CD2 4.31Å; R122-Y150 HydrophobicContact CG-CE1 4Å; R122-Y150 HydrophobicContact CG-CE2 4.48Å; R122-Y150 HydrophobicContact CG-CG 3.99Å; R122-D262 IonicContact CZ-OD1 2.71Å; R122-D262 VanDerWaalsContact CZ-OD1 3.24Å; R122-D262 IonicContact NH1-OD1 3.33Å; R122-D262 PolarHBondContact NH1-OD1 2.63Å; R122-D262 IonicContact NH2-OD1 3.99Å; R122-D262 PolarHBondContact NH2-OD1 2.64Å; R122-D262 IonicContact NH2-OD2 3.2Å
123	E	96.2	Very high	91.1	Very high	32 Å²	32	60.1 Å²	60.1	15%	0.15	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	148.9	171.7	46.5	170	-168.5	0	0	110.7	P115 R118 F125 K148 R149 I151	P115-E123 HydrophobicContact CB-CB 3.94Å; P115-E123 HydrophobicContact CG-CB 4.45Å; P115-E123 WeakPolarHBondContact CG-OE2 3.22Å; R118-E123 HydrophobicContact CB-CB 4.3Å; E123-F125 HydrophobicContact CB-CE2 4.37Å; E123-F125 HydrophobicContact CG-CE2 3.8Å; E123-F125 HydrophobicContact CG-CZ 4.12Å; E123-F125 WeakPolarHBondContact OE1-CZ 3.42Å; E123-K148 CarbonylContact O-C 3.43Å; E123-K148 WeakPolarHBondContact O-CA 3.47Å; E123-R149 HydrophobicContact CG-CB 4.37Å; E123-R149 WeakPolarHBondContact CG-O 3.36Å; E123-R149 PolarHBondContact N-O 3.3Å; E123-R149 PolarHBondContact O-N 2.91Å; E123-R149 IonicContact OE1-CZ 3.71Å; E123-R149 IonicContact OE1-NE 3.25Å; E123-R149 PolarHBondContact OE1-NE 3.18Å; E123-R149 IonicContact OE1-NH2 2.71Å; E123-R149 PolarHBondContact OE1-NH2 2.91Å; E123-I151 HydrophobicContact CB-CG1 4.33Å; E123-I151 HydrophobicContact CG-CG1 4.29Å
124	C	96.2	Very high	89.9	Confident	18 Å²	18	56 Å²	56	12%	0.122	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	130.7	-170.2	-63.9	0	0	0	0	111	P115 F116 N117 V146 A147	P115-C124 CarbonylContact C-O 3.58Å; P115-C124 WeakPolarHBondContact CA-O 3.19Å; P115-C124 WeakPolarHBondContact CB-O 3.28Å; F116-C124 HydrophobicContact CD1-CB 4.32Å; F116-C124 WeakPolarHBondContact CD1-O 3.42Å; F116-C124 HydrophobicContact CE1-CB 3.8Å; F116-C124 HydrophobicContact CZ-CB 4.14Å; F116-C124 PolarHBondContact N-O 2.87Å; N117-C124 HydrophobicContact CB-CB 4.33Å; N117-C124 PolarHBondContact O-N 3.41Å; C124-V146 HydrophobicContact CB-CG1 3.82Å; C124-A147 CarbonylContact C-O 3.42Å; C124-A147 WeakPolarHBondContact CA-O 3.39Å
125	F	98.1	Very high	88.7	Confident	3 Å²	3	61.4 Å²	61.4	1%	0.013	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.1	179.8	-57.4	-98.9	0	0	0	109.6	I111 E112 N113 P115 E123 V146 A147 R149 Y205	I111-F125 HydrophobicContact CD1-CB 3.93Å; I111-F125 HydrophobicContact CD1-CG 4.4Å; I111-F125 HydrophobicContact CG1-CB 3.9Å; E112-F125 WeakPolarHBondContact O-CD1 3.13Å; N113-F125 WeakPolarHBondContact O-CE1 3.21Å; P115-F125 HydrophobicContact CB-CD1 4.21Å; P115-F125 HydrophobicContact CB-CE1 3.91Å; P115-F125 HydrophobicContact CB-CE2 4.31Å; P115-F125 HydrophobicContact CB-CZ 3.96Å; P115-F125 HydrophobicContact CG-CE1 4.28Å; P115-F125 HydrophobicContact CG-CZ 4.36Å; E123-F125 HydrophobicContact CB-CE2 4.37Å; E123-F125 HydrophobicContact CG-CE2 3.8Å; E123-F125 HydrophobicContact CG-CZ 4.12Å; E123-F125 WeakPolarHBondContact OE1-CZ 3.42Å; F125-V146 WeakPolarHBondContact O-CA 3.42Å; F125-A147 HydrophobicContact CB-CB 4.31Å; F125-A147 WeakPolarHBondContact CD2-O 3.37Å; F125-A147 PolarHBondContact N-O 3.47Å; F125-A147 PolarHBondContact O-N 2.81Å; F125-R149 HydrophobicContact CE2-CB 4.13Å; F125-Y205 HydrophobicContact CD2-CD1 4.19Å; F125-Y205 AromaticContact CD2-CE1 3.69Å; F125-Y205 HydrophobicContact CD2-CE1 3.69Å; F125-Y205 HydrophobicContact CE2-CD1 4.42Å; F125-Y205 AromaticContact CE2-CE1 3.66Å; F125-Y205 HydrophobicContact CE2-CE1 3.66Å; F125-Y205 HydrophobicContact CG-CE1 4.38Å; F125-Y205 HydrophobicContact CZ-CE1 4.31Å
126	R	97.7	Very high	87.5	Confident	23 Å²	23	62.2 Å²	62.2	9%	0.087	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	136.2	170.7	-57.6	-173.6	-174.7	86.8	-0.5	109.1	W77 F80 L82 I111 E112 F116	W77-R126 HydrophobicContact CD2-CB 4.49Å; W77-R126 HydrophobicContact CD2-CG 4.27Å; W77-R126 HydrophobicContact CE3-CB 3.94Å; W77-R126 HydrophobicContact CE3-CG 4.19Å; W77-R126 HydrophobicContact CH2-CB 3.87Å; W77-R126 HydrophobicContact CH2-CG 3.79Å; W77-R126 HydrophobicContact CZ2-CB 4.44Å; W77-R126 HydrophobicContact CZ2-CG 3.88Å; W77-R126 HydrophobicContact CZ3-CB 3.6Å; W77-R126 HydrophobicContact CZ3-CG 3.96Å; F80-R126 VanDerWaalsContact CZ-CZ 3.44Å; F80-R126 VanDerWaalsContact CZ-NH2 3.29Å; L82-R126 HydrophobicContact CD1-CB 3.95Å; L82-R126 HydrophobicContact CD2-CB 4.15Å; I111-R126 WeakPolarHBondContact CA-O 3.12Å; E112-R126 HydrophobicContact CG-CB 4.17Å; E112-R126 PolarHBondContact N-O 3.41Å; E112-R126 IonicContact OE1-NH1 3.53Å; E112-R126 WeakPolarHBondContact OE2-CB 3.13Å; E112-R126 WeakPolarHBondContact OE2-CD 3.37Å; E112-R126 VanDerWaalsContact OE2-CG 3.26Å; E112-R126 WeakPolarHBondContact OE2-CG 3.31Å; E112-R126 IonicContact OE2-CZ 2.81Å; E112-R126 IonicContact OE2-NH1 2.72Å; E112-R126 PolarHBondContact OE2-NH1 2.82Å; F116-R126 HydrophobicContact CB-CG 4.39Å; F116-R126 HydrophobicContact CD1-CB 4.49Å; F116-R126 HydrophobicContact CD1-CG 3.49Å; F116-R126 VanDerWaalsContact CD1-CG 3.49Å; F116-R126 HydrophobicContact CE1-CG 3.89Å; F116-R126 HydrophobicContact CG-CG 3.99Å
127	A	97.5	Very high	86.8	Confident	2 Å²	2	63.2 Å²	63.2	2%	0.017	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	151.1	175.3	0	0	0	0	0	111.7	K110 I111 H145 A147 L207	K110-A127 CarbonylContact O-C 3.5Å; K110-A127 WeakPolarHBondContact O-CA 3.41Å; I111-A127 HydrophobicContact CB-CB 4.1Å; I111-A127 HydrophobicContact CG1-CB 4.13Å; A127-H145 HydrophobicContact CB-CB 4.3Å; A127-H145 PolarHBondContact N-O 2.92Å; A127-H145 PolarHBondContact O-N 3.48Å; A127-H145 VanDerWaalsContact O-O 3.08Å; A127-A147 HydrophobicContact CB-CB 4.47Å; A127-L207 HydrophobicContact CB-CD1 4.36Å
128	K	95.5	Very high	86.5	Confident	1 Å²	1	61.2 Å²	61.2	0%	0.004	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	141.7	159.9	-75.9	-166.8	169.2	-169.8	0	109.5	D75 L82 V109 K110 W139 S140 A142 S143 N144	D75-K128 WeakPolarHBondContact OD2-CE 3.24Å; D75-K128 IonicContact OD2-NZ 3.37Å; D75-K128 PolarHBondContact OD2-NZ 3.49Å; L82-K128 HydrophobicContact CB-CD 4.06Å; L82-K128 HydrophobicContact CB-CG 3.97Å; L82-K128 HydrophobicContact CD1-CG 4.08Å; V109-K128 CarbonylContact C-O 3.56Å; V109-K128 VanDerWaalsContact CA-O 3.28Å; V109-K128 WeakPolarHBondContact CA-O 3.39Å; K110-K128 PolarHBondContact N-O 3.25Å; K110-K128 PolarHBondContact O-N 3.48Å; K128-W139 HydrophobicContact CB-CE3 4.15Å; K128-W139 HydrophobicContact CB-CZ3 4.24Å; K128-W139 WeakPolarHBondContact CD-O 3.29Å; K128-W139 PolarHBondContact NZ-O 3.41Å; K128-S140 PolarHBondContact NZ-O 2.96Å; K128-S140 VanDerWaalsContact NZ-O 3.08Å; K128-A142 HydrophobicContact CB-CB 4.24Å; K128-A142 HydrophobicContact CD-CB 4.29Å; K128-S143 WeakPolarHBondContact CA-O 3.39Å; K128-N144 WeakPolarHBondContact CE-OD1 3.17Å
129	K	94.3	Very high	86.4	Confident	1 Å²	1	54.1 Å²	54.1	0%	0.004	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.3	173.3	-177.3	-170.7	166.4	-73.6	0	109.1	V109 N132 S143 H145 L207 D477	V109-K129 HydrophobicContact CG1-CB 4.21Å; V109-K129 HydrophobicContact CG1-CG 4.11Å; K129-N132 PolarHBondContact NZ-OD1 3.28Å; K129-S143 PolarHBondContact N-O 3.18Å; K129-S143 VanDerWaalsContact N-O 3.13Å; K129-S143 PolarHBondContact O-N 3.25Å; K129-S143 PolarHBondContact O-OG 3.02Å; K129-H145 VanDerWaalsContact CB-CD2 3.42Å; K129-H145 WeakPolarHBondContact CB-CD2 3.42Å; K129-L207 HydrophobicContact CD-CD2 4.03Å; K129-D477 IonicContact NZ-OD1 3.58Å; K129-D477 IonicContact NZ-OD2 3.8Å; K129-D477 PolarHBondContact NZ-OD2 3.15Å
130	L	88.8	Confident	86.5	Confident	22 Å²	22	54.8 Å²	54.8	12%	0.115	31%	0.305	C	S	.	.			trans	-72.2	141.6	172.8	-163.5	67	0	0	0	110	H108 N132 W139 A142	H108-L130 PolarHBondContact O-N 2.92Å; H108-L130 VanDerWaalsContact O-N 3.15Å; L130-N132 PolarHBondContact O-N 3.12Å; L130-W139 HydrophobicContact CB-CH2 3.79Å; L130-W139 HydrophobicContact CB-CZ2 4Å; L130-W139 HydrophobicContact CB-CZ3 4.1Å; L130-W139 HydrophobicContact CD2-CZ2 4.44Å; L130-A142 HydrophobicContact CD1-CB 4.45Å
131	S	83.3	Confident	86.4	Confident	48 Å²	48	58.9 Å²	58.9	34%	0.336	31%	0.312	S	S	.	.			trans	-66.1	128.3	172.2	173.9	0	0	0	0	109.8	F133 S134	S131-F133 PolarHBondContact O-N 2.86Å; S131-F133 VanDerWaalsContact O-N 3.1Å; S131-F133 PolarHBondContact OG-N 3.28Å; S131-S134 PolarHBondContact O-N 3.12Å
132	N	75	Confident	86.2	Confident	71 Å²	71	53.6 Å²	53.6	38%	0.38	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-14.6	176.9	-63.6	33.4	0	0	0	112.5	D105 I106 K129 L130	D105-N132 PolarHBondContact OD2-ND2 3.15Å; I106-N132 PolarHBondContact O-ND2 2.99Å; K129-N132 PolarHBondContact NZ-OD1 3.28Å; L130-N132 PolarHBondContact O-N 3.12Å
133	F	72.6	Confident	86	Confident	143 Å²	143	53.5 Å²	53.5	63%	0.627	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-9.5	177.7	-56.8	-78.6	0	0	0	112.9	S131 H135 N476	S131-F133 PolarHBondContact O-N 2.86Å; S131-F133 VanDerWaalsContact O-N 3.1Å; S131-F133 PolarHBondContact OG-N 3.28Å; F133-H135 PolarHBondContact O-N 2.75Å; F133-N476 VanDerWaalsContact CE2-O 3.23Å; F133-N476 WeakPolarHBondContact CE2-O 3.23Å
134	S	68.4	Low	85.9	Confident	49 Å²	49	53 Å²	53	34%	0.343	29%	0.292	S	S	.	.			trans	-79.8	118	174.3	-175.8	0	0	0	0	109	S131 C136	S131-S134 PolarHBondContact O-N 3.12Å; S134-C136 PolarHBondContact O-N 3.23Å; S134-C136 PolarHBondContact OG-N 3.24Å; S134-C136 VanDerWaalsContact OG-N 3.11Å; S134-C136 PolarHBondContact OG-O 2.8Å
135	H	69.8	Low	85.9	Confident	200 Å²	200	52.5 Å²	52.5	93%	0.926	29%	0.288	S	S	*	.	S	Bend	trans	-76.2	-0.6	166.1	-62.6	-62.4	0	0	0	112.5	F133	F133-H135 PolarHBondContact O-N 2.75Å
136	C	71.4	Confident	85.9	Confident	75 Å²	75	52.9 Å²	52.9	51%	0.507	29%	0.29	S	S	.	.	S	Bend	trans	-107.2	128.6	178.9	-168.2	0	0	0	0	110.1	S134 D138	S134-C136 PolarHBondContact O-N 3.23Å; S134-C136 PolarHBondContact OG-N 3.24Å; S134-C136 VanDerWaalsContact OG-N 3.11Å; S134-C136 PolarHBondContact OG-O 2.8Å; C136-D138 HydrophobicContact CB-CB 4.45Å; C136-D138 PolarHBondContact O-N 3.2Å
137	S	80.4	Confident	85.9	Confident	87 Å²	87	51.8 Å²	51.8	61%	0.608	29%	0.286	S	S	*	.			trans	-74.9	39.1	172.5	-54.7	0	0	0	0	112.5	W139	S137-W139 VanDerWaalsContact O-CD1 3.22Å; S137-W139 PolarHBondContact O-N 2.99Å
138	D	85.3	Confident	85.9	Confident	59 Å²	59	52.5 Å²	52.5	32%	0.316	29%	0.289	S	S	.	.			trans	-80.6	85.4	-178.8	-173.8	1.8	0	0	0	110.9	C136 S140 H141 A142	C136-D138 HydrophobicContact CB-CB 4.45Å; C136-D138 PolarHBondContact O-N 3.2Å; D138-S140 PolarHBondContact O-N 3.14Å; D138-S140 WeakPolarHBondContact OD1-CB 3.38Å; D138-S140 PolarHBondContact OD1-N 3.1Å; D138-S140 VanDerWaalsContact OD1-N 3.12Å; D138-S140 PolarHBondContact OD1-OG 3.15Å; D138-H141 IonicContact OD1-ND1 3Å; D138-H141 IonicContact OD2-CE1 3.86Å; D138-H141 IonicContact OD2-CG 3.45Å; D138-H141 IonicContact OD2-ND1 2.71Å; D138-H141 PolarHBondContact OD2-ND1 3.19Å; D138-A142 PolarHBondContact O-N 3.3Å
139	W	88.8	Confident	86	Confident	18 Å²	18	56.4 Å²	56.4	7%	0.068	30%	0.304	C	S	.	.			trans	-69.4	-17	177.2	-71.8	102.1	0	0	0	113.8	Q83 E87 H108 K110 K128 L130 S137 H141 A142	Q83-W139 HydrophobicContact CB-CB 3.7Å; E87-W139 HydrophobicContact CB-CZ2 4.36Å; E87-W139 HydrophobicContact CG-CH2 4.41Å; E87-W139 HydrophobicContact CG-CZ2 3.71Å; E87-W139 PolarHBondContact OE2-NE1 3.28Å; H108-W139 HydrophobicContact CB-CH2 4.15Å; H108-W139 HydrophobicContact CB-CZ2 4.17Å; H108-W139 WeakPolarHBondContact O-CH2 3.5Å; K110-W139 HydrophobicContact CB-CE3 4.39Å; K110-W139 HydrophobicContact CB-CZ3 4.15Å; K110-W139 HydrophobicContact CD-CD2 3.7Å; K110-W139 HydrophobicContact CD-CE3 3.76Å; K110-W139 HydrophobicContact CD-CG 4.07Å; K110-W139 HydrophobicContact CD-CZ2 4.49Å; K110-W139 HydrophobicContact CD-CZ3 4.17Å; K110-W139 VanDerWaalsContact CE-CE2 3.48Å; K110-W139 HydrophobicContact CG-CD2 4.15Å; K110-W139 HydrophobicContact CG-CE3 3.88Å; K110-W139 HydrophobicContact CG-CH2 3.91Å; K110-W139 HydrophobicContact CG-CZ2 4.21Å; K110-W139 HydrophobicContact CG-CZ3 3.75Å; K128-W139 HydrophobicContact CB-CE3 4.15Å; K128-W139 HydrophobicContact CB-CZ3 4.24Å; K128-W139 WeakPolarHBondContact CD-O 3.29Å; K128-W139 PolarHBondContact NZ-O 3.41Å; L130-W139 HydrophobicContact CB-CH2 3.79Å; L130-W139 HydrophobicContact CB-CZ2 4Å; L130-W139 HydrophobicContact CB-CZ3 4.1Å; L130-W139 HydrophobicContact CD2-CZ2 4.44Å; S137-W139 VanDerWaalsContact O-CD1 3.22Å; S137-W139 PolarHBondContact O-N 2.99Å; W139-H141 VanDerWaalsContact C-N 3.35Å; W139-A142 HydrophobicContact CE3-CB 3.97Å; W139-A142 PolarHBondContact O-N 2.94Å
140	S	85.3	Confident	86.1	Confident	60 Å²	60	57.7 Å²	57.7	42%	0.42	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-40.2	177.9	70.5	0	0	0	0	110.9	K128 D138	K128-S140 PolarHBondContact NZ-O 2.96Å; K128-S140 VanDerWaalsContact NZ-O 3.08Å; D138-S140 PolarHBondContact O-N 3.14Å; D138-S140 WeakPolarHBondContact OD1-CB 3.38Å; D138-S140 PolarHBondContact OD1-N 3.1Å; D138-S140 VanDerWaalsContact OD1-N 3.12Å; D138-S140 PolarHBondContact OD1-OG 3.15Å
141	H	82.7	Confident	86.4	Confident	158 Å²	158	60.7 Å²	60.7	73%	0.731	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	9.2	177.9	-58.5	98.2	0	0	0	114.3	D138 W139	D138-H141 IonicContact OD1-ND1 3Å; D138-H141 IonicContact OD2-CE1 3.86Å; D138-H141 IonicContact OD2-CG 3.45Å; D138-H141 IonicContact OD2-ND1 2.71Å; D138-H141 PolarHBondContact OD2-ND1 3.19Å; W139-H141 VanDerWaalsContact C-N 3.35Å
142	A	88.9	Confident	87	Confident	12 Å²	12	66 Å²	66	10%	0.099	34%	0.343	C	S	.	.	S	Bend	trans	-67.2	149.5	175.7	0	0	0	0	0	111.4	K128 L130 D138 W139	K128-A142 HydrophobicContact CB-CB 4.24Å; K128-A142 HydrophobicContact CD-CB 4.29Å; L130-A142 HydrophobicContact CD1-CB 4.45Å; D138-A142 PolarHBondContact O-N 3.3Å; W139-A142 HydrophobicContact CE3-CB 3.97Å; W139-A142 PolarHBondContact O-N 2.94Å
143	S	90.1	Very high	87.8	Confident	41 Å²	41	71.6 Å²	71.6	29%	0.287	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	141.5	-175.8	50.6	0	0	0	0	112	K128 K129 H145	K128-S143 WeakPolarHBondContact CA-O 3.39Å; K129-S143 PolarHBondContact N-O 3.18Å; K129-S143 VanDerWaalsContact N-O 3.13Å; K129-S143 PolarHBondContact O-N 3.25Å; K129-S143 PolarHBondContact O-OG 3.02Å; S143-H145 PolarHBondContact O-CD2 2.51Å; S143-H145 VanDerWaalsContact O-CD2 3.26Å; S143-H145 PolarHBondContact OG-CD2 2.79Å; S143-H145 PolarHBondContact OG-NE2 3.21Å
144	N	94.3	Very high	88.9	Confident	23 Å²	23	66.9 Å²	66.9	12%	0.123	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	132.9	173.6	-69.7	-31.2	0	0	0	111.2	D75 W77 K128 F210	D75-N144 PolarHBondContact OD1-ND2 3.45Å; W77-N144 HydrophobicContact CD2-CB 4.3Å; W77-N144 HydrophobicContact CE3-CB 3.69Å; W77-N144 HydrophobicContact CZ3-CB 3.97Å; K128-N144 WeakPolarHBondContact CE-OD1 3.17Å; N144-F210 HydrophobicContact CB-CB 3.93Å; N144-F210 PolarHBondContact O-N 3.28Å
145	H	96.4	Very high	90.2	Very high	6 Å²	6	70.9 Å²	70.9	3%	0.028	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	150.4	-178	-74.1	-86.7	0	0	0	111.5	W77 A127 K129 S143 L207 E208 H209	W77-H145 VanDerWaalsContact CH2-O 3.27Å; W77-H145 WeakPolarHBondContact CH2-O 3.32Å; W77-H145 WeakPolarHBondContact CZ3-O 3.31Å; A127-H145 HydrophobicContact CB-CB 4.3Å; A127-H145 PolarHBondContact N-O 2.92Å; A127-H145 PolarHBondContact O-N 3.48Å; A127-H145 VanDerWaalsContact O-O 3.08Å; K129-H145 VanDerWaalsContact CB-CD2 3.42Å; K129-H145 WeakPolarHBondContact CB-CD2 3.42Å; S143-H145 PolarHBondContact O-CD2 2.51Å; S143-H145 VanDerWaalsContact O-CD2 3.26Å; S143-H145 PolarHBondContact OG-CD2 2.79Å; S143-H145 PolarHBondContact OG-NE2 3.21Å; H145-L207 HydrophobicContact CB-CD1 3.55Å; H145-L207 HydrophobicContact CB-CG 4.04Å; H145-E208 CarbonylContact C-O 3.58Å; H145-E208 WeakPolarHBondContact CA-O 3.45Å; H145-E208 VanDerWaalsContact CB-O 3.25Å; H145-E208 WeakPolarHBondContact CB-O 3.23Å; H145-E208 PolarHBondContact ND1-O 2.82Å; H145-H209 AromaticContact CE1-CD2 3.41Å; H145-H209 PolarHBondContact CE1-CD2 2.59Å; H145-H209 VanDerWaalsContact CE1-CD2 3.41Å; H145-H209 AromaticContact CE1-CE1 3.52Å; H145-H209 AromaticContact CE1-CG 3.66Å; H145-H209 AromaticContact CE1-ND1 3.7Å; H145-H209 AromaticContact CE1-NE2 3.34Å; H145-H209 PolarHBondContact CE1-NE2 3.16Å; H145-H209 VanDerWaalsContact CE1-NE2 3.34Å; H145-H209 AromaticContact NE2-CD2 3.82Å; H145-H209 AromaticContact NE2-NE2 3.72Å
146	V	96.9	Very high	91.4	Very high	12 Å²	12	66.5 Å²	66.5	7%	0.073	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	121.8	167.9	-179.2	0	0	0	0	107.3	W77 F116 C124 F125 K148 E208 F210	W77-V146 HydrophobicContact CH2-CG2 3.87Å; W77-V146 HydrophobicContact CZ2-CG2 4.29Å; F116-V146 HydrophobicContact CE1-CG1 4.25Å; F116-V146 HydrophobicContact CE1-CG2 4.47Å; F116-V146 HydrophobicContact CZ-CG1 4.47Å; F116-V146 HydrophobicContact CZ-CG2 4.3Å; C124-V146 HydrophobicContact CB-CG1 3.82Å; F125-V146 WeakPolarHBondContact O-CA 3.42Å; V146-K148 HydrophobicContact CG1-CG 4.01Å; V146-E208 HydrophobicContact CB-CG 4.29Å; V146-E208 PolarHBondContact N-O 3.05Å; V146-E208 PolarHBondContact O-N 2.94Å; V146-F210 HydrophobicContact CG2-CB 4.32Å; V146-F210 HydrophobicContact CG2-CD2 4.06Å
147	A	98.2	Very high	92.6	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	131.3	169.2	0	0	0	0	0	108.9	I111 C124 F125 A127 Y205 H206 L207	I111-A147 HydrophobicContact CD1-CB 3.48Å; I111-A147 VanDerWaalsContact CD1-CB 3.48Å; I111-A147 HydrophobicContact CG1-CB 4.4Å; C124-A147 CarbonylContact C-O 3.42Å; C124-A147 WeakPolarHBondContact CA-O 3.39Å; F125-A147 HydrophobicContact CB-CB 4.31Å; F125-A147 WeakPolarHBondContact CD2-O 3.37Å; F125-A147 PolarHBondContact N-O 3.47Å; F125-A147 PolarHBondContact O-N 2.81Å; A127-A147 HydrophobicContact CB-CB 4.47Å; A147-Y205 HydrophobicContact CB-CD1 4Å; A147-H206 CarbonylContact C-O 3.6Å; A147-H206 VanDerWaalsContact CA-O 3.22Å; A147-H206 WeakPolarHBondContact CA-O 3.44Å; A147-L207 HydrophobicContact CB-CD1 4.14Å
148	K	97.4	Very high	93.3	Very high	16 Å²	16	65.2 Å²	65.2	7%	0.07	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	136.5	-178.2	-59.4	178.1	167.6	168.1	0	111.1	R122 E123 V146 Y205 H206 E208 D262	R122-K148 HydrophobicContact CB-CB 4.46Å; E123-K148 CarbonylContact O-C 3.43Å; E123-K148 WeakPolarHBondContact O-CA 3.47Å; V146-K148 HydrophobicContact CG1-CG 4.01Å; K148-Y205 CarbonylContact O-C 3.56Å; K148-Y205 WeakPolarHBondContact O-CA 3.37Å; K148-H206 HydrophobicContact CB-CB 4.24Å; K148-H206 PolarHBondContact N-O 2.83Å; K148-H206 PolarHBondContact O-N 2.78Å; K148-E208 WeakPolarHBondContact CE-OE1 3.38Å; K148-E208 IonicContact NZ-OE1 3.95Å; K148-E208 PolarHBondContact NZ-OE1 3.18Å; K148-D262 IonicContact NZ-OD1 3.15Å; K148-D262 IonicContact NZ-OD2 3.94Å; K148-D262 PolarHBondContact NZ-OD2 3.5Å
149	R	96.8	Very high	93.9	Very high	84 Å²	84	63.1 Å²	63.1	32%	0.317	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.8	175.4	-173.3	178.7	61.3	-177.2	2.7	109.5	R122 E123 F125 Y159 Y205	R122-R149 CarbonylContact C-O 3.58Å; R122-R149 WeakPolarHBondContact CA-O 3.44Å; R122-R149 WeakPolarHBondContact CB-O 3.46Å; E123-R149 HydrophobicContact CG-CB 4.37Å; E123-R149 WeakPolarHBondContact CG-O 3.36Å; E123-R149 PolarHBondContact N-O 3.3Å; E123-R149 PolarHBondContact O-N 2.91Å; E123-R149 IonicContact OE1-CZ 3.71Å; E123-R149 IonicContact OE1-NE 3.25Å; E123-R149 PolarHBondContact OE1-NE 3.18Å; E123-R149 IonicContact OE1-NH2 2.71Å; E123-R149 PolarHBondContact OE1-NH2 2.91Å; F125-R149 HydrophobicContact CE2-CB 4.13Å; R149-Y159 VanDerWaalsContact CG-OH 3.31Å; R149-Y159 WeakPolarHBondContact CG-OH 3.4Å; R149-Y205 HydrophobicContact CB-CD1 3.78Å; R149-Y205 HydrophobicContact CB-CE1 3.68Å; R149-Y205 HydrophobicContact CB-CG 4.46Å; R149-Y205 HydrophobicContact CG-CE1 4.36Å; R149-Y205 PolarHBondContact NH1-OH 3.07Å
150	Y	97.5	Very high	94.3	Very high	27 Å²	27	64.5 Å²	64.5	11%	0.106	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	137.5	171.4	-80.3	-83.6	0	0	0	111.1	M121 R122 E152 V154 V158 Y159 D162 H206	M121-Y150 HydrophobicContact CB-CD1 4.27Å; M121-Y150 HydrophobicContact CB-CE1 4.16Å; M121-Y150 WeakPolarHBondContact O-CA 3.47Å; R122-Y150 HydrophobicContact CG-CD1 3.82Å; R122-Y150 HydrophobicContact CG-CD2 4.31Å; R122-Y150 HydrophobicContact CG-CE1 4Å; R122-Y150 HydrophobicContact CG-CE2 4.48Å; R122-Y150 HydrophobicContact CG-CG 3.99Å; Y150-E152 VanDerWaalsContact C-N 3.33Å; Y150-E152 WeakPolarHBondContact CB-O 3.18Å; Y150-V154 HydrophobicContact CD1-CG1 3.97Å; Y150-V154 HydrophobicContact CD1-CG2 4.44Å; Y150-V154 HydrophobicContact CD2-CG1 4.41Å; Y150-V154 HydrophobicContact CD2-CG2 3.4Å; Y150-V154 HydrophobicContact CE1-CG1 4.43Å; Y150-V154 HydrophobicContact CE2-CG2 3.92Å; Y150-V154 HydrophobicContact CG-CG1 3.95Å; Y150-V154 HydrophobicContact CG-CG2 3.7Å; Y150-V158 HydrophobicContact CE2-CG1 3.86Å; Y150-V158 WeakPolarHBondContact OH-CG1 3.24Å; Y150-Y159 HydrophobicContact CD2-CD2 4.27Å; Y150-Y159 HydrophobicContact CD2-CE1 4.04Å; Y150-Y159 AromaticContact CD2-CE2 3.76Å; Y150-Y159 HydrophobicContact CD2-CE2 3.76Å; Y150-Y159 AromaticContact CD2-CZ 3.65Å; Y150-Y159 HydrophobicContact CE2-CE2 4.43Å; Y150-Y159 PolarHBondContact N-OH 2.96Å; Y150-D162 WeakPolarHBondContact CE2-OD2 3.49Å; Y150-D162 VanDerWaalsContact CZ-OD2 3.31Å; Y150-D162 VanDerWaalsContact OH-CG 3.31Å; Y150-D162 PolarHBondContact OH-OD1 2.9Å; Y150-D162 PolarHBondContact OH-OD2 2.67Å; Y150-H206 AromaticContact CE2-CE1 3.97Å
151	I	95.5	Very high	94.8	Very high	86 Å²	86	64.7 Å²	64.7	44%	0.441	31%	0.314	S	S	.	.	S	Bend	trans	-66.2	-41.8	177.3	-64.3	168.7	0	0	0	109.4	M121 E123	M121-I151 PolarHBondContact O-N 2.9Å; E123-I151 HydrophobicContact CB-CG1 4.33Å; E123-I151 HydrophobicContact CG-CG1 4.29Å
152	E	94.8	Very high	95.5	Very high	158 Å²	158	58.8 Å²	58.8	74%	0.738	29%	0.287	S	S	*	.	S	Bend	trans	-99.2	152.5	174.3	-64.2	-174.9	176.9	0	0	111.2	Y150 V154	Y150-E152 VanDerWaalsContact C-N 3.33Å; Y150-E152 WeakPolarHBondContact CB-O 3.18Å; E152-V154 PolarHBondContact O-N 2.97Å
153	K	92.9	Very high	95.9	Very high	189 Å²	189	58.2 Å²	58.2	82%	0.822	28%	0.283	S	S	*	.			trans	-70.2	116.2	179.6	-173.6	170.1	-177.4	162.7	0	109.8	E201	K153-E201 IonicContact NZ-OE2 2.58Å
154	V	94.9	Very high	96.3	Very high	45 Å²	45	61.9 Å²	61.9	27%	0.273	29%	0.29	S	S	.	.			trans	-110.1	163.4	174.2	-59	0	0	0	0	111	Y150 E152 V158 Y159	Y150-V154 HydrophobicContact CD1-CG1 3.97Å; Y150-V154 HydrophobicContact CD1-CG2 4.44Å; Y150-V154 HydrophobicContact CD2-CG1 4.41Å; Y150-V154 HydrophobicContact CD2-CG2 3.4Å; Y150-V154 HydrophobicContact CE1-CG1 4.43Å; Y150-V154 HydrophobicContact CE2-CG2 3.92Å; Y150-V154 HydrophobicContact CG-CG1 3.95Å; Y150-V154 HydrophobicContact CG-CG2 3.7Å; E152-V154 PolarHBondContact O-N 2.97Å; V154-V158 HydrophobicContact CB-CB 4.38Å; V154-V158 HydrophobicContact CB-CG2 4.33Å; V154-V158 HydrophobicContact CG2-CB 4.13Å; V154-V158 HydrophobicContact CG2-CG1 4.33Å; V154-Y159 HydrophobicContact CG2-CD2 4.04Å; V154-Y159 HydrophobicContact CG2-CE2 3.59Å
155	E	95.6	Very high	96.4	Very high	133 Å²	133	61 Å²	61	62%	0.621	29%	0.286	S	S	*	.			trans	-66.1	147.9	172.6	-63.7	-168.9	-172.7	0	0	111.6	H157 V158	E155-H157 PolarHBondContact O-N 3.47Å; E155-H157 VanDerWaalsContact O-N 3.16Å; E155-H157 IonicContact OE2-CD2 3.05Å; E155-H157 PolarHBondContact OE2-CD2 2.93Å; E155-H157 VanDerWaalsContact OE2-CD2 3.24Å; E155-H157 IonicContact OE2-NE2 3.84Å; E155-H157 PolarHBondContact OE2-NE2 3.4Å; E155-V158 HydrophobicContact CB-CG2 4.46Å; E155-V158 WeakPolarHBondContact O-CB 3.5Å; E155-V158 WeakPolarHBondContact O-CG2 3.12Å; E155-V158 PolarHBondContact O-N 3.22Å; E155-V158 VanDerWaalsContact O-N 3.14Å
156	N	96	Very high	96.5	Very high	108 Å²	108	61 Å²	61	58%	0.578	29%	0.286	S	S	*	.	H	α-helix	trans	-57.6	-35.9	-175.6	-75.8	-5.3	0	0	0	112.9	V158 Y159 F160 L204	N156-V158 PolarHBondContact O-N 3.2Å; N156-Y159 PolarHBondContact O-N 3.02Å; N156-F160 VanDerWaalsContact O-CD2 3.29Å; N156-F160 WeakPolarHBondContact O-CD2 3.45Å; N156-L204 HydrophobicContact CB-CD1 3.86Å
157	H	95.5	Very high	96.5	Very high	99 Å²	99	61.5 Å²	61.5	46%	0.458	29%	0.287	S	S	.	.	H	α-helix	trans	-61.6	-29.6	-177.1	78.8	80.5	0	0	0	112.6	E155 Y159 F160 D161	E155-H157 PolarHBondContact O-N 3.47Å; E155-H157 VanDerWaalsContact O-N 3.16Å; E155-H157 IonicContact OE2-CD2 3.05Å; E155-H157 PolarHBondContact OE2-CD2 2.93Å; E155-H157 VanDerWaalsContact OE2-CD2 3.24Å; E155-H157 IonicContact OE2-NE2 3.84Å; E155-H157 PolarHBondContact OE2-NE2 3.4Å; H157-Y159 VanDerWaalsContact C-N 3.27Å; H157-Y159 PolarHBondContact O-N 2.94Å; H157-F160 WeakPolarHBondContact O-CA 3.25Å; H157-F160 WeakPolarHBondContact O-CB 3.49Å; H157-F160 PolarHBondContact O-N 2.94Å; H157-D161 IonicContact CE1-OD2 2.97Å; H157-D161 IonicContact CG-OD2 3.44Å; H157-D161 IonicContact ND1-OD2 3.04Å; H157-D161 PolarHBondContact ND1-OD2 3.5Å; H157-D161 PolarHBondContact O-N 2.88Å
158	V	95.9	Very high	96.4	Very high	35 Å²	35	62.2 Å²	62.2	21%	0.212	29%	0.291	C	S	.	.	H	α-helix	trans	-57.8	-41.4	179.1	179.6	0	0	0	0	110.9	Y150 V154 E155 N156 F160 D161 D162	Y150-V158 HydrophobicContact CE2-CG1 3.86Å; Y150-V158 WeakPolarHBondContact OH-CG1 3.24Å; V154-V158 HydrophobicContact CB-CB 4.38Å; V154-V158 HydrophobicContact CB-CG2 4.33Å; V154-V158 HydrophobicContact CG2-CB 4.13Å; V154-V158 HydrophobicContact CG2-CG1 4.33Å; E155-V158 HydrophobicContact CB-CG2 4.46Å; E155-V158 WeakPolarHBondContact O-CB 3.5Å; E155-V158 WeakPolarHBondContact O-CG2 3.12Å; E155-V158 PolarHBondContact O-N 3.22Å; E155-V158 VanDerWaalsContact O-N 3.14Å; N156-V158 PolarHBondContact O-N 3.2Å; V158-F160 VanDerWaalsContact C-N 3.27Å; V158-F160 PolarHBondContact O-N 3Å; V158-D161 PolarHBondContact O-N 2.79Å; V158-D162 VanDerWaalsContact O-CG 3.28Å; V158-D162 PolarHBondContact O-N 2.88Å
159	Y	97.7	Very high	96.4	Very high	15 Å²	15	61.5 Å²	61.5	6%	0.059	29%	0.288	C	S	.	.	H	α-helix	trans	-59.5	-38.5	176.2	-77.6	-97	0	0	0	112.6	R149 Y150 V154 N156 H157 V163 L204 H206	R149-Y159 VanDerWaalsContact CG-OH 3.31Å; R149-Y159 WeakPolarHBondContact CG-OH 3.4Å; Y150-Y159 HydrophobicContact CD2-CD2 4.27Å; Y150-Y159 HydrophobicContact CD2-CE1 4.04Å; Y150-Y159 AromaticContact CD2-CE2 3.76Å; Y150-Y159 HydrophobicContact CD2-CE2 3.76Å; Y150-Y159 AromaticContact CD2-CZ 3.65Å; Y150-Y159 HydrophobicContact CE2-CE2 4.43Å; Y150-Y159 PolarHBondContact N-OH 2.96Å; V154-Y159 HydrophobicContact CG2-CD2 4.04Å; V154-Y159 HydrophobicContact CG2-CE2 3.59Å; N156-Y159 PolarHBondContact O-N 3.02Å; H157-Y159 VanDerWaalsContact C-N 3.27Å; H157-Y159 PolarHBondContact O-N 2.94Å; Y159-V163 WeakPolarHBondContact O-CG2 3.46Å; Y159-V163 PolarHBondContact O-N 3.45Å; Y159-L204 HydrophobicContact CD1-CB 3.81Å; Y159-L204 HydrophobicContact CD2-CB 3.98Å; Y159-L204 HydrophobicContact CD2-CD1 4.07Å; Y159-L204 HydrophobicContact CE1-CB 3.88Å; Y159-L204 WeakPolarHBondContact CE1-O 3.44Å; Y159-L204 HydrophobicContact CE2-CB 4.06Å; Y159-L204 HydrophobicContact CG-CB 3.84Å; Y159-L204 HydrophobicContact CG-CD1 4.15Å; Y159-L204 VanDerWaalsContact CZ-O 3.3Å; Y159-L204 PolarHBondContact OH-O 2.96Å; Y159-L204 VanDerWaalsContact OH-O 3.12Å; Y159-H206 WeakPolarHBondContact CA-NE2 3.42Å; Y159-H206 AromaticContact CD1-CD2 3.98Å; Y159-H206 AromaticContact CD1-CE1 3.71Å; Y159-H206 AromaticContact CD1-NE2 3.63Å; Y159-H206 PolarHBondContact O-NE2 2.78Å
160	F	97.7	Very high	96.4	Very high	47 Å²	47	58 Å²	58	21%	0.206	28%	0.275	C	S	.	.	H	α-helix	trans	-75.3	-38.2	179.6	-68.5	-96.6	0	0	0	111.3	Y93 W102 N156 H157 V158 V163 R164 V193 L204	Y93-F160 AromaticContact CD1-CE1 3.87Å; Y93-F160 HydrophobicContact CD1-CE1 3.87Å; Y93-F160 HydrophobicContact CD1-CZ 4.36Å; Y93-F160 HydrophobicContact CD2-CE1 4.13Å; Y93-F160 HydrophobicContact CD2-CZ 4.09Å; Y93-F160 HydrophobicContact CE1-CE1 4.41Å; Y93-F160 HydrophobicContact CE2-CZ 4.31Å; Y93-F160 AromaticContact CG-CE1 3.69Å; Y93-F160 HydrophobicContact CG-CE1 3.69Å; Y93-F160 HydrophobicContact CG-CZ 4.12Å; W102-F160 HydrophobicContact CD2-CD1 4.2Å; W102-F160 HydrophobicContact CE3-CD1 4.05Å; W102-F160 HydrophobicContact CE3-CE1 4.45Å; W102-F160 HydrophobicContact CH2-CB 3.87Å; W102-F160 AromaticContact CH2-CD1 3.53Å; W102-F160 HydrophobicContact CH2-CD1 3.53Å; W102-F160 HydrophobicContact CH2-CG 4.12Å; W102-F160 WeakPolarHBondContact CH2-O 3.38Å; W102-F160 HydrophobicContact CZ2-CB 3.69Å; W102-F160 AromaticContact CZ2-CD1 3.73Å; W102-F160 HydrophobicContact CZ2-CD1 3.73Å; W102-F160 HydrophobicContact CZ2-CG 4.2Å; W102-F160 WeakPolarHBondContact CZ2-O 3.32Å; W102-F160 AromaticContact CZ3-CD1 3.71Å; W102-F160 HydrophobicContact CZ3-CD1 3.71Å; W102-F160 HydrophobicContact CZ3-CE1 4.3Å; N156-F160 VanDerWaalsContact O-CD2 3.29Å; N156-F160 WeakPolarHBondContact O-CD2 3.45Å; H157-F160 WeakPolarHBondContact O-CA 3.25Å; H157-F160 WeakPolarHBondContact O-CB 3.49Å; H157-F160 PolarHBondContact O-N 2.94Å; V158-F160 VanDerWaalsContact C-N 3.27Å; V158-F160 PolarHBondContact O-N 3Å; F160-V163 PolarHBondContact O-N 3.07Å; F160-R164 WeakPolarHBondContact O-CB 3.3Å; F160-R164 PolarHBondContact O-N 2.83Å; F160-V193 HydrophobicContact CD1-CG2 4.21Å; F160-V193 HydrophobicContact CE1-CG2 4.36Å; F160-V193 HydrophobicContact CE2-CG1 4.42Å; F160-V193 HydrophobicContact CG-CG2 4.31Å; F160-V193 HydrophobicContact CZ-CG1 4.31Å; F160-L204 HydrophobicContact CE2-CD1 3.95Å
161	D	95.9	Very high	96.2	Very high	64 Å²	64	57.2 Å²	57.2	34%	0.342	27%	0.273	S	S	.	.	H	α-helix	trans	-63.9	-40.2	177.4	-70.1	-33.3	0	0	0	111.8	H157 V158 R164 L165	H157-D161 IonicContact CE1-OD2 2.97Å; H157-D161 IonicContact CG-OD2 3.44Å; H157-D161 IonicContact ND1-OD2 3.04Å; H157-D161 PolarHBondContact ND1-OD2 3.5Å; H157-D161 PolarHBondContact O-N 2.88Å; V158-D161 PolarHBondContact O-N 2.79Å; D161-R164 WeakPolarHBondContact O-CB 3.44Å; D161-R164 PolarHBondContact O-N 2.76Å; D161-L165 WeakPolarHBondContact O-CB 3.35Å; D161-L165 PolarHBondContact O-N 3.5Å
162	D	96.8	Very high	96.2	Very high	34 Å²	34	54 Å²	54	18%	0.182	26%	0.255	C	S	.	.	H	α-helix	trans	-63.8	-43	175.3	-66.2	-30.5	0	0	0	112.5	Y150 V158 R164 L165 Q166 H206	Y150-D162 WeakPolarHBondContact CE2-OD2 3.49Å; Y150-D162 VanDerWaalsContact CZ-OD2 3.31Å; Y150-D162 VanDerWaalsContact OH-CG 3.31Å; Y150-D162 PolarHBondContact OH-OD1 2.9Å; Y150-D162 PolarHBondContact OH-OD2 2.67Å; V158-D162 VanDerWaalsContact O-CG 3.28Å; V158-D162 PolarHBondContact O-N 2.88Å; D162-R164 VanDerWaalsContact C-N 3.33Å; D162-L165 WeakPolarHBondContact O-CB 3.41Å; D162-L165 PolarHBondContact O-N 3.43Å; D162-Q166 WeakPolarHBondContact O-CB 3.39Å; D162-Q166 PolarHBondContact O-N 3.42Å; D162-H206 IonicContact OD2-CE1 3.41Å; D162-H206 PolarHBondContact OD2-CE1 3.26Å; D162-H206 IonicContact OD2-NE2 2.86Å
163	V	97.9	Very high	96.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.2	-41.5	176.5	167.4	0	0	0	0	110	W102 Y159 F160 Q166 M167 T191 V193	W102-V163 HydrophobicContact CH2-CB 3.86Å; W102-V163 HydrophobicContact CH2-CG1 3.65Å; W102-V163 HydrophobicContact CZ3-CB 4.47Å; W102-V163 HydrophobicContact CZ3-CG1 3.9Å; Y159-V163 WeakPolarHBondContact O-CG2 3.46Å; Y159-V163 PolarHBondContact O-N 3.45Å; F160-V163 PolarHBondContact O-N 3.07Å; V163-Q166 PolarHBondContact O-N 3.3Å; V163-M167 HydrophobicContact CG1-CG 4.18Å; V163-M167 VanDerWaalsContact O-CB 3.25Å; V163-M167 WeakPolarHBondContact O-CB 3.14Å; V163-M167 WeakPolarHBondContact O-CG 3.1Å; V163-M167 PolarHBondContact O-N 3.42Å; V163-T191 HydrophobicContact CB-CG2 4.27Å; V163-T191 HydrophobicContact CG1-CG2 4.3Å; V163-T191 HydrophobicContact CG2-CG2 3.95Å; V163-V193 HydrophobicContact CB-CG2 4.4Å; V163-V193 HydrophobicContact CG2-CG2 3.7Å
164	R	97.4	Very high	96.2	Very high	118 Å²	118	39.1 Å²	39.1	45%	0.445	19%	0.189	S	C	.	.	H	α-helix	trans	-58.4	-49	173.8	176.6	176	-173.6	171.8	4.4	111	Y95 F160 D161 D162 M167 D168	Y95-R164 HydrophobicContact CD1-CB 4.28Å; Y95-R164 HydrophobicContact CD1-CG 4.27Å; Y95-R164 HydrophobicContact CE1-CB 4.21Å; Y95-R164 HydrophobicContact CE1-CG 3.7Å; Y95-R164 HydrophobicContact CE2-CG 4.44Å; F160-R164 WeakPolarHBondContact O-CB 3.3Å; F160-R164 PolarHBondContact O-N 2.83Å; D161-R164 WeakPolarHBondContact O-CB 3.44Å; D161-R164 PolarHBondContact O-N 2.76Å; D162-R164 VanDerWaalsContact C-N 3.33Å; R164-M167 PolarHBondContact O-N 3.05Å; R164-D168 WeakPolarHBondContact O-CB 3.47Å; R164-D168 VanDerWaalsContact O-CG 3.29Å; R164-D168 PolarHBondContact O-N 3.09Å
165	L	97.2	Very high	95.9	Very high	5 Å²	5	37.2 Å²	37.2	3%	0.026	18%	0.177	C	C	.	.	H	α-helix	trans	-54.7	-56.6	177.2	-171	173.7	0	0	0	110.9	D161 D162 M167 D168 A169 P263 I265 Y273	D161-L165 WeakPolarHBondContact O-CB 3.35Å; D161-L165 PolarHBondContact O-N 3.5Å; D162-L165 WeakPolarHBondContact O-CB 3.41Å; D162-L165 PolarHBondContact O-N 3.43Å; L165-M167 VanDerWaalsContact C-N 3.31Å; L165-M167 PolarHBondContact O-N 3.34Å; L165-D168 PolarHBondContact O-N 3.04Å; L165-A169 WeakPolarHBondContact O-CB 3.45Å; L165-A169 PolarHBondContact O-N 3.42Å; L165-P263 HydrophobicContact CD2-CG 4.04Å; L165-P263 WeakPolarHBondContact CD2-O 3.09Å; L165-I265 HydrophobicContact CD2-CD1 4.14Å; L165-I265 HydrophobicContact CD2-CG1 3.87Å; L165-I265 HydrophobicContact CG-CD1 4.3Å; L165-I265 HydrophobicContact CG-CG1 4.2Å; L165-Y273 HydrophobicContact CB-CD1 3.73Å; L165-Y273 HydrophobicContact CB-CE1 4.41Å; L165-Y273 HydrophobicContact CD1-CD1 4.36Å; L165-Y273 HydrophobicContact CD1-CG 4.47Å; L165-Y273 HydrophobicContact CG-CD1 3.69Å; L165-Y273 HydrophobicContact CG-CG 4.16Å
166	Q	97.8	Very high	95.8	Very high	7 Å²	7	31 Å²	31	3%	0.033	15%	0.147	C	C	.	.	H	α-helix	trans	-63.8	-37.1	-175.6	-179	164.4	-28.8	0	0	112.2	D162 V163 A169 K170 I188 S189 T191 T261 P263	D162-Q166 WeakPolarHBondContact O-CB 3.39Å; D162-Q166 PolarHBondContact O-N 3.42Å; V163-Q166 PolarHBondContact O-N 3.3Å; Q166-A169 PolarHBondContact O-N 2.89Å; Q166-K170 PolarHBondContact O-N 3.22Å; Q166-I188 HydrophobicContact CG-CG2 3.68Å; Q166-S189 PolarHBondContact NE2-O 3.5Å; Q166-T191 HydrophobicContact CB-CG2 3.74Å; Q166-T191 VanDerWaalsContact CD-CG2 3.44Å; Q166-T191 HydrophobicContact CG-CG2 3.76Å; Q166-T261 PolarHBondContact NE2-OG1 2.86Å; Q166-T261 VanDerWaalsContact NE2-OG1 3.16Å; Q166-P263 HydrophobicContact CB-CG 4.45Å; Q166-P263 HydrophobicContact CG-CG 4.35Å
167	M	97.5	Very high	95.6	Very high	21 Å²	21	26.8 Å²	26.8	10%	0.103	13%	0.127	C	C	.	.	H	α-helix	trans	-73.4	-33.3	177.3	-67.8	-53.8	-56.2	0	0	112.9	Y95 A97 V163 R164 L165 K170 L171 Q190	Y95-M167 HydrophobicContact CD1-CB 3.88Å; A97-M167 HydrophobicContact CB-CB 4.31Å; V163-M167 HydrophobicContact CG1-CG 4.18Å; V163-M167 VanDerWaalsContact O-CB 3.25Å; V163-M167 WeakPolarHBondContact O-CB 3.14Å; V163-M167 WeakPolarHBondContact O-CG 3.1Å; V163-M167 PolarHBondContact O-N 3.42Å; R164-M167 PolarHBondContact O-N 3.05Å; L165-M167 VanDerWaalsContact C-N 3.31Å; L165-M167 PolarHBondContact O-N 3.34Å; M167-K170 HydrophobicContact CE-CD 3.84Å; M167-K170 WeakPolarHBondContact O-CB 3.25Å; M167-K170 PolarHBondContact O-N 3.24Å; M167-K170 HydrophobicContact SD-CD 4.41Å; M167-L171 PolarHBondContact O-N 3.16Å; M167-Q190 HydrophobicContact CE-CG 4.21Å; M167-Q190 HydrophobicContact SD-CB 4.32Å; M167-Q190 HydrophobicContact SD-CG 4.35Å
168	D	95.5	Very high	95.3	Very high	16 Å²	16	25.3 Å²	25.3	9%	0.086	12%	0.117	C	C	.	.	H	α-helix	trans	-66.2	-45.2	169.9	-75.5	-7.3	0	0	0	110.4	Y95 A97 R164 L165 K170 L171 W172 I265 Y273	Y95-D168 WeakPolarHBondContact CE1-OD1 3.37Å; A97-D168 WeakPolarHBondContact CB-OD1 3.31Å; R164-D168 WeakPolarHBondContact O-CB 3.47Å; R164-D168 VanDerWaalsContact O-CG 3.29Å; R164-D168 PolarHBondContact O-N 3.09Å; L165-D168 PolarHBondContact O-N 3.04Å; D168-K170 VanDerWaalsContact C-N 3.25Å; D168-K170 PolarHBondContact O-N 2.81Å; D168-L171 WeakPolarHBondContact O-CB 3.25Å; D168-L171 PolarHBondContact O-N 2.86Å; D168-L171 VanDerWaalsContact O-N 3.08Å; D168-W172 VanDerWaalsContact O-CD1 3.28Å; D168-W172 PolarHBondContact O-N 3.31Å; D168-I265 HydrophobicContact CB-CD1 4.3Å; D168-Y273 HydrophobicContact CB-CE1 4.34Å; D168-Y273 WeakPolarHBondContact OD2-CE1 3.41Å; D168-Y273 PolarHBondContact OD2-OH 3.28Å
169	A	97.1	Very high	94.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.7	-37.3	174.2	0	0	0	0	0	111.8	L165 Q166 L171 W172 G173 I188 V250 P263 I265	L165-A169 WeakPolarHBondContact O-CB 3.45Å; L165-A169 PolarHBondContact O-N 3.42Å; Q166-A169 PolarHBondContact O-N 2.89Å; A169-L171 VanDerWaalsContact C-N 3.31Å; A169-L171 PolarHBondContact O-N 2.83Å; A169-W172 WeakPolarHBondContact O-CA 3.37Å; A169-W172 VanDerWaalsContact O-CB 3.31Å; A169-W172 WeakPolarHBondContact O-CB 3.49Å; A169-W172 PolarHBondContact O-N 3.24Å; A169-G173 PolarHBondContact O-N 2.91Å; A169-I188 VanDerWaalsContact C-CD1 3.43Å; A169-I188 HydrophobicContact CB-CD1 3.81Å; A169-I188 VanDerWaalsContact O-CD1 3.25Å; A169-I188 WeakPolarHBondContact O-CD1 3.38Å; A169-V250 HydrophobicContact CB-CG1 3.94Å; A169-P263 HydrophobicContact CB-CB 4.09Å; A169-P263 HydrophobicContact CB-CG 3.45Å; A169-P263 VanDerWaalsContact CB-CG 3.45Å; A169-I265 HydrophobicContact CB-CD1 4.21Å
170	K	96.8	Very high	94.4	Very high	10 Å²	10	31 Å²	31	4%	0.043	15%	0.153	C	C	.	.	H	α-helix	trans	-57.2	-41.5	173.8	-177.1	-178.5	-179.1	64.4	0	112.5	Q166 M167 D168 W172 G173 E174 D187 I188 Q190	Q166-K170 PolarHBondContact O-N 3.22Å; M167-K170 HydrophobicContact CE-CD 3.84Å; M167-K170 WeakPolarHBondContact O-CB 3.25Å; M167-K170 PolarHBondContact O-N 3.24Å; M167-K170 HydrophobicContact SD-CD 4.41Å; D168-K170 VanDerWaalsContact C-N 3.25Å; D168-K170 PolarHBondContact O-N 2.81Å; K170-W172 PolarHBondContact O-N 3.01Å; K170-G173 WeakPolarHBondContact O-CA 3.32Å; K170-G173 PolarHBondContact O-N 2.9Å; K170-G173 VanDerWaalsContact O-N 3.07Å; K170-E174 PolarHBondContact O-N 3.48Å; K170-D187 IonicContact NZ-OD1 3.68Å; K170-D187 PolarHBondContact NZ-OD1 2.91Å; K170-D187 IonicContact NZ-OD2 3.25Å; K170-D187 PolarHBondContact NZ-OD2 3.29Å; K170-I188 HydrophobicContact CB-CB 4.09Å; K170-I188 HydrophobicContact CB-CG2 4.43Å; K170-I188 HydrophobicContact CG-CB 4.45Å; K170-I188 PolarHBondContact NZ-O 3.49Å; K170-Q190 HydrophobicContact CD-CG 3.87Å
171	L	94.1	Very high	93.8	Very high	12 Å²	12	31.1 Å²	31.1	6%	0.063	16%	0.159	C	C	.	.	H	α-helix	trans	-59.9	-38.2	176	-60	-171.2	0	0	0	111.4	A97 I98 M167 D168 A169 E174 E175 L532 F535 F536	A97-L171 HydrophobicContact CB-CD1 3.51Å; A97-L171 HydrophobicContact CB-CD2 4.23Å; A97-L171 HydrophobicContact CB-CG 3.74Å; I98-L171 HydrophobicContact CD1-CD2 4.43Å; I98-L171 HydrophobicContact CG1-CD1 4.02Å; I98-L171 HydrophobicContact CG1-CD2 3.9Å; M167-L171 PolarHBondContact O-N 3.16Å; D168-L171 WeakPolarHBondContact O-CB 3.25Å; D168-L171 PolarHBondContact O-N 2.86Å; D168-L171 VanDerWaalsContact O-N 3.08Å; A169-L171 VanDerWaalsContact C-N 3.31Å; A169-L171 PolarHBondContact O-N 2.83Å; L171-E174 PolarHBondContact O-N 3.33Å; L171-E175 PolarHBondContact O-N 2.97Å; L171-L532 HydrophobicContact CB-CD1 4.3Å; L171-L532 HydrophobicContact CD1-CD1 4.33Å; L171-L532 HydrophobicContact CD2-CD1 3.81Å; L171-L532 HydrophobicContact CG-CD1 4.38Å; L171-F535 HydrophobicContact CD1-CD1 4.37Å; L171-F535 HydrophobicContact CD1-CE1 4.05Å; L171-F535 HydrophobicContact CD1-CZ 4.28Å; L171-F536 HydrophobicContact CB-CE2 4.23Å; L171-F536 HydrophobicContact CB-CZ 3.8Å; L171-F536 VanDerWaalsContact O-CZ 3.31Å; L171-F536 WeakPolarHBondContact O-CZ 3.31Å
172	W	94.5	Very high	93.4	Very high	17 Å²	17	28.2 Å²	28.2	6%	0.064	14%	0.144	C	C	.	.	H	α-helix	trans	-64.9	-39.2	174.3	-69.1	105.2	0	0	0	112.3	D168 A169 K170 E174 E175 Y176 F236 T240 R243 L248 V250 F536	D168-W172 VanDerWaalsContact O-CD1 3.28Å; D168-W172 PolarHBondContact O-N 3.31Å; A169-W172 WeakPolarHBondContact O-CA 3.37Å; A169-W172 VanDerWaalsContact O-CB 3.31Å; A169-W172 WeakPolarHBondContact O-CB 3.49Å; A169-W172 PolarHBondContact O-N 3.24Å; K170-W172 PolarHBondContact O-N 3.01Å; W172-E174 VanDerWaalsContact C-N 3.35Å; W172-E175 PolarHBondContact O-N 3.4Å; W172-Y176 WeakPolarHBondContact O-CB 3.15Å; W172-Y176 PolarHBondContact O-N 2.63Å; W172-F236 HydrophobicContact CB-CE2 4.36Å; W172-F236 HydrophobicContact CB-CZ 4.1Å; W172-T240 HydrophobicContact CB-CG2 3.79Å; W172-T240 HydrophobicContact CD2-CG2 4.26Å; W172-T240 HydrophobicContact CE3-CG2 4.15Å; W172-T240 HydrophobicContact CG-CG2 4.14Å; W172-R243 HydrophobicContact CZ3-CB 3.91Å; W172-R243 HydrophobicContact CZ3-CG 3.92Å; W172-L248 HydrophobicContact CD2-CD1 4.37Å; W172-L248 HydrophobicContact CZ2-CD1 3.84Å; W172-L248 HydrophobicContact CZ2-CD2 3.86Å; W172-L248 HydrophobicContact CZ2-CG 4.12Å; W172-V250 HydrophobicContact CB-CG2 4.08Å; W172-V250 HydrophobicContact CG-CG2 3.95Å; W172-F536 AromaticContact CD2-CE1 3.85Å; W172-F536 HydrophobicContact CD2-CE1 3.85Å; W172-F536 HydrophobicContact CD2-CZ 4.4Å; W172-F536 AromaticContact CE2-CE1 3.97Å; W172-F536 HydrophobicContact CE3-CD1 4.42Å; W172-F536 AromaticContact CE3-CE1 3.66Å; W172-F536 HydrophobicContact CE3-CE1 3.66Å; W172-F536 HydrophobicContact CE3-CZ 4.38Å; W172-F536 HydrophobicContact CH2-CD1 4Å; W172-F536 AromaticContact CH2-CE1 3.74Å; W172-F536 HydrophobicContact CH2-CE1 3.74Å; W172-F536 AromaticContact CZ2-CE1 3.93Å; W172-F536 HydrophobicContact CZ2-CE1 3.93Å; W172-F536 AromaticContact CZ3-CD1 3.95Å; W172-F536 HydrophobicContact CZ3-CD1 3.95Å; W172-F536 AromaticContact CZ3-CE1 3.61Å; W172-F536 HydrophobicContact CZ3-CE1 3.61Å
173	G	95	Very high	92.7	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-57.2	-45.3	170	0	0	0	0	0	112.6	A169 K170 Y176 S177	A169-G173 PolarHBondContact O-N 2.91Å; K170-G173 WeakPolarHBondContact O-CA 3.32Å; K170-G173 PolarHBondContact O-N 2.9Å; K170-G173 VanDerWaalsContact O-N 3.07Å; G173-Y176 PolarHBondContact O-N 3.29Å; G173-S177 WeakPolarHBondContact O-CB 3.2Å; G173-S177 PolarHBondContact O-N 3.36Å; G173-S177 PolarHBondContact O-OG 2.91Å
174	E	92.6	Very high	92.1	Very high	36 Å²	36	36.2 Å²	36.2	17%	0.168	19%	0.187	C	C	.	.	H	α-helix	trans	-65.8	-38.1	176.3	-66.8	-176	176.6	0	0	112.2	K170 L171 W172 S177 R178 K528 L532	K170-E174 PolarHBondContact O-N 3.48Å; L171-E174 PolarHBondContact O-N 3.33Å; W172-E174 VanDerWaalsContact C-N 3.35Å; E174-S177 PolarHBondContact O-N 2.84Å; E174-R178 WeakPolarHBondContact O-CG 3.08Å; E174-R178 PolarHBondContact O-N 2.96Å; E174-R178 PolarHBondContact O-NE 3.35Å; E174-K528 IonicContact OE1-NZ 3.71Å; E174-L532 HydrophobicContact CB-CD2 4.03Å; E174-L532 VanDerWaalsContact OE2-CD2 3.22Å; E174-L532 WeakPolarHBondContact OE2-CD2 3.38Å
175	E	90.1	Very high	91.8	Very high	5 Å²	5	35.7 Å²	35.7	2%	0.023	19%	0.188	C	C	.	.	H	α-helix	trans	-66.9	-43.1	175.6	179.7	60.8	-155.1	0	0	112.9	L171 W172 S177 R178 Q179 F239 R243 F536	L171-E175 PolarHBondContact O-N 2.97Å; W172-E175 PolarHBondContact O-N 3.4Å; E175-S177 VanDerWaalsContact C-N 3.33Å; E175-R178 VanDerWaalsContact N-NH2 3.2Å; E175-R178 PolarHBondContact O-N 3.39Å; E175-R178 IonicContact OE2-CZ 3.71Å; E175-R178 IonicContact OE2-NH1 3.13Å; E175-R178 PolarHBondContact OE2-NH1 3.46Å; E175-R178 IonicContact OE2-NH2 3.71Å; E175-R178 PolarHBondContact OE2-NH2 3.4Å; E175-Q179 PolarHBondContact O-NE2 2.89Å; E175-Q179 PolarHBondContact OE1-NE2 3.47Å; E175-F239 HydrophobicContact CB-CE1 4.39Å; E175-F239 HydrophobicContact CG-CE1 3.93Å; E175-F239 HydrophobicContact CG-CZ 3.86Å; E175-R243 HydrophobicContact CG-CG 4.13Å; E175-R243 IonicContact OE1-CZ 2.64Å; E175-R243 VanDerWaalsContact OE1-CZ 3.25Å; E175-R243 IonicContact OE1-NE 3.35Å; E175-R243 PolarHBondContact OE1-NE 2.87Å; E175-R243 IonicContact OE1-NH2 3.86Å; E175-R243 PolarHBondContact OE1-NH2 2.72Å; E175-F536 HydrophobicContact CB-CD1 4.49Å; E175-F536 HydrophobicContact CB-CD2 3.99Å; E175-F536 HydrophobicContact CB-CE1 4.14Å; E175-F536 HydrophobicContact CB-CE2 3.6Å; E175-F536 HydrophobicContact CB-CG 4.43Å; E175-F536 HydrophobicContact CB-CZ 3.69Å; E175-F536 HydrophobicContact CG-CD1 4.16Å; E175-F536 HydrophobicContact CG-CD2 4.08Å; E175-F536 HydrophobicContact CG-CE1 4.24Å; E175-F536 HydrophobicContact CG-CE2 4.17Å; E175-F536 HydrophobicContact CG-CG 4.09Å; E175-F536 HydrophobicContact CG-CZ 4.25Å; E175-F536 WeakPolarHBondContact OE2-CD2 3.24Å
176	Y	92.3	Very high	91.7	Very high	1 Å²	1	35.8 Å²	35.8	0%	0.004	19%	0.189	C	C	.	.	H	α-helix	trans	-60.7	-45.9	172.3	178	-87.4	0	0	0	110.7	W172 G173 R178 Q179 A182 V186 T232 F236 F239 L299	W172-Y176 WeakPolarHBondContact O-CB 3.15Å; W172-Y176 PolarHBondContact O-N 2.63Å; G173-Y176 PolarHBondContact O-N 3.29Å; Y176-R178 PolarHBondContact O-N 3.24Å; Y176-Q179 VanDerWaalsContact O-CB 3.32Å; Y176-Q179 WeakPolarHBondContact O-CB 3.41Å; Y176-Q179 WeakPolarHBondContact O-CG 3.33Å; Y176-Q179 PolarHBondContact O-N 3.48Å; Y176-A182 HydrophobicContact CD1-CB 4.22Å; Y176-A182 HydrophobicContact CE1-CB 3.76Å; Y176-V186 HydrophobicContact CD1-CG1 4.15Å; Y176-V186 HydrophobicContact CD1-CG2 3.68Å; Y176-V186 HydrophobicContact CE1-CG1 3.99Å; Y176-V186 HydrophobicContact CE1-CG2 4.36Å; Y176-V186 HydrophobicContact CG-CG2 4.35Å; Y176-T232 HydrophobicContact CE1-CG2 4.33Å; Y176-F236 HydrophobicContact CD1-CD2 4.34Å; Y176-F236 HydrophobicContact CD2-CB 4.26Å; Y176-F236 AromaticContact CD2-CD2 3.85Å; Y176-F236 HydrophobicContact CD2-CD2 3.85Å; Y176-F236 HydrophobicContact CE2-CB 4.21Å; Y176-F236 AromaticContact CG-CD2 3.7Å; Y176-F236 HydrophobicContact CG-CD2 3.7Å; Y176-F236 HydrophobicContact CG-CE2 4.43Å; Y176-F239 HydrophobicContact CD2-CB 3.84Å; Y176-F239 AromaticContact CD2-CD1 3.7Å; Y176-F239 HydrophobicContact CD2-CD1 3.7Å; Y176-F239 HydrophobicContact CD2-CD2 4.3Å; Y176-F239 HydrophobicContact CD2-CE1 4.33Å; Y176-F239 AromaticContact CD2-CG 3.67Å; Y176-F239 HydrophobicContact CD2-CG 3.67Å; Y176-F239 HydrophobicContact CE2-CB 4.23Å; Y176-F239 HydrophobicContact CE2-CG 4.43Å; Y176-F239 HydrophobicContact CG-CD1 4.28Å; Y176-L299 HydrophobicContact CD2-CD1 4.34Å; Y176-L299 HydrophobicContact CE2-CD1 3.47Å; Y176-L299 VanDerWaalsContact CE2-CD1 3.47Å; Y176-L299 HydrophobicContact CE2-CD2 4.46Å
177	S	92.7	Very high	91.6	Very high	20 Å²	20	38.3 Å²	38.3	14%	0.14	20%	0.203	C	C	.	.	H	α-helix	trans	-64.7	-25.9	179.3	-77.4	0	0	0	0	113.3	G173 E174 E175 Q179 K185 V186	G173-S177 WeakPolarHBondContact O-CB 3.2Å; G173-S177 PolarHBondContact O-N 3.36Å; G173-S177 PolarHBondContact O-OG 2.91Å; E174-S177 PolarHBondContact O-N 2.84Å; E175-S177 VanDerWaalsContact C-N 3.33Å; S177-Q179 VanDerWaalsContact C-N 3.26Å; S177-Q179 PolarHBondContact O-N 2.84Å; S177-K185 WeakPolarHBondContact O-CD 3.37Å; S177-K185 WeakPolarHBondContact O-CE 3.18Å; S177-K185 PolarHBondContact O-NZ 2.88Å; S177-K185 WeakPolarHBondContact OG-CA 3.4Å; S177-V186 PolarHBondContact OG-N 2.87Å; S177-V186 PolarHBondContact OG-O 3.4Å
178	R	88.7	Confident	91.6	Very high	69 Å²	69	37.3 Å²	37.3	26%	0.26	20%	0.198	S	C	.	.	H	α-helix	trans	-71.9	-16.3	173.4	-82.5	178.3	-81.2	117	8.4	113.7	E174 E175 Y176 P180 F536	E174-R178 WeakPolarHBondContact O-CG 3.08Å; E174-R178 PolarHBondContact O-N 2.96Å; E174-R178 PolarHBondContact O-NE 3.35Å; E175-R178 VanDerWaalsContact N-NH2 3.2Å; E175-R178 PolarHBondContact O-N 3.39Å; E175-R178 IonicContact OE2-CZ 3.71Å; E175-R178 IonicContact OE2-NH1 3.13Å; E175-R178 PolarHBondContact OE2-NH1 3.46Å; E175-R178 IonicContact OE2-NH2 3.71Å; E175-R178 PolarHBondContact OE2-NH2 3.4Å; Y176-R178 PolarHBondContact O-N 3.24Å; R178-P180 WeakPolarHBondContact O-CD 3.35Å; R178-F536 VanDerWaalsContact NH2-CE2 3.33Å
179	Q	87.1	Confident	91.7	Very high	42 Å²	42	37 Å²	37	20%	0.196	20%	0.196	C	C	.	.			trans	-65.9	125.1	177.1	-55.5	-48.4	-51.3	0	0	111.2	E175 Y176 S177 S181 A182 K185 F239 L299	E175-Q179 PolarHBondContact O-NE2 2.89Å; E175-Q179 PolarHBondContact OE1-NE2 3.47Å; Y176-Q179 VanDerWaalsContact O-CB 3.32Å; Y176-Q179 WeakPolarHBondContact O-CB 3.41Å; Y176-Q179 WeakPolarHBondContact O-CG 3.33Å; Y176-Q179 PolarHBondContact O-N 3.48Å; S177-Q179 VanDerWaalsContact C-N 3.26Å; S177-Q179 PolarHBondContact O-N 2.84Å; Q179-S181 PolarHBondContact O-N 3.17Å; Q179-A182 HydrophobicContact CB-CB 4.22Å; Q179-A182 WeakPolarHBondContact O-CB 3.45Å; Q179-A182 PolarHBondContact O-N 3.11Å; Q179-A182 VanDerWaalsContact O-N 3.14Å; Q179-K185 PolarHBondContact O-NZ 3.02Å; Q179-F239 HydrophobicContact CG-CD2 4.41Å; Q179-F239 HydrophobicContact CG-CE2 3.54Å; Q179-F239 HydrophobicContact CG-CZ 3.78Å; Q179-L299 HydrophobicContact CB-CD2 3.76Å; Q179-L299 HydrophobicContact CG-CD2 3.94Å
180	P	87.4	Confident	91.6	Very high	127 Å²	127	40 Å²	40	83%	0.825	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-30.9	178.4	-25.9	35.2	0	0	0	113.4	R178 A182	R178-P180 WeakPolarHBondContact O-CD 3.35Å; P180-A182 VanDerWaalsContact C-N 3.35Å
181	S	85.9	Confident	91.7	Very high	49 Å²	49	40 Å²	40	34%	0.343	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-10.7	179.6	51.5	0	0	0	0	114.2	Q179 P183 A298 L299	Q179-S181 PolarHBondContact O-N 3.17Å; S181-P183 WeakPolarHBondContact O-CD 3.12Å; S181-A298 WeakPolarHBondContact CB-O 3.43Å; S181-A298 PolarHBondContact OG-O 2.85Å; S181-A298 VanDerWaalsContact OG-O 3.06Å; S181-L299 WeakPolarHBondContact OG-CD2 3.25Å
182	A	87.1	Confident	91.9	Very high	3 Å²	3	39.9 Å²	39.9	3%	0.025	21%	0.212	C	C	.	.			trans	-74.3	107.9	173.9	0	0	0	0	0	110	Y176 Q179 P180 K185	Y176-A182 HydrophobicContact CD1-CB 4.22Å; Y176-A182 HydrophobicContact CE1-CB 3.76Å; Q179-A182 HydrophobicContact CB-CB 4.22Å; Q179-A182 WeakPolarHBondContact O-CB 3.45Å; Q179-A182 PolarHBondContact O-N 3.11Å; Q179-A182 VanDerWaalsContact O-N 3.14Å; P180-A182 VanDerWaalsContact C-N 3.35Å; A182-K185 PolarHBondContact O-NZ 2.78Å
183	P	82	Confident	92.1	Very high	93 Å²	93	39.1 Å²	39.1	60%	0.604	21%	0.209	S	C	*	.	S	Bend	trans	-74.3	-31.4	-172.2	30.1	-34.4	0	0	0	112.4	S181 L295	S181-P183 WeakPolarHBondContact O-CD 3.12Å; P183-L295 HydrophobicContact CG-CD2 3.58Å
184	K	85.2	Confident	92.3	Very high	110 Å²	110	39.1 Å²	39.1	48%	0.478	21%	0.209	S	C	.	.	S	Bend	trans	-113	131.2	173.7	-66.5	-179.6	178.1	-179	0	107.8
185	K	91.4	Very high	92.5	Very high	106 Å²	106	38.9 Å²	38.9	46%	0.461	21%	0.208	S	C	.	.			trans	-82.3	140.2	172.6	-53.5	-47.6	-174.3	-173.8	0	108.2	S177 Q179 A182 N258	S177-K185 WeakPolarHBondContact O-CD 3.37Å; S177-K185 WeakPolarHBondContact O-CE 3.18Å; S177-K185 PolarHBondContact O-NZ 2.88Å; S177-K185 WeakPolarHBondContact OG-CA 3.4Å; Q179-K185 PolarHBondContact O-NZ 3.02Å; A182-K185 PolarHBondContact O-NZ 2.78Å; K185-N258 WeakPolarHBondContact O-CB 3.17Å
186	V	95.2	Very high	92.9	Very high	7 Å²	7	38.8 Å²	38.8	4%	0.042	21%	0.207	C	C	.	.			trans	-113.2	153.9	179	-51.4	0	0	0	0	108.6	Y176 S177 T232 F236 N258 W260	Y176-V186 HydrophobicContact CD1-CG1 4.15Å; Y176-V186 HydrophobicContact CD1-CG2 3.68Å; Y176-V186 HydrophobicContact CE1-CG1 3.99Å; Y176-V186 HydrophobicContact CE1-CG2 4.36Å; Y176-V186 HydrophobicContact CG-CG2 4.35Å; S177-V186 PolarHBondContact OG-N 2.87Å; S177-V186 PolarHBondContact OG-O 3.4Å; V186-T232 HydrophobicContact CG1-CG2 3.56Å; V186-F236 HydrophobicContact CG2-CD2 4.25Å; V186-F236 HydrophobicContact CG2-CE2 4.45Å; V186-N258 WeakPolarHBondContact CA-O 3.45Å; V186-N258 HydrophobicContact CG1-CB 4.32Å; V186-W260 HydrophobicContact CB-CE3 4.33Å; V186-W260 HydrophobicContact CB-CH2 3.87Å; V186-W260 HydrophobicContact CB-CZ2 4.33Å; V186-W260 HydrophobicContact CB-CZ3 3.85Å; V186-W260 HydrophobicContact CG1-CH2 3.58Å; V186-W260 HydrophobicContact CG1-CZ2 3.93Å; V186-W260 HydrophobicContact CG1-CZ3 4.1Å; V186-W260 HydrophobicContact CG2-CH2 4.19Å; V186-W260 HydrophobicContact CG2-CZ3 3.86Å
187	D	96.3	Very high	93.2	Very high	61 Å²	61	41.2 Å²	41.2	33%	0.326	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	156.2	169.1	-160.7	13.7	0	0	0	110.3	K170 N258 L259 W260	K170-D187 IonicContact NZ-OD1 3.68Å; K170-D187 PolarHBondContact NZ-OD1 2.91Å; K170-D187 IonicContact NZ-OD2 3.25Å; K170-D187 PolarHBondContact NZ-OD2 3.29Å; D187-N258 PolarHBondContact N-O 3.41Å; D187-L259 HydrophobicContact CB-CD1 4.07Å; D187-L259 WeakPolarHBondContact O-CA 3.24Å; D187-W260 PolarHBondContact O-N 3.31Å
188	I	97.9	Very high	93.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	131.8	172	-68.4	158.6	0	0	0	108	Q166 A169 K170 Q190 F236 W260 P263	Q166-I188 HydrophobicContact CG-CG2 3.68Å; A169-I188 VanDerWaalsContact C-CD1 3.43Å; A169-I188 HydrophobicContact CB-CD1 3.81Å; A169-I188 VanDerWaalsContact O-CD1 3.25Å; A169-I188 WeakPolarHBondContact O-CD1 3.38Å; K170-I188 HydrophobicContact CB-CB 4.09Å; K170-I188 HydrophobicContact CB-CG2 4.43Å; K170-I188 HydrophobicContact CG-CB 4.45Å; K170-I188 PolarHBondContact NZ-O 3.49Å; I188-Q190 PolarHBondContact O-N 2.96Å; I188-F236 HydrophobicContact CD1-CZ 4.42Å; I188-W260 CarbonylContact C-O 3.55Å; I188-W260 WeakPolarHBondContact CA-O 3.45Å; I188-W260 HydrophobicContact CG1-CB 4.11Å; I188-W260 HydrophobicContact CG1-CE3 4.28Å; I188-P263 HydrophobicContact CD1-CG 4.48Å; I188-P263 HydrophobicContact CG2-CG 4.38Å
189	S	96.4	Very high	93.7	Very high	8 Å²	8	45.1 Å²	45.1	6%	0.056	24%	0.241	C	C	.	.			trans	-52.3	135	-180	-174.6	0	0	0	0	110.2	Q166 E208 W260	Q166-S189 PolarHBondContact NE2-O 3.5Å; S189-E208 PolarHBondContact OG-OE2 3.12Å; S189-W260 WeakPolarHBondContact CB-O 3.46Å; S189-W260 PolarHBondContact N-O 2.89Å
190	Q	96.2	Very high	94.1	Very high	63 Å²	63	48.8 Å²	48.8	29%	0.294	27%	0.268	S	S	.	.			trans	-73.6	133.2	171.8	-69.9	-177	-32.1	0	0	109	M167 K170 I188 S478	M167-Q190 HydrophobicContact CE-CG 4.21Å; M167-Q190 HydrophobicContact SD-CB 4.32Å; M167-Q190 HydrophobicContact SD-CG 4.35Å; K170-Q190 HydrophobicContact CD-CG 3.87Å; I188-Q190 PolarHBondContact O-N 2.96Å; Q190-S478 PolarHBondContact NE2-O 2.96Å
191	T	97.4	Very high	94.4	Very high	10 Å²	10	50.8 Å²	50.8	6%	0.061	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	155.9	176.1	-174.3	0	0	0	0	110.1	V163 Q166 L207	V163-T191 HydrophobicContact CB-CG2 4.27Å; V163-T191 HydrophobicContact CG1-CG2 4.3Å; V163-T191 HydrophobicContact CG2-CG2 3.95Å; Q166-T191 HydrophobicContact CB-CG2 3.74Å; Q166-T191 VanDerWaalsContact CD-CG2 3.44Å; Q166-T191 HydrophobicContact CG-CG2 3.76Å; T191-L207 WeakPolarHBondContact CA-O 3.34Å
192	C	98.3	Very high	94.9	Very high	11 Å²	11	53.8 Å²	53.8	7%	0.074	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	161.7	178.7	59.8	0	0	0	0	110.2	R92 Y93 R94 H206 L207	R92-C192 HydrophobicContact CG-CB 4.09Å; Y93-C192 WeakPolarHBondContact O-CA 3.43Å; Y93-C192 VanDerWaalsContact O-CB 3.23Å; Y93-C192 WeakPolarHBondContact O-CB 3.13Å; R94-C192 HydrophobicContact CG-CB 3.87Å; C192-H206 CarbonylContact O-C 3.42Å; C192-H206 VanDerWaalsContact O-CA 3.28Å; C192-H206 WeakPolarHBondContact O-CA 3.45Å; C192-L207 PolarHBondContact N-O 3.49Å; C192-L207 VanDerWaalsContact N-O 3.1Å; C192-L207 PolarHBondContact O-N 2.81Å; C192-L207 PolarHBondContact SG-O 2.81Å; C192-L207 VanDerWaalsContact SG-O 3.36Å
193	V	98.8	Very high	95.4	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	133	172.8	-173.7	0	0	0	0	108.8	R92 Y93 F160 V163 L204 Y205	R92-V193 CarbonylContact C-O 3.56Å; R92-V193 WeakPolarHBondContact CA-O 3.32Å; Y93-V193 HydrophobicContact CD2-CB 4.31Å; Y93-V193 HydrophobicContact CD2-CG1 4.47Å; Y93-V193 PolarHBondContact N-O 3.46Å; Y93-V193 PolarHBondContact O-N 2.74Å; F160-V193 HydrophobicContact CD1-CG2 4.21Å; F160-V193 HydrophobicContact CE1-CG2 4.36Å; F160-V193 HydrophobicContact CE2-CG1 4.42Å; F160-V193 HydrophobicContact CG-CG2 4.31Å; F160-V193 HydrophobicContact CZ-CG1 4.31Å; V163-V193 HydrophobicContact CB-CG2 4.4Å; V163-V193 HydrophobicContact CG2-CG2 3.7Å; V193-L204 HydrophobicContact CG1-CB 4.16Å; V193-L204 HydrophobicContact CG1-CD1 4.29Å; V193-L204 HydrophobicContact CG1-CD2 4.02Å; V193-L204 HydrophobicContact CG1-CG 4.38Å; V193-Y205 CarbonylContact C-O 3.55Å; V193-Y205 WeakPolarHBondContact CA-O 3.46Å
194	L	98.5	Very high	96.2	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.2	165.7	-67.5	-174	0	0	0	109.8	A90 K91 R92 V107 V109 F196 L204 Y205 L207	A90-L194 HydrophobicContact CB-CB 4.43Å; A90-L194 HydrophobicContact CB-CD2 4.34Å; K91-L194 CarbonylContact O-C 3.56Å; K91-L194 WeakPolarHBondContact O-CA 2.96Å; R92-L194 HydrophobicContact CB-CD2 3.76Å; R92-L194 HydrophobicContact CG-CD2 3.97Å; V107-L194 HydrophobicContact CG2-CD2 3.68Å; V109-L194 HydrophobicContact CG1-CD1 4.14Å; L194-F196 HydrophobicContact CB-CE2 4.29Å; L194-F196 HydrophobicContact CD1-CE2 4.41Å; L194-F196 HydrophobicContact CD1-CZ 4.43Å; L194-L204 CarbonylContact O-C 3.58Å; L194-L204 VanDerWaalsContact O-CA 3.3Å; L194-L204 WeakPolarHBondContact O-CA 3.46Å; L194-Y205 PolarHBondContact N-O 3.42Å; L194-Y205 PolarHBondContact O-N 3.48Å; L194-L207 HydrophobicContact CD1-CB 3.81Å; L194-L207 HydrophobicContact CD1-CD1 3.8Å; L194-L207 HydrophobicContact CD1-CD2 3.95Å; L194-L207 HydrophobicContact CD1-CG 4.05Å; L194-L207 HydrophobicContact CD2-CD2 4.36Å; L194-L207 HydrophobicContact CG-CB 3.79Å; L194-L207 HydrophobicContact CG-CD2 4.29Å; L194-L207 HydrophobicContact CG-CG 4.46Å
195	E	98.6	Very high	96.8	Very high	31 Å²	31	46.1 Å²	46.1	15%	0.145	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115.4	167	-177.8	-173.9	173.3	0	0	109	A90 K91 Y93 I197 K202 L204	A90-E195 CarbonylContact C-O 3.4Å; A90-E195 VanDerWaalsContact CA-O 3.31Å; A90-E195 WeakPolarHBondContact CA-O 3.3Å; K91-E195 HydrophobicContact CB-CB 4.34Å; K91-E195 PolarHBondContact N-O 3.04Å; K91-E195 PolarHBondContact O-N 3.17Å; Y93-E195 HydrophobicContact CE2-CB 3.94Å; Y93-E195 PolarHBondContact OH-OE2 2.81Å; E195-I197 VanDerWaalsContact C-N 3.32Å; E195-I197 HydrophobicContact CG-CG2 4.11Å; E195-I197 PolarHBondContact O-N 3.06Å; E195-K202 HydrophobicContact CG-CB 4.03Å; E195-K202 VanDerWaalsContact OE1-CD 3.3Å; E195-K202 WeakPolarHBondContact OE1-CD 3.41Å; E195-L204 HydrophobicContact CB-CD2 3.57Å; E195-L204 HydrophobicContact CG-CD2 3.82Å
196	F	98.2	Very high	97.1	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.009	21%	0.212	C	C	.	.			trans	-79.7	81.9	175.5	-74.4	-95	0	0	0	110.2	E88 A90 V109 I111 L194 N198 R199 P203 Y205	E88-F196 HydrophobicContact CB-CD1 4.31Å; E88-F196 HydrophobicContact CB-CE1 4.2Å; A90-F196 HydrophobicContact CB-CD1 4.34Å; A90-F196 HydrophobicContact CB-CE1 4.48Å; V109-F196 HydrophobicContact CG2-CE1 3.54Å; V109-F196 HydrophobicContact CG2-CZ 3.81Å; I111-F196 HydrophobicContact CD1-CE2 4.49Å; I111-F196 HydrophobicContact CD1-CZ 4.05Å; I111-F196 HydrophobicContact CG2-CE1 3.98Å; I111-F196 HydrophobicContact CG2-CZ 3.96Å; L194-F196 HydrophobicContact CB-CE2 4.29Å; L194-F196 HydrophobicContact CD1-CE2 4.41Å; L194-F196 HydrophobicContact CD1-CZ 4.43Å; F196-N198 PolarHBondContact O-N 3.31Å; F196-R199 HydrophobicContact CB-CB 4.01Å; F196-R199 HydrophobicContact CB-CG 3.84Å; F196-R199 HydrophobicContact CG-CG 4.49Å; F196-R199 PolarHBondContact O-N 2.77Å; F196-P203 HydrophobicContact CB-CG 4.32Å; F196-P203 PolarHBondContact N-O 3.16Å; F196-Y205 AromaticContact CD2-CD2 3.57Å; F196-Y205 HydrophobicContact CD2-CD2 3.57Å; F196-Y205 AromaticContact CD2-CE2 3.84Å; F196-Y205 HydrophobicContact CD2-CE2 3.84Å; F196-Y205 AromaticContact CE2-CD2 3.44Å; F196-Y205 HydrophobicContact CE2-CD2 3.44Å; F196-Y205 VanDerWaalsContact CE2-CD2 3.44Å; F196-Y205 AromaticContact CE2-CE2 3.85Å; F196-Y205 HydrophobicContact CE2-CE2 3.85Å; F196-Y205 HydrophobicContact CE2-CG 4Å
197	I	97.2	Very high	97.3	Very high	53 Å²	53	41.1 Å²	41.1	27%	0.272	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.9	-171.8	57.9	173.9	0	0	0	115.2	T89 K91 E195	T89-I197 HydrophobicContact CG2-CD1 4.35Å; K91-I197 HydrophobicContact CB-CG2 3.88Å; E195-I197 VanDerWaalsContact C-N 3.32Å; E195-I197 HydrophobicContact CG-CG2 4.11Å; E195-I197 PolarHBondContact O-N 3.06Å
198	N	97.1	Very high	97.3	Very high	123 Å²	123	38.7 Å²	38.7	66%	0.658	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-6.7	-178.7	-64.6	-29.8	0	0	0	113.5	F196	F196-N198 PolarHBondContact O-N 3.31Å
199	R	96.1	Very high	97.1	Very high	47 Å²	47	42.8 Å²	42.8	18%	0.177	22%	0.217	C	C	.	.	S	Bend	trans	-87.1	149.7	175.9	-71.9	-175.2	-177.2	-169.9	-6	110.5	E88 F196 K202 P203	E88-R199 VanDerWaalsContact CD-NH2 3.33Å; E88-R199 IonicContact OE1-CZ 2.82Å; E88-R199 IonicContact OE1-NE 2.71Å; E88-R199 IonicContact OE1-NH2 3.6Å; E88-R199 PolarHBondContact OE1-NH2 2.93Å; E88-R199 IonicContact OE2-CZ 2.91Å; E88-R199 IonicContact OE2-NE 3.68Å; E88-R199 PolarHBondContact OE2-NE 3.07Å; E88-R199 IonicContact OE2-NH2 3.07Å; E88-R199 PolarHBondContact OE2-NH2 2.79Å; F196-R199 HydrophobicContact CB-CB 4.01Å; F196-R199 HydrophobicContact CB-CG 3.84Å; F196-R199 HydrophobicContact CG-CG 4.49Å; F196-R199 PolarHBondContact O-N 2.77Å; R199-K202 PolarHBondContact O-N 2.94Å; R199-K202 VanDerWaalsContact O-N 3.08Å; R199-P203 HydrophobicContact CB-CG 4.13Å
200	P	94.9	Very high	97	Very high	119 Å²	119	45.3 Å²	45.3	77%	0.773	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	140.7	170.5	-23.7	33.7	0	0	0	111.3	K202 P203	P200-K202 PolarHBondContact O-N 3.44Å; P200-P203 VanDerWaalsContact O-CD 3.32Å; P200-P203 WeakPolarHBondContact O-CD 3.3Å
201	E	93.4	Very high	96.8	Very high	170 Å²	170	43.9 Å²	43.9	79%	0.794	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.7	-1.6	-175.1	-52.5	-167.7	172.4	0	0	116.5	K153	K153-E201 IonicContact NZ-OE2 2.58Å
202	K	97	Very high	96.3	Very high	112 Å²	112	49.4 Å²	49.4	49%	0.487	25%	0.246	S	C	.	.			trans	49	58.3	-179.3	-54	-177.6	-176	177.7	0	112.5	E195 R199 P200	E195-K202 HydrophobicContact CG-CB 4.03Å; E195-K202 VanDerWaalsContact OE1-CD 3.3Å; E195-K202 WeakPolarHBondContact OE1-CD 3.41Å; R199-K202 PolarHBondContact O-N 2.94Å; R199-K202 VanDerWaalsContact O-N 3.08Å; P200-K202 PolarHBondContact O-N 3.44Å
203	P	97.2	Very high	95.8	Very high	30 Å²	30	51.4 Å²	51.4	20%	0.195	27%	0.269	C	S	.	.			trans	-61.5	146.2	-171.9	27.9	-37	0	0	0	111.8	F196 R199 P200 Y205	F196-P203 HydrophobicContact CB-CG 4.32Å; F196-P203 PolarHBondContact N-O 3.16Å; R199-P203 HydrophobicContact CB-CG 4.13Å; P200-P203 VanDerWaalsContact O-CD 3.32Å; P200-P203 WeakPolarHBondContact O-CD 3.3Å; P203-Y205 HydrophobicContact CB-CE2 4.02Å; P203-Y205 HydrophobicContact CG-CE2 4.13Å
204	L	98.5	Very high	95.4	Very high	9 Å²	9	57.4 Å²	57.4	5%	0.047	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	142.4	177.8	-58.3	-175.3	0	0	0	111.6	N156 Y159 F160 V193 L194 E195	N156-L204 HydrophobicContact CB-CD1 3.86Å; Y159-L204 HydrophobicContact CD1-CB 3.81Å; Y159-L204 HydrophobicContact CD2-CB 3.98Å; Y159-L204 HydrophobicContact CD2-CD1 4.07Å; Y159-L204 HydrophobicContact CE1-CB 3.88Å; Y159-L204 WeakPolarHBondContact CE1-O 3.44Å; Y159-L204 HydrophobicContact CE2-CB 4.06Å; Y159-L204 HydrophobicContact CG-CB 3.84Å; Y159-L204 HydrophobicContact CG-CD1 4.15Å; Y159-L204 VanDerWaalsContact CZ-O 3.3Å; Y159-L204 PolarHBondContact OH-O 2.96Å; Y159-L204 VanDerWaalsContact OH-O 3.12Å; F160-L204 HydrophobicContact CE2-CD1 3.95Å; V193-L204 HydrophobicContact CG1-CB 4.16Å; V193-L204 HydrophobicContact CG1-CD1 4.29Å; V193-L204 HydrophobicContact CG1-CD2 4.02Å; V193-L204 HydrophobicContact CG1-CG 4.38Å; L194-L204 CarbonylContact O-C 3.58Å; L194-L204 VanDerWaalsContact O-CA 3.3Å; L194-L204 WeakPolarHBondContact O-CA 3.46Å; E195-L204 HydrophobicContact CB-CD2 3.57Å; E195-L204 HydrophobicContact CG-CD2 3.82Å
205	Y	98.6	Very high	94.9	Very high	6 Å²	6	63 Å²	63	2%	0.024	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	145.4	173.1	-69.4	-107.3	0	0	0	109.7	I111 F125 A147 K148 R149 V193 L194 F196 P203	I111-Y205 HydrophobicContact CD1-CD1 4.35Å; I111-Y205 HydrophobicContact CD1-CE1 4.23Å; F125-Y205 HydrophobicContact CD2-CD1 4.19Å; F125-Y205 AromaticContact CD2-CE1 3.69Å; F125-Y205 HydrophobicContact CD2-CE1 3.69Å; F125-Y205 HydrophobicContact CE2-CD1 4.42Å; F125-Y205 AromaticContact CE2-CE1 3.66Å; F125-Y205 HydrophobicContact CE2-CE1 3.66Å; F125-Y205 HydrophobicContact CG-CE1 4.38Å; F125-Y205 HydrophobicContact CZ-CE1 4.31Å; A147-Y205 HydrophobicContact CB-CD1 4Å; K148-Y205 CarbonylContact O-C 3.56Å; K148-Y205 WeakPolarHBondContact O-CA 3.37Å; R149-Y205 HydrophobicContact CB-CD1 3.78Å; R149-Y205 HydrophobicContact CB-CE1 3.68Å; R149-Y205 HydrophobicContact CB-CG 4.46Å; R149-Y205 HydrophobicContact CG-CE1 4.36Å; R149-Y205 PolarHBondContact NH1-OH 3.07Å; V193-Y205 CarbonylContact C-O 3.55Å; V193-Y205 WeakPolarHBondContact CA-O 3.46Å; L194-Y205 PolarHBondContact N-O 3.42Å; L194-Y205 PolarHBondContact O-N 3.48Å; F196-Y205 AromaticContact CD2-CD2 3.57Å; F196-Y205 HydrophobicContact CD2-CD2 3.57Å; F196-Y205 AromaticContact CD2-CE2 3.84Å; F196-Y205 HydrophobicContact CD2-CE2 3.84Å; F196-Y205 AromaticContact CE2-CD2 3.44Å; F196-Y205 HydrophobicContact CE2-CD2 3.44Å; F196-Y205 VanDerWaalsContact CE2-CD2 3.44Å; F196-Y205 AromaticContact CE2-CE2 3.85Å; F196-Y205 HydrophobicContact CE2-CE2 3.85Å; F196-Y205 HydrophobicContact CE2-CG 4Å; P203-Y205 HydrophobicContact CB-CE2 4.02Å; P203-Y205 HydrophobicContact CG-CE2 4.13Å
206	H	98.3	Very high	94.6	Very high	3 Å²	3	64.9 Å²	64.9	1%	0.014	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	137.2	158.9	-56.7	122.8	0	0	0	109.1	A147 K148 Y150 Y159 D162 C192	A147-H206 CarbonylContact C-O 3.6Å; A147-H206 VanDerWaalsContact CA-O 3.22Å; A147-H206 WeakPolarHBondContact CA-O 3.44Å; K148-H206 HydrophobicContact CB-CB 4.24Å; K148-H206 PolarHBondContact N-O 2.83Å; K148-H206 PolarHBondContact O-N 2.78Å; Y150-H206 AromaticContact CE2-CE1 3.97Å; Y159-H206 WeakPolarHBondContact CA-NE2 3.42Å; Y159-H206 AromaticContact CD1-CD2 3.98Å; Y159-H206 AromaticContact CD1-CE1 3.71Å; Y159-H206 AromaticContact CD1-NE2 3.63Å; Y159-H206 PolarHBondContact O-NE2 2.78Å; D162-H206 IonicContact OD2-CE1 3.41Å; D162-H206 PolarHBondContact OD2-CE1 3.26Å; D162-H206 IonicContact OD2-NE2 2.86Å; C192-H206 CarbonylContact O-C 3.42Å; C192-H206 VanDerWaalsContact O-CA 3.28Å; C192-H206 WeakPolarHBondContact O-CA 3.45Å
207	L	98.2	Very high	94.3	Very high	4 Å²	4	67.7 Å²	67.7	2%	0.021	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	125	174.2	-174.6	87.8	0	0	0	110	A127 K129 H145 A147 T191 C192 L194	A127-L207 HydrophobicContact CB-CD1 4.36Å; K129-L207 HydrophobicContact CD-CD2 4.03Å; H145-L207 HydrophobicContact CB-CD1 3.55Å; H145-L207 HydrophobicContact CB-CG 4.04Å; A147-L207 HydrophobicContact CB-CD1 4.14Å; T191-L207 WeakPolarHBondContact CA-O 3.34Å; C192-L207 PolarHBondContact N-O 3.49Å; C192-L207 VanDerWaalsContact N-O 3.1Å; C192-L207 PolarHBondContact O-N 2.81Å; C192-L207 PolarHBondContact SG-O 2.81Å; C192-L207 VanDerWaalsContact SG-O 3.36Å; L194-L207 HydrophobicContact CD1-CB 3.81Å; L194-L207 HydrophobicContact CD1-CD1 3.8Å; L194-L207 HydrophobicContact CD1-CD2 3.95Å; L194-L207 HydrophobicContact CD1-CG 4.05Å; L194-L207 HydrophobicContact CD2-CD2 4.36Å; L194-L207 HydrophobicContact CG-CB 3.79Å; L194-L207 HydrophobicContact CG-CD2 4.29Å; L194-L207 HydrophobicContact CG-CG 4.46Å
208	E	96.2	Very high	94.1	Very high	11 Å²	11	65.7 Å²	65.7	5%	0.051	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	166.6	172.6	64.4	175.6	165.1	0	0	111.1	H145 V146 K148 S189 T261	H145-E208 CarbonylContact C-O 3.58Å; H145-E208 WeakPolarHBondContact CA-O 3.45Å; H145-E208 VanDerWaalsContact CB-O 3.25Å; H145-E208 WeakPolarHBondContact CB-O 3.23Å; H145-E208 PolarHBondContact ND1-O 2.82Å; V146-E208 HydrophobicContact CB-CG 4.29Å; V146-E208 PolarHBondContact N-O 3.05Å; V146-E208 PolarHBondContact O-N 2.94Å; K148-E208 WeakPolarHBondContact CE-OE1 3.38Å; K148-E208 IonicContact NZ-OE1 3.95Å; K148-E208 PolarHBondContact NZ-OE1 3.18Å; S189-E208 PolarHBondContact OG-OE2 3.12Å; E208-T261 WeakPolarHBondContact OE2-CB 3.36Å; E208-T261 PolarHBondContact OE2-OG1 2.83Å
209	H	94.9	Very high	94	Very high	85 Å²	85	59.9 Å²	59.9	39%	0.394	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	146	174.8	-73	85	0	0	0	110.6	H145 I211	H145-H209 AromaticContact CE1-CD2 3.41Å; H145-H209 PolarHBondContact CE1-CD2 2.59Å; H145-H209 VanDerWaalsContact CE1-CD2 3.41Å; H145-H209 AromaticContact CE1-CE1 3.52Å; H145-H209 AromaticContact CE1-CG 3.66Å; H145-H209 AromaticContact CE1-ND1 3.7Å; H145-H209 AromaticContact CE1-NE2 3.34Å; H145-H209 PolarHBondContact CE1-NE2 3.16Å; H145-H209 VanDerWaalsContact CE1-NE2 3.34Å; H145-H209 AromaticContact NE2-CD2 3.82Å; H145-H209 AromaticContact NE2-NE2 3.72Å; H209-I211 PolarHBondContact O-N 2.8Å
210	F	93.6	Very high	93.9	Very high	61 Å²	61	57.9 Å²	57.9	27%	0.268	30%	0.296	S	S	.	.			trans	-63.9	130.8	169	174.7	-114	0	0	0	110.1	P76 W77 N144 V146 E212	P76-F210 HydrophobicContact CB-CE1 4.23Å; P76-F210 HydrophobicContact CG-CD1 4.13Å; P76-F210 HydrophobicContact CG-CE1 3.84Å; W77-F210 AromaticContact CE2-CD2 3.81Å; W77-F210 AromaticContact CE2-CE2 3.98Å; W77-F210 AromaticContact CE2-CG 3.91Å; W77-F210 HydrophobicContact CH2-CB 3.97Å; W77-F210 AromaticContact CH2-CD2 3.95Å; W77-F210 HydrophobicContact CH2-CD2 3.95Å; W77-F210 HydrophobicContact CH2-CG 4.06Å; W77-F210 HydrophobicContact CZ2-CB 4.04Å; W77-F210 HydrophobicContact CZ2-CD1 4.33Å; W77-F210 AromaticContact CZ2-CD2 3.24Å; W77-F210 HydrophobicContact CZ2-CD2 3.24Å; W77-F210 AromaticContact CZ2-CE2 3.7Å; W77-F210 HydrophobicContact CZ2-CE2 3.7Å; W77-F210 AromaticContact CZ2-CG 3.6Å; W77-F210 HydrophobicContact CZ2-CG 3.6Å; W77-F210 HydrophobicContact CZ2-CZ 4.41Å; W77-F210 HydrophobicContact CZ3-CB 4.42Å; W77-F210 AromaticContact NE1-CE1 3.9Å; W77-F210 AromaticContact NE1-CE2 3.83Å; W77-F210 AromaticContact NE1-CZ 3.71Å; N144-F210 HydrophobicContact CB-CB 3.93Å; N144-F210 PolarHBondContact O-N 3.28Å; V146-F210 HydrophobicContact CG2-CB 4.32Å; V146-F210 HydrophobicContact CG2-CD2 4.06Å; F210-E212 HydrophobicContact CE1-CB 3.93Å; F210-E212 HydrophobicContact CE1-CG 4.37Å
211	I	91	Very high	93.8	Very high	33 Å²	33	53.1 Å²	53.1	17%	0.169	26%	0.264	C	S	.	.			trans	-107	107.8	177.3	-52.3	170.8	0	0	0	107.9	H209 V256 L259	H209-I211 PolarHBondContact O-N 2.8Å; I211-V256 HydrophobicContact CB-CG2 4.29Å; I211-V256 HydrophobicContact CG2-CB 3.59Å; I211-V256 HydrophobicContact CG2-CG1 4.45Å; I211-V256 HydrophobicContact CG2-CG2 3.6Å; I211-L259 HydrophobicContact CD1-CD2 4.11Å; I211-L259 HydrophobicContact CD1-CG 4.05Å; I211-L259 HydrophobicContact CG1-CD2 3.99Å; I211-L259 HydrophobicContact CG1-CG 4.49Å; I211-L259 HydrophobicContact CG2-CD2 3.95Å; I211-L259 HydrophobicContact CG2-CG 4.49Å
212	E	87.3	Confident	93.7	Very high	127 Å²	127	47.2 Å²	47.2	59%	0.593	24%	0.242	S	C	*	.			trans	-72.4	131.6	177.7	-170.7	-175.5	175.5	0	0	111.5	F210	F210-E212 HydrophobicContact CE1-CB 3.93Å; F210-E212 HydrophobicContact CE1-CG 4.37Å
213	G	88.8	Confident	93.3	Very high	53 Å²	53	42.2 Å²	42.2	55%	0.546	22%	0.222	S	C	.	.	S	Bend	trans	130.6	-171.8	171.7	0	0	0	0	0	113.4	Y215	G213-Y215 PolarHBondContact O-N 3.43Å
214	T	89.4	Confident	93	Very high	125 Å²	125	45.4 Å²	45.4	77%	0.767	23%	0.233	S	C	*	.			trans	-79.3	114.3	-176.8	-46.4	0	0	0	0	111
215	Y	89.4	Confident	92.5	Very high	119 Å²	119	45.8 Å²	45.8	47%	0.467	24%	0.236	S	C	.	.			trans	-67.8	138	175.3	-169	-86.4	0	0	0	111.2	G213 Q254 T261	G213-Y215 PolarHBondContact O-N 3.43Å; Y215-Q254 HydrophobicContact CE1-CB 4.29Å; Y215-Q254 WeakPolarHBondContact OH-CG 3.32Å; Y215-Q254 PolarHBondContact OH-OE1 3.27Å; Y215-Q254 VanDerWaalsContact OH-OE1 3.07Å; Y215-T261 HydrophobicContact CE2-CG2 4.26Å
216	R	91.2	Very high	91.9	Very high	71 Å²	71	46.5 Å²	46.5	27%	0.268	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	136.4	179.4	-170.7	167.3	178.9	159	20.9	111.8	Y218 D226 Q254 G255	R216-Y218 HydrophobicContact CB-CE1 4.13Å; R216-Y218 HydrophobicContact CG-CD1 4.21Å; R216-Y218 HydrophobicContact CG-CE1 3.84Å; R216-D226 IonicContact CZ-OD1 3.64Å; R216-D226 IonicContact CZ-OD2 3.44Å; R216-D226 IonicContact NE-OD1 3.13Å; R216-D226 IonicContact NE-OD2 3.47Å; R216-D226 PolarHBondContact NE-OD2 2.83Å; R216-D226 IonicContact NH2-OD1 3.59Å; R216-D226 PolarHBondContact NH2-OD1 3.44Å; R216-D226 IonicContact NH2-OD2 3.23Å; R216-D226 PolarHBondContact NH2-OD2 3.08Å; R216-Q254 CarbonylContact O-C 3.52Å; R216-Q254 VanDerWaalsContact O-CA 3.3Å; R216-Q254 WeakPolarHBondContact O-CA 3.49Å; R216-G255 PolarHBondContact N-O 3.41Å; R216-G255 PolarHBondContact O-N 3.26Å
217	K	91.4	Very high	90.9	Very high	60 Å²	60	50.2 Å²	50.2	26%	0.261	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	119.5	171.2	-176	166.5	-172.2	170.2	0	109.3	N219 D226 D252 Q254	K217-N219 WeakPolarHBondContact CE-O 3.39Å; K217-N219 WeakPolarHBondContact CG-O 3.43Å; K217-D226 WeakPolarHBondContact O-CB 3.46Å; K217-D252 WeakPolarHBondContact CE-OD1 3Å; K217-D252 IonicContact NZ-OD1 2.73Å; K217-D252 PolarHBondContact NZ-OD1 3.24Å; K217-Q254 HydrophobicContact CB-CB 4.1Å; K217-Q254 HydrophobicContact CG-CB 4.17Å
218	Y	94.2	Very high	89.8	Confident	11 Å²	11	55.4 Å²	55.4	4%	0.043	29%	0.287	C	S	.	.			trans	-96.8	-32.6	-173	-57.9	-74.1	0	0	0	113.2	R216 D226 R230 P233 I253 G257 W260	R216-Y218 HydrophobicContact CB-CE1 4.13Å; R216-Y218 HydrophobicContact CG-CD1 4.21Å; R216-Y218 HydrophobicContact CG-CE1 3.84Å; Y218-D226 WeakPolarHBondContact O-CB 3.31Å; Y218-D226 PolarHBondContact O-N 3.33Å; Y218-R230 VanDerWaalsContact CZ-NH1 3.27Å; Y218-R230 PolarHBondContact OH-NH1 3Å; Y218-P233 VanDerWaalsContact CB-CB 3.5Å; Y218-P233 HydrophobicContact CD1-CG 3.87Å; Y218-P233 HydrophobicContact CD2-CB 4.37Å; Y218-P233 HydrophobicContact CD2-CG 3.79Å; Y218-P233 HydrophobicContact CG-CB 3.98Å; Y218-P233 HydrophobicContact CG-CG 3.44Å; Y218-P233 VanDerWaalsContact CG-CG 3.44Å; Y218-I253 WeakPolarHBondContact CB-O 3.48Å; Y218-I253 HydrophobicContact CD2-CG2 4.14Å; Y218-I253 WeakPolarHBondContact CD2-O 3.41Å; Y218-I253 PolarHBondContact N-O 3.01Å; Y218-G257 PolarHBondContact OH-O 3.01Å; Y218-W260 AromaticContact CE2-NE1 3.76Å
219	N	94.9	Very high	88.6	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-151.1	178.9	170.2	68.6	21.1	0	0	0	110.6	K217 F224 Q234 S237 D252 I253	K217-N219 WeakPolarHBondContact CE-O 3.39Å; K217-N219 WeakPolarHBondContact CG-O 3.43Å; N219-F224 CarbonylContact C-O 3.55Å; N219-F224 WeakPolarHBondContact CA-O 3.41Å; N219-F224 WeakPolarHBondContact CB-O 3.39Å; N219-Q234 VanDerWaalsContact CB-NE2 3.31Å; N219-S237 PolarHBondContact ND2-OG 3.07Å; N219-S237 VanDerWaalsContact ND2-OG 3.15Å; N219-D252 PolarHBondContact OD1-N 2.92Å; N219-I253 PolarHBondContact N-O 3.29Å; N219-I253 WeakPolarHBondContact OD1-CB 3.43Å; N219-I253 WeakPolarHBondContact OD1-CG1 3.16Å; N219-I253 PolarHBondContact OD1-N 2.97Å
220	S	93.8	Very high	88.3	Confident	5 Å²	5	56.4 Å²	56.4	4%	0.035	30%	0.295	C	S	.	.			trans	-133.8	169.8	176.4	74.1	0	0	0	0	114.6	S222 G223 F224 D252	S220-S222 PolarHBondContact O-N 3.14Å; S220-S222 PolarHBondContact OG-N 3.35Å; S220-S222 PolarHBondContact OG-OG 2.89Å; S220-G223 PolarHBondContact OG-N 2.81Å; S220-F224 PolarHBondContact N-O 3.33Å; S220-F224 VanDerWaalsContact OG-CB 3.25Å; S220-F224 WeakPolarHBondContact OG-CB 3.22Å; S220-F224 PolarHBondContact OG-N 3.11Å; S220-D252 WeakPolarHBondContact CA-OD1 3.1Å; S220-D252 WeakPolarHBondContact CB-OD1 3.49Å
221	N	93.2	Very high	88.2	Confident	19 Å²	19	56.8 Å²	56.8	10%	0.102	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-17.7	169.1	69.3	-19.1	0	0	0	114.8	V251 D252 Q264 H266 G276	N221-V251 HydrophobicContact CB-CG2 3.82Å; N221-D252 WeakPolarHBondContact CB-OD2 3.45Å; N221-D252 VanDerWaalsContact N-CG 3.35Å; N221-D252 PolarHBondContact N-OD1 3.09Å; N221-D252 PolarHBondContact N-OD2 3.49Å; N221-D252 PolarHBondContact OD1-OD2 2.73Å; N221-Q264 HydrophobicContact CB-CB 4.07Å; N221-Q264 HydrophobicContact CB-CG 3.84Å; N221-H266 PolarHBondContact O-CE1 3.39Å; N221-H266 PolarHBondContact O-NE2 3.02Å; N221-G276 PolarHBondContact ND2-O 2.94Å
222	S	90.8	Very high	88.3	Confident	46 Å²	46	55.6 Å²	55.6	32%	0.322	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	8.5	-178.9	61.2	0	0	0	0	114.1	S220	S220-S222 PolarHBondContact O-N 3.14Å; S220-S222 PolarHBondContact OG-N 3.35Å; S220-S222 PolarHBondContact OG-OG 2.89Å
223	G	88.2	Confident	88.7	Confident	7 Å²	7	49.6 Å²	49.6	7%	0.072	27%	0.266	C	S	.	.	S	Bend	trans	98.5	-4.3	174.8	0	0	0	0	0	115.5	S220 V225 T289	S220-G223 PolarHBondContact OG-N 2.81Å; G223-V225 PolarHBondContact O-N 3.23Å; G223-T289 WeakPolarHBondContact O-CB 3.31Å; G223-T289 WeakPolarHBondContact O-CG2 3.42Å; G223-T289 PolarHBondContact O-OG1 2.86Å
224	F	90.3	Very high	89	Confident	98 Å²	98	47.8 Å²	47.8	43%	0.43	24%	0.244	S	C	.	.			trans	-56	139	170.6	167.7	-92.6	0	0	0	111.8	N219 S220 D226	N219-F224 CarbonylContact C-O 3.55Å; N219-F224 WeakPolarHBondContact CA-O 3.41Å; N219-F224 WeakPolarHBondContact CB-O 3.39Å; S220-F224 PolarHBondContact N-O 3.33Å; S220-F224 VanDerWaalsContact OG-CB 3.25Å; S220-F224 WeakPolarHBondContact OG-CB 3.22Å; S220-F224 PolarHBondContact OG-N 3.11Å; F224-D226 HydrophobicContact CE1-CB 4.34Å; F224-D226 HydrophobicContact CZ-CB 4.47Å
225	V	88.2	Confident	89.3	Confident	17 Å²	17	41.9 Å²	41.9	10%	0.103	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-135.7	127.1	175	-174.9	0	0	0	0	108.8	G223 Q234 T289 S317	G223-V225 PolarHBondContact O-N 3.23Å; V225-Q234 HydrophobicContact CG1-CG 4.14Å; V225-Q234 VanDerWaalsContact CG2-NE2 3.26Å; V225-T289 WeakPolarHBondContact CG2-OG1 3.31Å; V225-S317 PolarHBondContact O-OG 2.87Å
226	D	87.6	Confident	89.6	Confident	20 Å²	20	36.2 Å²	36.2	11%	0.107	19%	0.185	C	C	.	.			trans	-61.7	137.9	-179.7	171.6	37.6	0	0	0	113.5	R216 K217 Y218 F224 L228 S229	R216-D226 IonicContact CZ-OD1 3.64Å; R216-D226 IonicContact CZ-OD2 3.44Å; R216-D226 IonicContact NE-OD1 3.13Å; R216-D226 IonicContact NE-OD2 3.47Å; R216-D226 PolarHBondContact NE-OD2 2.83Å; R216-D226 IonicContact NH2-OD1 3.59Å; R216-D226 PolarHBondContact NH2-OD1 3.44Å; R216-D226 IonicContact NH2-OD2 3.23Å; R216-D226 PolarHBondContact NH2-OD2 3.08Å; K217-D226 WeakPolarHBondContact O-CB 3.46Å; Y218-D226 WeakPolarHBondContact O-CB 3.31Å; Y218-D226 PolarHBondContact O-N 3.33Å; F224-D226 HydrophobicContact CE1-CB 4.34Å; F224-D226 HydrophobicContact CZ-CB 4.47Å; D226-L228 PolarHBondContact O-N 3.41Å; D226-S229 VanDerWaalsContact O-CA 3.3Å; D226-S229 WeakPolarHBondContact O-CA 3.43Å; D226-S229 VanDerWaalsContact O-CB 3.3Å; D226-S229 WeakPolarHBondContact O-CB 3.47Å; D226-S229 PolarHBondContact O-N 3.38Å; D226-S229 VanDerWaalsContact O-N 3.16Å
227	D	75.8	Confident	90	Very high	81 Å²	81	32.8 Å²	32.8	43%	0.433	17%	0.172	S	C	.	.	S	Bend	trans	-61.2	-42.6	-171.9	-57.3	0.5	0	0	0	112.9	S229 S317	D227-S229 PolarHBondContact O-N 3.01Å; D227-S317 WeakPolarHBondContact OD1-CA 3.26Å; D227-S317 WeakPolarHBondContact OD1-CB 3.4Å
228	L	76.1	Confident	90.2	Very high	114 Å²	114	30 Å²	30	60%	0.597	16%	0.16	S	C	*	.	S	Bend	trans	-85	56.7	172.7	-42.5	165.5	0	0	0	109.7	D226 R230	D226-L228 PolarHBondContact O-N 3.41Å; L228-R230 PolarHBondContact O-N 3.31Å
229	S	70.6	Confident	90.2	Very high	53 Å²	53	29.7 Å²	29.7	37%	0.371	16%	0.159	S	C	.	.			trans	-56.4	97.3	-169.4	66.8	0	0	0	0	111.5	D226 D227	D226-S229 VanDerWaalsContact O-CA 3.3Å; D226-S229 WeakPolarHBondContact O-CA 3.43Å; D226-S229 VanDerWaalsContact O-CB 3.3Å; D226-S229 WeakPolarHBondContact O-CB 3.47Å; D226-S229 PolarHBondContact O-N 3.38Å; D226-S229 VanDerWaalsContact O-N 3.16Å; D227-S229 PolarHBondContact O-N 3.01Å
230	R	87.6	Confident	90.2	Very high	64 Å²	64	29.7 Å²	29.7	24%	0.242	16%	0.159	C	C	.	.			trans	-63.6	139.9	168.2	-74.3	172	54.5	-164.2	-9.2	108.6	Y218 L228 T232 P233 G257 N258	Y218-R230 VanDerWaalsContact CZ-NH1 3.27Å; Y218-R230 PolarHBondContact OH-NH1 3Å; L228-R230 PolarHBondContact O-N 3.31Å; R230-T232 VanDerWaalsContact C-N 3.28Å; R230-T232 PolarHBondContact O-N 3.25Å; R230-P233 HydrophobicContact CB-CG 4.46Å; R230-P233 WeakPolarHBondContact O-CD 3.32Å; R230-G257 VanDerWaalsContact CZ-O 3.28Å; R230-G257 PolarHBondContact NH1-O 3.46Å; R230-G257 PolarHBondContact NH2-O 3.32Å; R230-N258 PolarHBondContact NH2-OD1 2.88Å
231	N	91.7	Very high	90.2	Very high	68 Å²	68	29.4 Å²	29.4	36%	0.364	16%	0.157	S	C	.	.	H	α-helix	trans	-62.2	-34.5	179.6	-70.2	-20.9	0	0	0	113.4	A235 N293 L295	N231-A235 WeakPolarHBondContact O-CB 3.15Å; N231-A235 PolarHBondContact O-N 3.2Å; N231-N293 WeakPolarHBondContact CA-ND2 3.3Å; N231-N293 HydrophobicContact CB-CB 4.34Å; N231-N293 WeakPolarHBondContact CB-OD1 3.47Å; N231-N293 PolarHBondContact O-ND2 3.18Å; N231-N293 WeakPolarHBondContact OD1-CB 3.37Å; N231-L295 HydrophobicContact CB-CD1 3.66Å; N231-L295 HydrophobicContact CB-CG 3.89Å
232	T	94.2	Very high	90	Very high	9 Å²	9	28.8 Å²	28.8	6%	0.055	15%	0.153	C	C	.	.	H	α-helix	trans	-65.7	-50.7	-168.6	-54.1	0	0	0	0	114.2	Y176 V186 R230 Q234 A235 F236 W260 L295	Y176-T232 HydrophobicContact CE1-CG2 4.33Å; V186-T232 HydrophobicContact CG1-CG2 3.56Å; R230-T232 VanDerWaalsContact C-N 3.28Å; R230-T232 PolarHBondContact O-N 3.25Å; T232-Q234 PolarHBondContact O-N 3.01Å; T232-A235 PolarHBondContact O-N 3.05Å; T232-F236 VanDerWaalsContact O-CB 3.31Å; T232-F236 WeakPolarHBondContact O-CB 3.09Å; T232-F236 PolarHBondContact O-N 3.37Å; T232-W260 HydrophobicContact CG2-CH2 4.27Å; T232-W260 HydrophobicContact CG2-CZ2 4.27Å; T232-L295 WeakPolarHBondContact OG1-CD1 3.15Å
233	P	95.7	Very high	89.8	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.006	15%	0.145	C	C	.	.	H	α-helix	trans	-56.6	-47.6	178.5	-28.4	37.2	0	0	0	113.6	Y218 R230 F236 S237 I253 W260	Y218-P233 VanDerWaalsContact CB-CB 3.5Å; Y218-P233 HydrophobicContact CD1-CG 3.87Å; Y218-P233 HydrophobicContact CD2-CB 4.37Å; Y218-P233 HydrophobicContact CD2-CG 3.79Å; Y218-P233 HydrophobicContact CG-CB 3.98Å; Y218-P233 HydrophobicContact CG-CG 3.44Å; Y218-P233 VanDerWaalsContact CG-CG 3.44Å; R230-P233 HydrophobicContact CB-CG 4.46Å; R230-P233 WeakPolarHBondContact O-CD 3.32Å; P233-F236 WeakPolarHBondContact O-CB 3.2Å; P233-F236 PolarHBondContact O-N 3.25Å; P233-S237 PolarHBondContact O-N 2.94Å; P233-S237 PolarHBondContact O-OG 3.33Å; P233-I253 HydrophobicContact CB-CB 4.12Å; P233-I253 HydrophobicContact CB-CG2 3.79Å; P233-I253 HydrophobicContact CG-CG2 4.32Å; P233-W260 HydrophobicContact CB-CZ2 4.43Å; P233-W260 HydrophobicContact CG-CZ2 4.07Å
234	Q	94.7	Very high	89.8	Confident	15 Å²	15	28.2 Å²	28.2	7%	0.07	14%	0.143	C	C	.	.	H	α-helix	trans	-66.4	-41.1	179.6	-77	-63.4	-24.4	0	0	112.7	N219 V225 T232 F236 H238 H290	N219-Q234 VanDerWaalsContact CB-NE2 3.31Å; V225-Q234 HydrophobicContact CG1-CG 4.14Å; V225-Q234 VanDerWaalsContact CG2-NE2 3.26Å; T232-Q234 PolarHBondContact O-N 3.01Å; Q234-F236 VanDerWaalsContact C-N 3.32Å; Q234-H238 PolarHBondContact O-N 2.9Å; Q234-H238 VanDerWaalsContact O-N 3.15Å; Q234-H290 PolarHBondContact O-CE1 3.14Å; Q234-H290 PolarHBondContact OE1-ND1 3.15Å
235	A	95.6	Very high	89.5	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-68.5	-31.5	175.7	0	0	0	0	0	112.4	N231 T232 F239 L295 L299	N231-A235 WeakPolarHBondContact O-CB 3.15Å; N231-A235 PolarHBondContact O-N 3.2Å; T232-A235 PolarHBondContact O-N 3.05Å; A235-F239 WeakPolarHBondContact O-CB 3.47Å; A235-F239 PolarHBondContact O-N 3.5Å; A235-L295 HydrophobicContact CB-CB 3.66Å; A235-L295 HydrophobicContact CB-CD1 4.43Å; A235-L299 HydrophobicContact CB-CD1 4.34Å
236	F	97	Very high	89.5	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-65.3	-51.6	174.4	169.4	-100.3	0	0	0	111.4	W172 Y176 V186 I188 T232 P233 Q234 H238 F239 T240 V250 I253 W260	W172-F236 HydrophobicContact CB-CE2 4.36Å; W172-F236 HydrophobicContact CB-CZ 4.1Å; Y176-F236 HydrophobicContact CD1-CD2 4.34Å; Y176-F236 HydrophobicContact CD2-CB 4.26Å; Y176-F236 AromaticContact CD2-CD2 3.85Å; Y176-F236 HydrophobicContact CD2-CD2 3.85Å; Y176-F236 HydrophobicContact CE2-CB 4.21Å; Y176-F236 AromaticContact CG-CD2 3.7Å; Y176-F236 HydrophobicContact CG-CD2 3.7Å; Y176-F236 HydrophobicContact CG-CE2 4.43Å; V186-F236 HydrophobicContact CG2-CD2 4.25Å; V186-F236 HydrophobicContact CG2-CE2 4.45Å; I188-F236 HydrophobicContact CD1-CZ 4.42Å; T232-F236 VanDerWaalsContact O-CB 3.31Å; T232-F236 WeakPolarHBondContact O-CB 3.09Å; T232-F236 PolarHBondContact O-N 3.37Å; P233-F236 WeakPolarHBondContact O-CB 3.2Å; P233-F236 PolarHBondContact O-N 3.25Å; Q234-F236 VanDerWaalsContact C-N 3.32Å; F236-H238 PolarHBondContact O-N 3.29Å; F236-F239 WeakPolarHBondContact O-CB 3.24Å; F236-F239 PolarHBondContact O-N 2.93Å; F236-F239 VanDerWaalsContact O-N 3.11Å; F236-T240 HydrophobicContact CD2-CG2 4.32Å; F236-T240 HydrophobicContact CE1-CG2 4.09Å; F236-T240 HydrophobicContact CE2-CG2 3.83Å; F236-T240 HydrophobicContact CZ-CG2 3.71Å; F236-T240 WeakPolarHBondContact O-CG2 3.25Å; F236-T240 PolarHBondContact O-N 3.27Å; F236-V250 HydrophobicContact CE1-CB 3.83Å; F236-V250 HydrophobicContact CE1-CG1 3.75Å; F236-V250 HydrophobicContact CZ-CB 4.25Å; F236-V250 HydrophobicContact CZ-CG1 4.24Å; F236-I253 HydrophobicContact CD1-CD1 3.6Å; F236-I253 HydrophobicContact CD1-CG1 4.16Å; F236-I253 HydrophobicContact CE1-CD1 3.58Å; F236-W260 HydrophobicContact CB-CH2 3.77Å; F236-W260 HydrophobicContact CB-CZ3 4.02Å; F236-W260 HydrophobicContact CD1-CE3 4.38Å; F236-W260 HydrophobicContact CD1-CH2 4.06Å; F236-W260 AromaticContact CD1-CZ3 3.48Å; F236-W260 HydrophobicContact CD1-CZ3 3.48Å; F236-W260 VanDerWaalsContact CD1-CZ3 3.48Å; F236-W260 HydrophobicContact CD2-CH2 4.45Å; F236-W260 AromaticContact CD2-CZ3 3.97Å; F236-W260 HydrophobicContact CD2-CZ3 3.97Å; F236-W260 HydrophobicContact CE1-CE3 4.44Å; F236-W260 AromaticContact CE1-CZ3 3.87Å; F236-W260 HydrophobicContact CE1-CZ3 3.87Å; F236-W260 HydrophobicContact CE2-CZ3 4.34Å; F236-W260 AromaticContact CG-CH2 3.83Å; F236-W260 HydrophobicContact CG-CH2 3.83Å; F236-W260 AromaticContact CG-CZ3 3.53Å; F236-W260 HydrophobicContact CG-CZ3 3.53Å; F236-W260 HydrophobicContact CZ-CZ3 4.29Å
237	S	97.9	Very high	89.6	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-56.6	-50.3	177.3	-64.6	0	0	0	0	111.1	N219 P233 F239 T240 F241 I249 V250 F286	N219-S237 PolarHBondContact ND2-OG 3.07Å; N219-S237 VanDerWaalsContact ND2-OG 3.15Å; P233-S237 PolarHBondContact O-N 2.94Å; P233-S237 PolarHBondContact O-OG 3.33Å; S237-F239 VanDerWaalsContact C-N 3.31Å; S237-F239 PolarHBondContact O-N 2.89Å; S237-T240 PolarHBondContact O-N 2.91Å; S237-T240 VanDerWaalsContact O-N 3.09Å; S237-T240 PolarHBondContact O-OG1 3.47Å; S237-F241 PolarHBondContact O-N 2.81Å; S237-I249 WeakPolarHBondContact O-CG1 3.47Å; S237-V250 WeakPolarHBondContact CA-O 3.16Å; S237-V250 WeakPolarHBondContact CB-O 3.4Å; S237-V250 PolarHBondContact OG-O 3.44Å; S237-F286 VanDerWaalsContact CB-CZ 3.47Å
238	H	96	Very high	90.5	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-58.9	-41.6	175.6	-172.8	177.2	0	0	0	112	Q234 F236 T240 F241 E242 F286 H290 C292 L301 S302	Q234-H238 PolarHBondContact O-N 2.9Å; Q234-H238 VanDerWaalsContact O-N 3.15Å; F236-H238 PolarHBondContact O-N 3.29Å; H238-T240 VanDerWaalsContact C-N 3.33Å; H238-T240 PolarHBondContact O-N 2.81Å; H238-F241 WeakPolarHBondContact O-CB 3.39Å; H238-F241 PolarHBondContact O-N 2.93Å; H238-E242 IonicContact NE2-OE1 2.86Å; H238-E242 PolarHBondContact O-N 2.65Å; H238-F286 HydrophobicContact CB-CE1 4.26Å; H238-F286 HydrophobicContact CB-CZ 4.22Å; H238-H290 AromaticContact CE1-NE2 3.97Å; H238-H290 AromaticContact CG-NE2 3.67Å; H238-H290 AromaticContact ND1-CD2 3.65Å; H238-H290 AromaticContact ND1-CE1 3.87Å; H238-H290 AromaticContact ND1-NE2 2.99Å; H238-H290 PolarHBondContact ND1-NE2 3.25Å; H238-C292 VanDerWaalsContact CE1-SG 3.52Å; H238-L301 HydrophobicContact CB-CD1 3.98Å; H238-S302 PolarHBondContact CE1-O 3.01Å; H238-S302 PolarHBondContact NE2-O 3.42Å; H238-S302 VanDerWaalsContact NE2-O 3.11Å
239	F	94.5	Very high	91.5	Very high	6 Å²	6	19.6 Å²	19.6	3%	0.026	9%	0.092	C	C	.	.	H	α-helix	trans	-57.7	-44.1	174.9	169.4	-92	0	0	0	112.3	E175 Y176 Q179 A235 F236 S237 F241 E242 R243 L299 L301	E175-F239 HydrophobicContact CB-CE1 4.39Å; E175-F239 HydrophobicContact CG-CE1 3.93Å; E175-F239 HydrophobicContact CG-CZ 3.86Å; Y176-F239 HydrophobicContact CD2-CB 3.84Å; Y176-F239 AromaticContact CD2-CD1 3.7Å; Y176-F239 HydrophobicContact CD2-CD1 3.7Å; Y176-F239 HydrophobicContact CD2-CD2 4.3Å; Y176-F239 HydrophobicContact CD2-CE1 4.33Å; Y176-F239 AromaticContact CD2-CG 3.67Å; Y176-F239 HydrophobicContact CD2-CG 3.67Å; Y176-F239 HydrophobicContact CE2-CB 4.23Å; Y176-F239 HydrophobicContact CE2-CG 4.43Å; Y176-F239 HydrophobicContact CG-CD1 4.28Å; Q179-F239 HydrophobicContact CG-CD2 4.41Å; Q179-F239 HydrophobicContact CG-CE2 3.54Å; Q179-F239 HydrophobicContact CG-CZ 3.78Å; A235-F239 WeakPolarHBondContact O-CB 3.47Å; A235-F239 PolarHBondContact O-N 3.5Å; F236-F239 WeakPolarHBondContact O-CB 3.24Å; F236-F239 PolarHBondContact O-N 2.93Å; F236-F239 VanDerWaalsContact O-N 3.11Å; S237-F239 VanDerWaalsContact C-N 3.31Å; S237-F239 PolarHBondContact O-N 2.89Å; F239-F241 VanDerWaalsContact C-N 3.3Å; F239-F241 PolarHBondContact O-N 3.21Å; F239-E242 PolarHBondContact O-N 3.49Å; F239-R243 HydrophobicContact CD1-CB 4.46Å; F239-R243 HydrophobicContact CE1-CB 4.14Å; F239-R243 HydrophobicContact CE1-CG 4.15Å; F239-R243 HydrophobicContact CE2-CB 4.33Å; F239-R243 HydrophobicContact CE2-CG 4.34Å; F239-R243 HydrophobicContact CZ-CB 4.07Å; F239-R243 HydrophobicContact CZ-CG 3.82Å; F239-R243 WeakPolarHBondContact O-CB 3.33Å; F239-R243 PolarHBondContact O-N 2.75Å; F239-L299 HydrophobicContact CD2-CD2 4.41Å; F239-L301 HydrophobicContact CB-CD1 4.08Å; F239-L301 HydrophobicContact CB-CD2 4.42Å; F239-L301 HydrophobicContact CD2-CD2 4.2Å
240	T	94.7	Very high	92.8	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-64.3	-36.1	179.5	63.6	0	0	0	0	112.6	W172 F236 S237 H238 S244 V250	W172-T240 HydrophobicContact CB-CG2 3.79Å; W172-T240 HydrophobicContact CD2-CG2 4.26Å; W172-T240 HydrophobicContact CE3-CG2 4.15Å; W172-T240 HydrophobicContact CG-CG2 4.14Å; F236-T240 HydrophobicContact CD2-CG2 4.32Å; F236-T240 HydrophobicContact CE1-CG2 4.09Å; F236-T240 HydrophobicContact CE2-CG2 3.83Å; F236-T240 HydrophobicContact CZ-CG2 3.71Å; F236-T240 WeakPolarHBondContact O-CG2 3.25Å; F236-T240 PolarHBondContact O-N 3.27Å; S237-T240 PolarHBondContact O-N 2.91Å; S237-T240 VanDerWaalsContact O-N 3.09Å; S237-T240 PolarHBondContact O-OG1 3.47Å; H238-T240 VanDerWaalsContact C-N 3.33Å; H238-T240 PolarHBondContact O-N 2.81Å; T240-S244 WeakPolarHBondContact O-CB 3.38Å; T240-S244 PolarHBondContact O-N 2.95Å; T240-S244 PolarHBondContact O-OG 3.18Å; T240-V250 HydrophobicContact CG2-CB 4.03Å; T240-V250 HydrophobicContact CG2-CG2 3.78Å; T240-V250 PolarHBondContact OG1-N 3.36Å
241	F	93.5	Very high	93.3	Very high	0 Å²	0	14 Å²	14	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-62.6	-53	174.5	-177.6	-99.1	0	0	0	112.3	S237 H238 F239 R243 S244 H246 L248 I249 M283 F287 S546 L559 I562	S237-F241 PolarHBondContact O-N 2.81Å; H238-F241 WeakPolarHBondContact O-CB 3.39Å; H238-F241 PolarHBondContact O-N 2.93Å; F239-F241 VanDerWaalsContact C-N 3.3Å; F239-F241 PolarHBondContact O-N 3.21Å; F241-R243 PolarHBondContact O-N 3.41Å; F241-S244 PolarHBondContact O-N 3.26Å; F241-S244 PolarHBondContact O-OG 3.44Å; F241-S244 VanDerWaalsContact O-OG 3.11Å; F241-H246 AromaticContact CD1-CD2 3.63Å; F241-H246 HydrophobicContact CD2-CB 4.43Å; F241-H246 HydrophobicContact CE1-CB 3.99Å; F241-H246 AromaticContact CE1-CD2 3.17Å; F241-H246 WeakPolarHBondContact CE1-CD2 3.19Å; F241-H246 AromaticContact CE1-CG 3.74Å; F241-H246 HydrophobicContact CE2-CB 3.69Å; F241-H246 HydrophobicContact CZ-CB 3.45Å; F241-H246 VanDerWaalsContact CZ-CB 3.45Å; F241-H246 AromaticContact CZ-CD2 3.62Å; F241-H246 AromaticContact CZ-CG 3.68Å; F241-H246 WeakPolarHBondContact O-CA 3.4Å; F241-H246 PolarHBondContact O-N 3.4Å; F241-L248 VanDerWaalsContact CA-O 3.26Å; F241-L248 WeakPolarHBondContact CA-O 3.22Å; F241-I249 HydrophobicContact CB-CB 4.14Å; F241-I249 HydrophobicContact CB-CD1 4.07Å; F241-I249 HydrophobicContact CB-CG1 4.09Å; F241-I249 HydrophobicContact CD2-CB 4.24Å; F241-M283 HydrophobicContact CD2-SD 4.5Å; F241-M283 HydrophobicContact CE2-CG 4.47Å; F241-M283 HydrophobicContact CE2-SD 3.98Å; F241-F287 HydrophobicContact CB-CZ 4.26Å; F241-F287 AromaticContact CD1-CE2 3.6Å; F241-F287 HydrophobicContact CD1-CE2 3.6Å; F241-F287 AromaticContact CD1-CZ 3.3Å; F241-F287 HydrophobicContact CD1-CZ 3.3Å; F241-F287 AromaticContact CD2-CE2 3.94Å; F241-F287 HydrophobicContact CD2-CE2 3.94Å; F241-F287 HydrophobicContact CD2-CZ 4.36Å; F241-F287 AromaticContact CE1-CE2 3.51Å; F241-F287 HydrophobicContact CE1-CE2 3.51Å; F241-F287 AromaticContact CE1-CZ 3.54Å; F241-F287 HydrophobicContact CE1-CZ 3.54Å; F241-F287 AromaticContact CE2-CE2 3.9Å; F241-F287 HydrophobicContact CE2-CE2 3.9Å; F241-F287 AromaticContact CG-CE2 3.78Å; F241-F287 HydrophobicContact CG-CE2 3.78Å; F241-F287 AromaticContact CG-CZ 3.71Å; F241-F287 HydrophobicContact CG-CZ 3.71Å; F241-F287 AromaticContact CZ-CE2 3.67Å; F241-F287 HydrophobicContact CZ-CE2 3.67Å; F241-F287 HydrophobicContact CZ-CZ 4.19Å; F241-S546 WeakPolarHBondContact CE1-OG 3.46Å; F241-L559 HydrophobicContact CE1-CD2 3.83Å; F241-L559 HydrophobicContact CZ-CD2 3.79Å; F241-I562 HydrophobicContact CE2-CD1 3.61Å; F241-I562 HydrophobicContact CZ-CD1 3.45Å; F241-I562 VanDerWaalsContact CZ-CD1 3.45Å
242	E	89.2	Confident	93.5	Very high	5 Å²	5	11.5 Å²	11.5	2%	0.023	5%	0.049	C	C	.	.	H	α-helix	trans	-64.9	-41.8	179.7	-72.9	-74.5	-164	0	0	112.2	H238 F239 S244 G245 H246 L301 S302 S545 S546	H238-E242 IonicContact NE2-OE1 2.86Å; H238-E242 PolarHBondContact O-N 2.65Å; F239-E242 PolarHBondContact O-N 3.49Å; E242-S244 VanDerWaalsContact C-N 3.33Å; E242-S244 PolarHBondContact O-N 3.17Å; E242-G245 PolarHBondContact O-N 3.15Å; E242-H246 IonicContact OE2-NE2 3.24Å; E242-H246 PolarHBondContact OE2-NE2 3.46Å; E242-L301 HydrophobicContact CB-CD2 4.06Å; E242-L301 HydrophobicContact CG-CB 4.35Å; E242-L301 HydrophobicContact CG-CD2 4.16Å; E242-S302 WeakPolarHBondContact OE1-CB 3.47Å; E242-S302 PolarHBondContact OE1-N 3.2Å; E242-S545 WeakPolarHBondContact OE2-CA 3.31Å; E242-S545 PolarHBondContact OE2-N 2.95Å; E242-S546 WeakPolarHBondContact OE1-CB 3.43Å; E242-S546 PolarHBondContact OE1-N 3.15Å; E242-S546 PolarHBondContact OE1-OG 3.3Å; E242-S546 PolarHBondContact OE2-N 2.93Å
243	R	87.4	Confident	93.7	Very high	36 Å²	36	11.1 Å²	11.1	14%	0.136	5%	0.047	C	C	.	.	H	α-helix	trans	-71.2	-29.6	-175.6	-166.4	71.3	175.2	111.2	-0.2	112.5	W172 E175 F239 F241 G245	W172-R243 HydrophobicContact CZ3-CB 3.91Å; W172-R243 HydrophobicContact CZ3-CG 3.92Å; E175-R243 HydrophobicContact CG-CG 4.13Å; E175-R243 IonicContact OE1-CZ 2.64Å; E175-R243 VanDerWaalsContact OE1-CZ 3.25Å; E175-R243 IonicContact OE1-NE 3.35Å; E175-R243 PolarHBondContact OE1-NE 2.87Å; E175-R243 IonicContact OE1-NH2 3.86Å; E175-R243 PolarHBondContact OE1-NH2 2.72Å; F239-R243 HydrophobicContact CD1-CB 4.46Å; F239-R243 HydrophobicContact CE1-CB 4.14Å; F239-R243 HydrophobicContact CE1-CG 4.15Å; F239-R243 HydrophobicContact CE2-CB 4.33Å; F239-R243 HydrophobicContact CE2-CG 4.34Å; F239-R243 HydrophobicContact CZ-CB 4.07Å; F239-R243 HydrophobicContact CZ-CG 3.82Å; F239-R243 WeakPolarHBondContact O-CB 3.33Å; F239-R243 PolarHBondContact O-N 2.75Å; F241-R243 PolarHBondContact O-N 3.41Å; R243-G245 VanDerWaalsContact C-N 3.28Å
244	S	87.7	Confident	93.6	Very high	5 Å²	5	12.4 Å²	12.4	4%	0.035	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	0.7	176.7	72.7	0	0	0	0	114	T240 F241 E242 H246 R247 L248	T240-S244 WeakPolarHBondContact O-CB 3.38Å; T240-S244 PolarHBondContact O-N 2.95Å; T240-S244 PolarHBondContact O-OG 3.18Å; F241-S244 PolarHBondContact O-N 3.26Å; F241-S244 PolarHBondContact O-OG 3.44Å; F241-S244 VanDerWaalsContact O-OG 3.11Å; E242-S244 VanDerWaalsContact C-N 3.33Å; E242-S244 PolarHBondContact O-N 3.17Å; S244-H246 VanDerWaalsContact C-N 3.35Å; S244-R247 WeakPolarHBondContact O-CG 3.39Å; S244-R247 PolarHBondContact OG-N 2.94Å; S244-L248 PolarHBondContact OG-N 3.27Å; S244-L248 VanDerWaalsContact OG-N 3.15Å; S244-L248 PolarHBondContact OG-O 2.96Å
245	G	84.5	Confident	93.6	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.01	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	40.5	-172.7	0	0	0	0	0	112.1	E242 R243 R247	E242-G245 PolarHBondContact O-N 3.15Å; R243-G245 VanDerWaalsContact C-N 3.28Å; G245-R247 PolarHBondContact O-N 3.07Å; G245-R247 VanDerWaalsContact O-N 3.07Å
246	H	88.9	Confident	93.4	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	1.2	179.7	-40.8	136.9	0	0	0	114.8	F241 E242 S244 L248 I558 L559	F241-H246 AromaticContact CD1-CD2 3.63Å; F241-H246 HydrophobicContact CD2-CB 4.43Å; F241-H246 HydrophobicContact CE1-CB 3.99Å; F241-H246 AromaticContact CE1-CD2 3.17Å; F241-H246 WeakPolarHBondContact CE1-CD2 3.19Å; F241-H246 AromaticContact CE1-CG 3.74Å; F241-H246 HydrophobicContact CE2-CB 3.69Å; F241-H246 HydrophobicContact CZ-CB 3.45Å; F241-H246 VanDerWaalsContact CZ-CB 3.45Å; F241-H246 AromaticContact CZ-CD2 3.62Å; F241-H246 AromaticContact CZ-CG 3.68Å; F241-H246 WeakPolarHBondContact O-CA 3.4Å; F241-H246 PolarHBondContact O-N 3.4Å; E242-H246 IonicContact OE2-NE2 3.24Å; E242-H246 PolarHBondContact OE2-NE2 3.46Å; S244-H246 VanDerWaalsContact C-N 3.35Å; H246-L248 VanDerWaalsContact C-N 3.32Å; H246-L248 PolarHBondContact O-N 2.84Å; H246-I558 HydrophobicContact CB-CB 4.14Å; H246-I558 HydrophobicContact CB-CD1 4.34Å; H246-I558 HydrophobicContact CB-CG2 3.97Å; H246-I558 WeakPolarHBondContact O-CG2 3.37Å; H246-L559 VanDerWaalsContact CE1-CD1 3.46Å; H246-L559 WeakPolarHBondContact CE1-CD1 3.35Å
247	R	88.8	Confident	93.2	Very high	128 Å²	128	14.5 Å²	14.5	48%	0.483	7%	0.073	S	C	.	.	S	Bend	trans	-69.8	-29	-175.1	-66.5	179.6	179.9	-121.8	-3.5	113.2	S244 G245 T267 F268 I558	S244-R247 WeakPolarHBondContact O-CG 3.39Å; S244-R247 PolarHBondContact OG-N 2.94Å; G245-R247 PolarHBondContact O-N 3.07Å; G245-R247 VanDerWaalsContact O-N 3.07Å; R247-T267 WeakPolarHBondContact O-CA 3.49Å; R247-F268 HydrophobicContact CB-CD1 4.19Å; R247-F268 HydrophobicContact CG-CD1 4.42Å; R247-F268 PolarHBondContact O-N 3.31Å; R247-I558 HydrophobicContact CG-CD1 4.25Å
248	L	94.2	Very high	93.1	Very high	21 Å²	21	16.7 Å²	16.7	11%	0.11	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	163.8	177.6	67.1	81.6	0	0	0	112.7	W172 F241 S244 H246 V250 I265 H266 T267	W172-L248 HydrophobicContact CD2-CD1 4.37Å; W172-L248 HydrophobicContact CZ2-CD1 3.84Å; W172-L248 HydrophobicContact CZ2-CD2 3.86Å; W172-L248 HydrophobicContact CZ2-CG 4.12Å; F241-L248 VanDerWaalsContact CA-O 3.26Å; F241-L248 WeakPolarHBondContact CA-O 3.22Å; S244-L248 PolarHBondContact OG-N 3.27Å; S244-L248 VanDerWaalsContact OG-N 3.15Å; S244-L248 PolarHBondContact OG-O 2.96Å; H246-L248 VanDerWaalsContact C-N 3.32Å; H246-L248 PolarHBondContact O-N 2.84Å; L248-V250 HydrophobicContact CD1-CG2 4.26Å; L248-I265 HydrophobicContact CB-CG2 4.01Å; L248-I265 HydrophobicContact CD1-CG2 4.36Å; L248-H266 CarbonylContact C-O 3.45Å; L248-H266 WeakPolarHBondContact CA-O 3.44Å; L248-H266 VanDerWaalsContact CB-O 3.31Å; L248-H266 WeakPolarHBondContact CB-O 3.34Å; L248-T267 HydrophobicContact CB-CG2 4.25Å
249	I	97.2	Very high	93.1	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	137.4	168.7	-173	172	0	0	0	110	S237 F241 V251 I265 H266 M283 F286	S237-I249 WeakPolarHBondContact O-CG1 3.47Å; F241-I249 HydrophobicContact CB-CB 4.14Å; F241-I249 HydrophobicContact CB-CD1 4.07Å; F241-I249 HydrophobicContact CB-CG1 4.09Å; F241-I249 HydrophobicContact CD2-CB 4.24Å; I249-V251 HydrophobicContact CD1-CG1 4.19Å; I249-V251 HydrophobicContact CG1-CG1 4.02Å; I249-V251 HydrophobicContact CG2-CG1 4.27Å; I249-I265 WeakPolarHBondContact O-CA 3.15Å; I249-H266 HydrophobicContact CG2-CB 3.75Å; I249-H266 PolarHBondContact N-O 2.97Å; I249-H266 PolarHBondContact O-N 3.33Å; I249-M283 HydrophobicContact CG2-CE 4.4Å; I249-M283 HydrophobicContact CG2-CG 3.68Å; I249-F286 HydrophobicContact CD1-CB 4.17Å; I249-F286 HydrophobicContact CD1-CD1 3.24Å; I249-F286 HydrophobicContact CD1-CD2 3.96Å; I249-F286 HydrophobicContact CD1-CE1 3.5Å; I249-F286 HydrophobicContact CD1-CE2 4.18Å; I249-F286 HydrophobicContact CD1-CG 3.5Å; I249-F286 VanDerWaalsContact CD1-CG 3.5Å; I249-F286 HydrophobicContact CD1-CZ 3.97Å
250	V	98.6	Very high	93.2	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	123.5	174.3	-172.1	0	0	0	0	109.4	A169 W172 F236 S237 T240 L248 I253 P263 I265	A169-V250 HydrophobicContact CB-CG1 3.94Å; W172-V250 HydrophobicContact CB-CG2 4.08Å; W172-V250 HydrophobicContact CG-CG2 3.95Å; F236-V250 HydrophobicContact CE1-CB 3.83Å; F236-V250 HydrophobicContact CE1-CG1 3.75Å; F236-V250 HydrophobicContact CZ-CB 4.25Å; F236-V250 HydrophobicContact CZ-CG1 4.24Å; S237-V250 WeakPolarHBondContact CA-O 3.16Å; S237-V250 WeakPolarHBondContact CB-O 3.4Å; S237-V250 PolarHBondContact OG-O 3.44Å; T240-V250 HydrophobicContact CG2-CB 4.03Å; T240-V250 HydrophobicContact CG2-CG2 3.78Å; T240-V250 PolarHBondContact OG1-N 3.36Å; L248-V250 HydrophobicContact CD1-CG2 4.26Å; V250-I253 HydrophobicContact CG1-CD1 4.13Å; V250-P263 HydrophobicContact CG1-CB 4.01Å; V250-I265 HydrophobicContact CG2-CG1 4.22Å
251	V	97.9	Very high	93.2	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	-168.9	-175.1	-65	0	0	0	0	110	N221 I249 I253 Q264 F286	N221-V251 HydrophobicContact CB-CG2 3.82Å; I249-V251 HydrophobicContact CD1-CG1 4.19Å; I249-V251 HydrophobicContact CG1-CG1 4.02Å; I249-V251 HydrophobicContact CG2-CG1 4.27Å; V251-I253 VanDerWaalsContact C-N 3.28Å; V251-I253 PolarHBondContact O-N 3.04Å; V251-Q264 HydrophobicContact CG2-CB 4.09Å; V251-Q264 HydrophobicContact CG2-CG 4.44Å; V251-Q264 WeakPolarHBondContact CG2-O 3.46Å; V251-Q264 PolarHBondContact N-O 2.87Å; V251-Q264 PolarHBondContact O-N 2.97Å; V251-F286 HydrophobicContact CG1-CD2 4.07Å
252	D	96.4	Very high	93.3	Very high	15 Å²	15	20.9 Å²	20.9	8%	0.08	11%	0.106	C	C	.	.			trans	51.6	47.6	-168.4	-82.5	-44.6	0	0	0	111.8	K217 N219 S220 N221 Q254 Q264	K217-D252 WeakPolarHBondContact CE-OD1 3Å; K217-D252 IonicContact NZ-OD1 2.73Å; K217-D252 PolarHBondContact NZ-OD1 3.24Å; N219-D252 PolarHBondContact OD1-N 2.92Å; S220-D252 WeakPolarHBondContact CA-OD1 3.1Å; S220-D252 WeakPolarHBondContact CB-OD1 3.49Å; N221-D252 WeakPolarHBondContact CB-OD2 3.45Å; N221-D252 VanDerWaalsContact N-CG 3.35Å; N221-D252 PolarHBondContact N-OD1 3.09Å; N221-D252 PolarHBondContact N-OD2 3.49Å; N221-D252 PolarHBondContact OD1-OD2 2.73Å; D252-Q254 WeakPolarHBondContact O-CG 3.4Å; D252-Q254 PolarHBondContact O-N 2.83Å; D252-Q254 VanDerWaalsContact O-N 3.11Å; D252-Q264 HydrophobicContact CB-CB 3.93Å; D252-Q264 VanDerWaalsContact OD2-CB 3.31Å; D252-Q264 WeakPolarHBondContact OD2-CB 3.44Å
253	I	97	Very high	93.7	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.005	11%	0.109	C	C	.	.			trans	-73.5	108.3	179.6	-52.6	-54.2	0	0	0	108.7	Y218 N219 P233 F236 V250 V251 W260	Y218-I253 WeakPolarHBondContact CB-O 3.48Å; Y218-I253 HydrophobicContact CD2-CG2 4.14Å; Y218-I253 WeakPolarHBondContact CD2-O 3.41Å; Y218-I253 PolarHBondContact N-O 3.01Å; N219-I253 PolarHBondContact N-O 3.29Å; N219-I253 WeakPolarHBondContact OD1-CB 3.43Å; N219-I253 WeakPolarHBondContact OD1-CG1 3.16Å; N219-I253 PolarHBondContact OD1-N 2.97Å; P233-I253 HydrophobicContact CB-CB 4.12Å; P233-I253 HydrophobicContact CB-CG2 3.79Å; P233-I253 HydrophobicContact CG-CG2 4.32Å; F236-I253 HydrophobicContact CD1-CD1 3.6Å; F236-I253 HydrophobicContact CD1-CG1 4.16Å; F236-I253 HydrophobicContact CE1-CD1 3.58Å; V250-I253 HydrophobicContact CG1-CD1 4.13Å; V251-I253 VanDerWaalsContact C-N 3.28Å; V251-I253 PolarHBondContact O-N 3.04Å; I253-W260 HydrophobicContact CD1-CE3 4.41Å; I253-W260 HydrophobicContact CG2-CD2 3.35Å; I253-W260 HydrophobicContact CG2-CE3 3.65Å; I253-W260 HydrophobicContact CG2-CG 3.82Å; I253-W260 HydrophobicContact CG2-CH2 3.89Å; I253-W260 HydrophobicContact CG2-CZ2 3.64Å; I253-W260 HydrophobicContact CG2-CZ3 3.92Å
254	Q	94.4	Very high	94.1	Very high	28 Å²	28	20.7 Å²	20.7	13%	0.131	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	154.4	-177.2	60.6	-168.1	-20.3	0	0	112.1	Y215 R216 K217 D252 W260 T261 D262	Y215-Q254 HydrophobicContact CE1-CB 4.29Å; Y215-Q254 WeakPolarHBondContact OH-CG 3.32Å; Y215-Q254 PolarHBondContact OH-OE1 3.27Å; Y215-Q254 VanDerWaalsContact OH-OE1 3.07Å; R216-Q254 CarbonylContact O-C 3.52Å; R216-Q254 VanDerWaalsContact O-CA 3.3Å; R216-Q254 WeakPolarHBondContact O-CA 3.49Å; K217-Q254 HydrophobicContact CB-CB 4.1Å; K217-Q254 HydrophobicContact CG-CB 4.17Å; D252-Q254 WeakPolarHBondContact O-CG 3.4Å; D252-Q254 PolarHBondContact O-N 2.83Å; D252-Q254 VanDerWaalsContact O-N 3.11Å; Q254-W260 CarbonylContact O-C 3.48Å; Q254-W260 WeakPolarHBondContact O-CA 3.33Å; Q254-W260 VanDerWaalsContact O-CB 3.25Å; Q254-W260 WeakPolarHBondContact O-CB 3.22Å; Q254-T261 VanDerWaalsContact CG-O 3.24Å; Q254-T261 WeakPolarHBondContact CG-O 3.31Å; Q254-T261 PolarHBondContact O-N 2.92Å; Q254-D262 PolarHBondContact NE2-O 3.01Å
255	G	93.9	Very high	94.6	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	142.4	-150.1	-179.9	0	0	0	0	0	112.5	R216	R216-G255 PolarHBondContact N-O 3.41Å; R216-G255 PolarHBondContact O-N 3.26Å
256	V	92.8	Very high	95.3	Very high	27 Å²	27	20.4 Å²	20.4	16%	0.164	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.8	-175.7	-174.7	0	0	0	0	110.4	I211 N258 L259	I211-V256 HydrophobicContact CB-CG2 4.29Å; I211-V256 HydrophobicContact CG2-CB 3.59Å; I211-V256 HydrophobicContact CG2-CG1 4.45Å; I211-V256 HydrophobicContact CG2-CG2 3.6Å; V256-N258 PolarHBondContact O-N 3.38Å; V256-L259 PolarHBondContact N-O 2.96Å; V256-L259 PolarHBondContact O-N 2.9Å; V256-L259 VanDerWaalsContact O-O 3.13Å
257	G	92.7	Very high	95.6	Very high	31 Å²	31	20.9 Å²	20.9	32%	0.32	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	-112.9	177.9	0	0	0	0	0	112.7	Y218 R230 W260	Y218-G257 PolarHBondContact OH-O 3.01Å; R230-G257 VanDerWaalsContact CZ-O 3.28Å; R230-G257 PolarHBondContact NH1-O 3.46Å; R230-G257 PolarHBondContact NH2-O 3.32Å; G257-W260 PolarHBondContact O-NE1 2.97Å
258	N	94.4	Very high	95.6	Very high	46 Å²	46	17.2 Å²	17.2	25%	0.246	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.7	10.4	176.1	-50.9	-63.4	0	0	0	112.7	K185 V186 D187 R230 V256	K185-N258 WeakPolarHBondContact O-CB 3.17Å; V186-N258 WeakPolarHBondContact CA-O 3.45Å; V186-N258 HydrophobicContact CG1-CB 4.32Å; D187-N258 PolarHBondContact N-O 3.41Å; R230-N258 PolarHBondContact NH2-OD1 2.88Å; V256-N258 PolarHBondContact O-N 3.38Å
259	L	96.2	Very high	95.4	Very high	64 Å²	64	19 Å²	19	34%	0.335	11%	0.106	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	111.1	172.6	-178.3	60.8	0	0	0	107.8	D187 I211 V256	D187-L259 HydrophobicContact CB-CD1 4.07Å; D187-L259 WeakPolarHBondContact O-CA 3.24Å; I211-L259 HydrophobicContact CD1-CD2 4.11Å; I211-L259 HydrophobicContact CD1-CG 4.05Å; I211-L259 HydrophobicContact CG1-CD2 3.99Å; I211-L259 HydrophobicContact CG1-CG 4.49Å; I211-L259 HydrophobicContact CG2-CD2 3.95Å; I211-L259 HydrophobicContact CG2-CG 4.49Å; V256-L259 PolarHBondContact N-O 2.96Å; V256-L259 PolarHBondContact O-N 2.9Å; V256-L259 VanDerWaalsContact O-O 3.13Å
260	W	97.3	Very high	95.2	Very high	3 Å²	3	20.8 Å²	20.8	1%	0.011	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	164.2	-172.4	-55.9	-36.5	0	0	0	111.9	V186 D187 I188 S189 Y218 T232 P233 F236 I253 Q254 G257	V186-W260 HydrophobicContact CB-CE3 4.33Å; V186-W260 HydrophobicContact CB-CH2 3.87Å; V186-W260 HydrophobicContact CB-CZ2 4.33Å; V186-W260 HydrophobicContact CB-CZ3 3.85Å; V186-W260 HydrophobicContact CG1-CH2 3.58Å; V186-W260 HydrophobicContact CG1-CZ2 3.93Å; V186-W260 HydrophobicContact CG1-CZ3 4.1Å; V186-W260 HydrophobicContact CG2-CH2 4.19Å; V186-W260 HydrophobicContact CG2-CZ3 3.86Å; D187-W260 PolarHBondContact O-N 3.31Å; I188-W260 CarbonylContact C-O 3.55Å; I188-W260 WeakPolarHBondContact CA-O 3.45Å; I188-W260 HydrophobicContact CG1-CB 4.11Å; I188-W260 HydrophobicContact CG1-CE3 4.28Å; S189-W260 WeakPolarHBondContact CB-O 3.46Å; S189-W260 PolarHBondContact N-O 2.89Å; Y218-W260 AromaticContact CE2-NE1 3.76Å; T232-W260 HydrophobicContact CG2-CH2 4.27Å; T232-W260 HydrophobicContact CG2-CZ2 4.27Å; P233-W260 HydrophobicContact CB-CZ2 4.43Å; P233-W260 HydrophobicContact CG-CZ2 4.07Å; F236-W260 HydrophobicContact CB-CH2 3.77Å; F236-W260 HydrophobicContact CB-CZ3 4.02Å; F236-W260 HydrophobicContact CD1-CE3 4.38Å; F236-W260 HydrophobicContact CD1-CH2 4.06Å; F236-W260 AromaticContact CD1-CZ3 3.48Å; F236-W260 HydrophobicContact CD1-CZ3 3.48Å; F236-W260 VanDerWaalsContact CD1-CZ3 3.48Å; F236-W260 HydrophobicContact CD2-CH2 4.45Å; F236-W260 AromaticContact CD2-CZ3 3.97Å; F236-W260 HydrophobicContact CD2-CZ3 3.97Å; F236-W260 HydrophobicContact CE1-CE3 4.44Å; F236-W260 AromaticContact CE1-CZ3 3.87Å; F236-W260 HydrophobicContact CE1-CZ3 3.87Å; F236-W260 HydrophobicContact CE2-CZ3 4.34Å; F236-W260 AromaticContact CG-CH2 3.83Å; F236-W260 HydrophobicContact CG-CH2 3.83Å; F236-W260 AromaticContact CG-CZ3 3.53Å; F236-W260 HydrophobicContact CG-CZ3 3.53Å; F236-W260 HydrophobicContact CZ-CZ3 4.29Å; I253-W260 HydrophobicContact CD1-CE3 4.41Å; I253-W260 HydrophobicContact CG2-CD2 3.35Å; I253-W260 HydrophobicContact CG2-CE3 3.65Å; I253-W260 HydrophobicContact CG2-CG 3.82Å; I253-W260 HydrophobicContact CG2-CH2 3.89Å; I253-W260 HydrophobicContact CG2-CZ2 3.64Å; I253-W260 HydrophobicContact CG2-CZ3 3.92Å; Q254-W260 CarbonylContact O-C 3.48Å; Q254-W260 WeakPolarHBondContact O-CA 3.33Å; Q254-W260 VanDerWaalsContact O-CB 3.25Å; Q254-W260 WeakPolarHBondContact O-CB 3.22Å; G257-W260 PolarHBondContact O-NE1 2.97Å
261	T	95.5	Very high	94.7	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.018	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	165.4	175.7	-168.3	0	0	0	0	110	Q166 E208 Y215 Q254	Q166-T261 PolarHBondContact NE2-OG1 2.86Å; Q166-T261 VanDerWaalsContact NE2-OG1 3.16Å; E208-T261 WeakPolarHBondContact OE2-CB 3.36Å; E208-T261 PolarHBondContact OE2-OG1 2.83Å; Y215-T261 HydrophobicContact CE2-CG2 4.26Å; Q254-T261 VanDerWaalsContact CG-O 3.24Å; Q254-T261 WeakPolarHBondContact CG-O 3.31Å; Q254-T261 PolarHBondContact O-N 2.92Å
262	D	94.1	Very high	94.3	Very high	24 Å²	24	31.9 Å²	31.9	13%	0.128	18%	0.18	C	C	.	.	S	Bend	trans	48.1	52.3	179.3	-62.7	-46.4	0	0	0	114.5	R122 K148 Q254	R122-D262 IonicContact CZ-OD1 2.71Å; R122-D262 VanDerWaalsContact CZ-OD1 3.24Å; R122-D262 IonicContact NH1-OD1 3.33Å; R122-D262 PolarHBondContact NH1-OD1 2.63Å; R122-D262 IonicContact NH2-OD1 3.99Å; R122-D262 PolarHBondContact NH2-OD1 2.64Å; R122-D262 IonicContact NH2-OD2 3.2Å; K148-D262 IonicContact NZ-OD1 3.15Å; K148-D262 IonicContact NZ-OD2 3.94Å; K148-D262 PolarHBondContact NZ-OD2 3.5Å; Q254-D262 PolarHBondContact NE2-O 3.01Å
263	P	97.2	Very high	94.1	Very high	13 Å²	13	33.5 Å²	33.5	8%	0.084	19%	0.185	C	C	.	.			trans	-72.7	168.1	173.5	34.1	-35	0	0	0	111.1	L165 Q166 A169 I188 V250	L165-P263 HydrophobicContact CD2-CG 4.04Å; L165-P263 WeakPolarHBondContact CD2-O 3.09Å; Q166-P263 HydrophobicContact CB-CG 4.45Å; Q166-P263 HydrophobicContact CG-CG 4.35Å; A169-P263 HydrophobicContact CB-CB 4.09Å; A169-P263 HydrophobicContact CB-CG 3.45Å; A169-P263 VanDerWaalsContact CB-CG 3.45Å; I188-P263 HydrophobicContact CD1-CG 4.48Å; I188-P263 HydrophobicContact CG2-CG 4.38Å; V250-P263 HydrophobicContact CG1-CB 4.01Å
264	Q	97.6	Very high	93.7	Very high	24 Å²	24	35.6 Å²	35.6	11%	0.112	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	149.3	168.6	-177	59.1	46.6	0	0	109.7	N221 V251 D252 Y273 G276	N221-Q264 HydrophobicContact CB-CB 4.07Å; N221-Q264 HydrophobicContact CB-CG 3.84Å; V251-Q264 HydrophobicContact CG2-CB 4.09Å; V251-Q264 HydrophobicContact CG2-CG 4.44Å; V251-Q264 WeakPolarHBondContact CG2-O 3.46Å; V251-Q264 PolarHBondContact N-O 2.87Å; V251-Q264 PolarHBondContact O-N 2.97Å; D252-Q264 HydrophobicContact CB-CB 3.93Å; D252-Q264 VanDerWaalsContact OD2-CB 3.31Å; D252-Q264 WeakPolarHBondContact OD2-CB 3.44Å; Q264-Y273 PolarHBondContact NE2-O 3.18Å; Q264-G276 VanDerWaalsContact CD-C 3.44Å; Q264-G276 VanDerWaalsContact CG-O 3.31Å; Q264-G276 WeakPolarHBondContact CG-O 3.36Å; Q264-G276 VanDerWaalsContact NE2-C 3.26Å
265	I	98.4	Very high	93.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	127.4	175.5	-58.9	178.4	0	0	0	109.1	L165 D168 A169 L248 I249 V250 T267 Y273	L165-I265 HydrophobicContact CD2-CD1 4.14Å; L165-I265 HydrophobicContact CD2-CG1 3.87Å; L165-I265 HydrophobicContact CG-CD1 4.3Å; L165-I265 HydrophobicContact CG-CG1 4.2Å; D168-I265 HydrophobicContact CB-CD1 4.3Å; A169-I265 HydrophobicContact CB-CD1 4.21Å; L248-I265 HydrophobicContact CB-CG2 4.01Å; L248-I265 HydrophobicContact CD1-CG2 4.36Å; I249-I265 WeakPolarHBondContact O-CA 3.15Å; V250-I265 HydrophobicContact CG2-CG1 4.22Å; I265-T267 HydrophobicContact CG2-CG2 4.22Å; I265-Y273 HydrophobicContact CB-CD2 3.74Å; I265-Y273 HydrophobicContact CB-CE2 4.14Å; I265-Y273 HydrophobicContact CB-CG 3.95Å; I265-Y273 HydrophobicContact CD1-CD1 4.26Å; I265-Y273 HydrophobicContact CD1-CD2 4.49Å; I265-Y273 HydrophobicContact CD1-CE1 3.98Å; I265-Y273 HydrophobicContact CD1-CE2 4.23Å; I265-Y273 HydrophobicContact CD1-CG 4.5Å; I265-Y273 HydrophobicContact CG2-CD2 3.67Å; I265-Y273 HydrophobicContact CG2-CE2 3.72Å; I265-Y273 HydrophobicContact CG2-CG 4.39Å
266	H	97.8	Very high	93.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	135.8	165.1	-62	-47	0	0	0	109.9	N221 L248 I249 G276 N277 L278 G282 M283	N221-H266 PolarHBondContact O-CE1 3.39Å; N221-H266 PolarHBondContact O-NE2 3.02Å; L248-H266 CarbonylContact C-O 3.45Å; L248-H266 WeakPolarHBondContact CA-O 3.44Å; L248-H266 VanDerWaalsContact CB-O 3.31Å; L248-H266 WeakPolarHBondContact CB-O 3.34Å; I249-H266 HydrophobicContact CG2-CB 3.75Å; I249-H266 PolarHBondContact N-O 2.97Å; I249-H266 PolarHBondContact O-N 3.33Å; H266-G276 PolarHBondContact CE1-O 3Å; H266-N277 VanDerWaalsContact CA-OD1 3.24Å; H266-N277 WeakPolarHBondContact CA-OD1 3.32Å; H266-L278 PolarHBondContact CE1-N 3.29Å; H266-L278 VanDerWaalsContact CE1-N 3.29Å; H266-L278 PolarHBondContact ND1-N 2.58Å; H266-G282 VanDerWaalsContact CD2-C 3.47Å; H266-G282 VanDerWaalsContact CD2-CA 3.45Å; H266-G282 WeakPolarHBondContact CD2-CA 3.34Å; H266-G282 WeakPolarHBondContact NE2-CA 3.16Å; H266-M283 HydrophobicContact CB-CE 4.29Å; H266-M283 HydrophobicContact CB-CG 4.22Å; H266-M283 WeakPolarHBondContact O-CE 3.31Å
267	T	95	Very high	93.4	Very high	10 Å²	10	42.6 Å²	42.6	6%	0.061	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	148.1	174.6	60.7	0	0	0	0	111	R247 L248 I265 N269 G270 Y273 N277 G279 M283	R247-T267 WeakPolarHBondContact O-CA 3.49Å; L248-T267 HydrophobicContact CB-CG2 4.25Å; I265-T267 HydrophobicContact CG2-CG2 4.22Å; T267-N269 WeakPolarHBondContact CB-OD1 3.45Å; T267-N269 PolarHBondContact O-N 2.72Å; T267-N269 PolarHBondContact OG1-OD1 2.97Å; T267-G270 PolarHBondContact O-N 3.38Å; T267-G270 PolarHBondContact OG1-N 2.82Å; T267-Y273 HydrophobicContact CG2-CD2 3.65Å; T267-Y273 HydrophobicContact CG2-CE2 3.64Å; T267-N277 PolarHBondContact N-OD1 2.91Å; T267-N277 PolarHBondContact OG1-ND2 3.07Å; T267-G279 WeakPolarHBondContact O-CA 3.46Å; T267-M283 VanDerWaalsContact C-CE 3.5Å
268	F	90.4	Very high	93.6	Very high	52 Å²	52	43 Å²	43	23%	0.228	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-27.2	-176.2	80.3	-84.2	0	0	0	113.6	R247 I280 M283 I558	R247-F268 HydrophobicContact CB-CD1 4.19Å; R247-F268 HydrophobicContact CG-CD1 4.42Å; R247-F268 PolarHBondContact O-N 3.31Å; F268-I280 HydrophobicContact CB-CD1 4.07Å; F268-I280 WeakPolarHBondContact O-CG1 3.38Å; F268-M283 HydrophobicContact CB-CE 4.48Å; F268-I558 HydrophobicContact CB-CD1 3.72Å; F268-I558 HydrophobicContact CB-CG1 3.93Å; F268-I558 HydrophobicContact CB-CG2 4.05Å; F268-I558 HydrophobicContact CD1-CD1 4.23Å; F268-I558 HydrophobicContact CD2-CD1 4.25Å; F268-I558 HydrophobicContact CD2-CG1 4.3Å; F268-I558 HydrophobicContact CG-CD1 3.79Å; F268-I558 HydrophobicContact CG-CG1 4.19Å
269	N	89.2	Confident	93.6	Very high	58 Å²	58	41 Å²	41	31%	0.31	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-11.6	179	65.6	5.4	0	0	0	113.9	T267 K271	T267-N269 WeakPolarHBondContact CB-OD1 3.45Å; T267-N269 PolarHBondContact O-N 2.72Å; T267-N269 PolarHBondContact OG1-OD1 2.97Å; N269-K271 WeakPolarHBondContact O-CG 3.33Å; N269-K271 PolarHBondContact O-N 3.45Å; N269-K271 PolarHBondContact OD1-N 3.04Å; N269-K271 VanDerWaalsContact OD1-N 3.13Å
270	G	92	Very high	93.6	Very high	37 Å²	37	39 Å²	39	38%	0.381	22%	0.223	S	C	.	.	S	Bend	trans	62.2	16.1	-177.8	0	0	0	0	0	116.1	T267	T267-G270 PolarHBondContact O-N 3.38Å; T267-G270 PolarHBondContact OG1-N 2.82Å
271	K	88.9	Confident	93.5	Very high	179 Å²	179	41.6 Å²	41.6	78%	0.778	23%	0.233	S	C	*	.			trans	-101.2	0	-170.8	-69.6	-171.8	-179.7	-171	0	115.7	N269	N269-K271 WeakPolarHBondContact O-CG 3.33Å; N269-K271 PolarHBondContact O-N 3.45Å; N269-K271 PolarHBondContact OD1-N 3.04Å; N269-K271 VanDerWaalsContact OD1-N 3.13Å
272	S	88.5	Confident	93.5	Very high	55 Å²	55	41.5 Å²	41.5	39%	0.385	23%	0.233	S	C	.	.	S	Bend	trans	-128.6	169.8	-172.8	-55.5	0	0	0	0	112.2	G274 N277	S272-G274 VanDerWaalsContact C-N 3.34Å; S272-G274 PolarHBondContact O-N 3.34Å; S272-N277 WeakPolarHBondContact O-CB 3.38Å; S272-N277 PolarHBondContact O-ND2 3.08Å
273	Y	92.3	Very high	93.6	Very high	49 Å²	49	40.3 Å²	40.3	19%	0.192	23%	0.226	C	C	.	.	S	Bend	trans	63.9	30.4	168.8	-53.1	-65.2	0	0	0	115.8	L165 D168 Q264 I265 T267	L165-Y273 HydrophobicContact CB-CD1 3.73Å; L165-Y273 HydrophobicContact CB-CE1 4.41Å; L165-Y273 HydrophobicContact CD1-CD1 4.36Å; L165-Y273 HydrophobicContact CD1-CG 4.47Å; L165-Y273 HydrophobicContact CG-CD1 3.69Å; L165-Y273 HydrophobicContact CG-CG 4.16Å; D168-Y273 HydrophobicContact CB-CE1 4.34Å; D168-Y273 WeakPolarHBondContact OD2-CE1 3.41Å; D168-Y273 PolarHBondContact OD2-OH 3.28Å; Q264-Y273 PolarHBondContact NE2-O 3.18Å; I265-Y273 HydrophobicContact CB-CD2 3.74Å; I265-Y273 HydrophobicContact CB-CE2 4.14Å; I265-Y273 HydrophobicContact CB-CG 3.95Å; I265-Y273 HydrophobicContact CD1-CD1 4.26Å; I265-Y273 HydrophobicContact CD1-CD2 4.49Å; I265-Y273 HydrophobicContact CD1-CE1 3.98Å; I265-Y273 HydrophobicContact CD1-CE2 4.23Å; I265-Y273 HydrophobicContact CD1-CG 4.5Å; I265-Y273 HydrophobicContact CG2-CD2 3.67Å; I265-Y273 HydrophobicContact CG2-CE2 3.72Å; I265-Y273 HydrophobicContact CG2-CG 4.39Å; T267-Y273 HydrophobicContact CG2-CD2 3.65Å; T267-Y273 HydrophobicContact CG2-CE2 3.64Å
274	G	88.8	Confident	93.6	Very high	45 Å²	45	39.7 Å²	39.7	46%	0.464	22%	0.222	S	C	.	.			trans	71.9	-177.3	171.9	0	0	0	0	0	115	S272 G276 N277	S272-G274 VanDerWaalsContact C-N 3.34Å; S272-G274 PolarHBondContact O-N 3.34Å; G274-G276 PolarHBondContact O-N 2.89Å; G274-G276 VanDerWaalsContact O-N 3.14Å; G274-N277 WeakPolarHBondContact O-CB 3.47Å; G274-N277 PolarHBondContact O-N 3.29Å
275	D	89.8	Confident	93.5	Very high	168 Å²	168	39.9 Å²	39.9	90%	0.898	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-17.8	-173.3	-64.7	-23.5	0	0	0	113.8	N277	D275-N277 PolarHBondContact O-N 2.96Å
276	G	91.1	Very high	93.3	Very high	19 Å²	19	40.1 Å²	40.1	20%	0.196	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-12.1	172.6	0	0	0	0	0	114	N221 Q264 H266 G274 L278	N221-G276 PolarHBondContact ND2-O 2.94Å; Q264-G276 VanDerWaalsContact CD-C 3.44Å; Q264-G276 VanDerWaalsContact CG-O 3.31Å; Q264-G276 WeakPolarHBondContact CG-O 3.36Å; Q264-G276 VanDerWaalsContact NE2-C 3.26Å; H266-G276 PolarHBondContact CE1-O 3Å; G274-G276 PolarHBondContact O-N 2.89Å; G274-G276 VanDerWaalsContact O-N 3.14Å; G276-L278 PolarHBondContact O-N 2.94Å
277	N	95.1	Very high	93.2	Very high	14 Å²	14	40.1 Å²	40.1	8%	0.075	23%	0.225	C	C	.	.			trans	-80	96.8	174.8	-179.4	3.6	0	0	0	110.7	H266 T267 S272 G274 D275 G279	H266-N277 VanDerWaalsContact CA-OD1 3.24Å; H266-N277 WeakPolarHBondContact CA-OD1 3.32Å; T267-N277 PolarHBondContact N-OD1 2.91Å; T267-N277 PolarHBondContact OG1-ND2 3.07Å; S272-N277 WeakPolarHBondContact O-CB 3.38Å; S272-N277 PolarHBondContact O-ND2 3.08Å; G274-N277 WeakPolarHBondContact O-CB 3.47Å; G274-N277 PolarHBondContact O-N 3.29Å; D275-N277 PolarHBondContact O-N 2.96Å; N277-G279 PolarHBondContact O-N 3.44Å; N277-G279 WeakPolarHBondContact OD1-CA 3.4Å; N277-G279 PolarHBondContact OD1-N 3.27Å
278	L	95.6	Very high	93	Very high	41 Å²	41	40 Å²	40	22%	0.215	22%	0.223	C	C	.	.			trans	-83.6	7.5	176.7	-53.6	-179.9	0	0	0	112.4	H266 G276 I280 R281 G282 L285 I348	H266-L278 PolarHBondContact CE1-N 3.29Å; H266-L278 VanDerWaalsContact CE1-N 3.29Å; H266-L278 PolarHBondContact ND1-N 2.58Å; G276-L278 PolarHBondContact O-N 2.94Å; L278-I280 PolarHBondContact O-N 3.38Å; L278-R281 WeakPolarHBondContact O-CB 3.11Å; L278-R281 PolarHBondContact O-N 3.01Å; L278-R281 VanDerWaalsContact O-N 3.13Å; L278-G282 PolarHBondContact O-N 3.13Å; L278-G282 VanDerWaalsContact O-N 3.1Å; L278-L285 HydrophobicContact CD1-CD1 4.48Å; L278-I348 HydrophobicContact CD2-CD1 4.3Å
279	G	95.6	Very high	93	Very high	4 Å²	4	38.4 Å²	38.4	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	51.2	-133.1	179	0	0	0	0	0	114.7	T267 N277 R281 G282 M283	T267-G279 WeakPolarHBondContact O-CA 3.46Å; N277-G279 PolarHBondContact O-N 3.44Å; N277-G279 WeakPolarHBondContact OD1-CA 3.4Å; N277-G279 PolarHBondContact OD1-N 3.27Å; G279-R281 PolarHBondContact O-N 2.95Å; G279-G282 PolarHBondContact O-N 3.49Å; G279-G282 VanDerWaalsContact O-N 3.09Å; G279-M283 WeakPolarHBondContact O-CG 3.42Å; G279-M283 PolarHBondContact O-N 2.94Å; G279-M283 VanDerWaalsContact O-N 3.07Å
280	I	95.7	Very high	93.2	Very high	21 Å²	21	35.9 Å²	35.9	11%	0.108	21%	0.205	C	C	.	.	H	α-helix	trans	-56	-36.9	177.7	-63.4	-61.9	0	0	0	111.9	F268 L278 M283 A284 I558 L561 I562 E565	F268-I280 HydrophobicContact CB-CD1 4.07Å; F268-I280 WeakPolarHBondContact O-CG1 3.38Å; L278-I280 PolarHBondContact O-N 3.38Å; I280-M283 HydrophobicContact CD1-SD 4.17Å; I280-M283 WeakPolarHBondContact O-CB 3.48Å; I280-M283 PolarHBondContact O-N 3.08Å; I280-A284 WeakPolarHBondContact O-CB 3.33Å; I280-A284 PolarHBondContact O-N 2.86Å; I280-I558 HydrophobicContact CD1-CG2 3.82Å; I280-L561 HydrophobicContact CD1-CB 4.09Å; I280-L561 HydrophobicContact CD1-CD1 4.36Å; I280-L561 HydrophobicContact CG1-CB 4.2Å; I280-L561 HydrophobicContact CG1-CD1 4.43Å; I280-L561 HydrophobicContact CG2-CB 3.97Å; I280-L561 WeakPolarHBondContact CG2-O 3.17Å; I280-I562 HydrophobicContact CD1-CG1 4.34Å; I280-I562 HydrophobicContact CG2-CG1 4.09Å; I280-E565 HydrophobicContact CG2-CB 3.89Å; I280-E565 HydrophobicContact CG2-CG 4.31Å
281	R	95.6	Very high	93.1	Very high	57 Å²	57	37.5 Å²	37.5	22%	0.215	20%	0.199	C	C	.	.	H	α-helix	trans	-63.6	-43.9	176.6	171.6	180	-89.6	-114.3	21.7	111.9	L278 G279 M283 A284 L285 E565 R568	L278-R281 WeakPolarHBondContact O-CB 3.11Å; L278-R281 PolarHBondContact O-N 3.01Å; L278-R281 VanDerWaalsContact O-N 3.13Å; G279-R281 PolarHBondContact O-N 2.95Å; R281-M283 VanDerWaalsContact C-N 3.31Å; R281-M283 PolarHBondContact O-N 2.71Å; R281-A284 WeakPolarHBondContact O-CB 3.5Å; R281-A284 PolarHBondContact O-N 3.1Å; R281-L285 HydrophobicContact CG-CD1 4.09Å; R281-L285 WeakPolarHBondContact O-CG 3.48Å; R281-L285 PolarHBondContact O-N 3.09Å; R281-E565 HydrophobicContact CB-CG 4.05Å; R281-E565 WeakPolarHBondContact CB-OE1 3.14Å; R281-E565 WeakPolarHBondContact CG-OE1 3.45Å; R281-E565 IonicContact CZ-OE1 3.53Å; R281-E565 IonicContact NE-OE1 2.63Å; R281-E565 PolarHBondContact NE-OE1 3.09Å; R281-E565 IonicContact NH2-OE1 3.7Å; R281-R568 VanDerWaalsContact CZ-NH2 3.31Å
282	G	95.4	Very high	93.2	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-60.7	-41.1	175	0	0	0	0	0	112.6	H266 L278 G279 L285 F286	H266-G282 VanDerWaalsContact CD2-C 3.47Å; H266-G282 VanDerWaalsContact CD2-CA 3.45Å; H266-G282 WeakPolarHBondContact CD2-CA 3.34Å; H266-G282 WeakPolarHBondContact NE2-CA 3.16Å; L278-G282 PolarHBondContact O-N 3.13Å; L278-G282 VanDerWaalsContact O-N 3.1Å; G279-G282 PolarHBondContact O-N 3.49Å; G279-G282 VanDerWaalsContact O-N 3.09Å; G282-L285 PolarHBondContact O-N 2.94Å; G282-F286 PolarHBondContact O-N 2.9Å
283	M	96.8	Very high	93.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.6	-44.1	174.2	-64	173.1	-179.5	0	0	112	F241 I249 H266 T267 F268 G279 I280 R281 F286 F287 I558 I562	F241-M283 HydrophobicContact CD2-SD 4.5Å; F241-M283 HydrophobicContact CE2-CG 4.47Å; F241-M283 HydrophobicContact CE2-SD 3.98Å; I249-M283 HydrophobicContact CG2-CE 4.4Å; I249-M283 HydrophobicContact CG2-CG 3.68Å; H266-M283 HydrophobicContact CB-CE 4.29Å; H266-M283 HydrophobicContact CB-CG 4.22Å; H266-M283 WeakPolarHBondContact O-CE 3.31Å; T267-M283 VanDerWaalsContact C-CE 3.5Å; F268-M283 HydrophobicContact CB-CE 4.48Å; G279-M283 WeakPolarHBondContact O-CG 3.42Å; G279-M283 PolarHBondContact O-N 2.94Å; G279-M283 VanDerWaalsContact O-N 3.07Å; I280-M283 HydrophobicContact CD1-SD 4.17Å; I280-M283 WeakPolarHBondContact O-CB 3.48Å; I280-M283 PolarHBondContact O-N 3.08Å; R281-M283 VanDerWaalsContact C-N 3.31Å; R281-M283 PolarHBondContact O-N 2.71Å; M283-F286 PolarHBondContact O-N 3.04Å; M283-F287 VanDerWaalsContact O-CD2 3.28Å; M283-F287 WeakPolarHBondContact O-CD2 3.43Å; M283-F287 PolarHBondContact O-N 3.02Å; M283-I558 HydrophobicContact SD-CG2 4.43Å; M283-I562 HydrophobicContact CB-CD1 3.84Å; M283-I562 HydrophobicContact CB-CG1 3.98Å; M283-I562 HydrophobicContact SD-CD1 4.12Å
284	A	96.2	Very high	93.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.4	-48.8	175.6	0	0	0	0	0	111.8	I280 R281 F286 F287 Y288 I562 E565 L566 L569	I280-A284 WeakPolarHBondContact O-CB 3.33Å; I280-A284 PolarHBondContact O-N 2.86Å; R281-A284 WeakPolarHBondContact O-CB 3.5Å; R281-A284 PolarHBondContact O-N 3.1Å; A284-F286 VanDerWaalsContact C-N 3.31Å; A284-F286 PolarHBondContact O-N 3.27Å; A284-F287 PolarHBondContact O-N 3.01Å; A284-F287 VanDerWaalsContact O-N 3.16Å; A284-Y288 WeakPolarHBondContact O-CB 3.26Å; A284-Y288 PolarHBondContact O-N 3.37Å; A284-I562 HydrophobicContact CB-CG2 4.13Å; A284-E565 HydrophobicContact CB-CB 4.2Å; A284-E565 HydrophobicContact CB-CG 3.94Å; A284-L566 HydrophobicContact CB-CD2 3.94Å; A284-L566 HydrophobicContact CB-CG 3.87Å; A284-L566 WeakPolarHBondContact O-CD2 3.49Å; A284-L569 HydrophobicContact CB-CD1 4.29Å
285	L	95.1	Very high	93.5	Very high	28 Å²	28	31.1 Å²	31.1	15%	0.147	17%	0.17	C	C	.	.	H	α-helix	trans	-61.1	-39	177.7	-70	169.8	0	0	0	112.4	L278 R281 G282 T289 L569	L278-L285 HydrophobicContact CD1-CD1 4.48Å; R281-L285 HydrophobicContact CG-CD1 4.09Å; R281-L285 WeakPolarHBondContact O-CG 3.48Å; R281-L285 PolarHBondContact O-N 3.09Å; G282-L285 PolarHBondContact O-N 2.94Å; L285-T289 PolarHBondContact O-N 3.03Å; L285-T289 PolarHBondContact O-OG1 3.11Å; L285-L569 HydrophobicContact CD2-CD1 3.92Å; L285-L569 HydrophobicContact CG-CD1 4.25Å
286	F	95.6	Very high	93.7	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.018	13%	0.128	C	C	.	.	H	α-helix	trans	-60.3	-50.9	172.3	173.9	-92.7	0	0	0	111.6	S237 H238 I249 V251 G282 M283 A284 Y288 T289 H290	S237-F286 VanDerWaalsContact CB-CZ 3.47Å; H238-F286 HydrophobicContact CB-CE1 4.26Å; H238-F286 HydrophobicContact CB-CZ 4.22Å; I249-F286 HydrophobicContact CD1-CB 4.17Å; I249-F286 HydrophobicContact CD1-CD1 3.24Å; I249-F286 HydrophobicContact CD1-CD2 3.96Å; I249-F286 HydrophobicContact CD1-CE1 3.5Å; I249-F286 HydrophobicContact CD1-CE2 4.18Å; I249-F286 HydrophobicContact CD1-CG 3.5Å; I249-F286 VanDerWaalsContact CD1-CG 3.5Å; I249-F286 HydrophobicContact CD1-CZ 3.97Å; V251-F286 HydrophobicContact CG1-CD2 4.07Å; G282-F286 PolarHBondContact O-N 2.9Å; M283-F286 PolarHBondContact O-N 3.04Å; A284-F286 VanDerWaalsContact C-N 3.31Å; A284-F286 PolarHBondContact O-N 3.27Å; F286-Y288 VanDerWaalsContact C-N 3.29Å; F286-Y288 PolarHBondContact O-N 3.29Å; F286-T289 PolarHBondContact O-N 3.38Å; F286-T289 PolarHBondContact O-OG1 2.86Å; F286-H290 HydrophobicContact CD1-CB 4.2Å; F286-H290 HydrophobicContact CE1-CB 3.8Å; F286-H290 AromaticContact CE1-CG 3.77Å; F286-H290 AromaticContact CE1-ND1 3.93Å; F286-H290 HydrophobicContact CZ-CB 4Å; F286-H290 AromaticContact CZ-CG 3.78Å; F286-H290 AromaticContact CZ-ND1 3.45Å; F286-H290 WeakPolarHBondContact CZ-ND1 3.18Å; F286-H290 WeakPolarHBondContact O-CB 3.33Å; F286-H290 PolarHBondContact O-N 3.43Å
287	F	94.7	Very high	93.8	Very high	1 Å²	1	28.9 Å²	28.9	0%	0.004	15%	0.153	C	C	.	.	H	α-helix	trans	-69.5	-26.7	-177.5	-80.2	-64.2	0	0	0	113.7	F241 M283 A284 T289 F304 I562	F241-F287 HydrophobicContact CB-CZ 4.26Å; F241-F287 AromaticContact CD1-CE2 3.6Å; F241-F287 HydrophobicContact CD1-CE2 3.6Å; F241-F287 AromaticContact CD1-CZ 3.3Å; F241-F287 HydrophobicContact CD1-CZ 3.3Å; F241-F287 AromaticContact CD2-CE2 3.94Å; F241-F287 HydrophobicContact CD2-CE2 3.94Å; F241-F287 HydrophobicContact CD2-CZ 4.36Å; F241-F287 AromaticContact CE1-CE2 3.51Å; F241-F287 HydrophobicContact CE1-CE2 3.51Å; F241-F287 AromaticContact CE1-CZ 3.54Å; F241-F287 HydrophobicContact CE1-CZ 3.54Å; F241-F287 AromaticContact CE2-CE2 3.9Å; F241-F287 HydrophobicContact CE2-CE2 3.9Å; F241-F287 AromaticContact CG-CE2 3.78Å; F241-F287 HydrophobicContact CG-CE2 3.78Å; F241-F287 AromaticContact CG-CZ 3.71Å; F241-F287 HydrophobicContact CG-CZ 3.71Å; F241-F287 AromaticContact CZ-CE2 3.67Å; F241-F287 HydrophobicContact CZ-CE2 3.67Å; F241-F287 HydrophobicContact CZ-CZ 4.19Å; M283-F287 VanDerWaalsContact O-CD2 3.28Å; M283-F287 WeakPolarHBondContact O-CD2 3.43Å; M283-F287 PolarHBondContact O-N 3.02Å; A284-F287 PolarHBondContact O-N 3.01Å; A284-F287 VanDerWaalsContact O-N 3.16Å; F287-T289 VanDerWaalsContact C-N 3.35Å; F287-T289 PolarHBondContact O-N 3.33Å; F287-F304 HydrophobicContact CB-CD1 3.82Å; F287-F304 HydrophobicContact CB-CD2 4.28Å; F287-F304 HydrophobicContact CB-CE1 4.02Å; F287-F304 HydrophobicContact CB-CE2 4.46Å; F287-F304 HydrophobicContact CB-CG 3.97Å; F287-F304 HydrophobicContact CB-CZ 4.34Å; F287-F304 HydrophobicContact CD1-CB 3.45Å; F287-F304 VanDerWaalsContact CD1-CB 3.45Å; F287-F304 HydrophobicContact CD1-CD1 4.27Å; F287-F304 AromaticContact CD1-CD2 3.88Å; F287-F304 HydrophobicContact CD1-CD2 3.88Å; F287-F304 AromaticContact CD1-CG 3.61Å; F287-F304 HydrophobicContact CD1-CG 3.61Å; F287-F304 HydrophobicContact CD2-CD2 4.05Å; F287-F304 HydrophobicContact CD2-CE2 4.24Å; F287-F304 HydrophobicContact CD2-CG 4.47Å; F287-F304 HydrophobicContact CE1-CB 3.84Å; F287-F304 HydrophobicContact CE1-CD2 4.23Å; F287-F304 HydrophobicContact CE1-CG 4.23Å; F287-F304 HydrophobicContact CE2-CD2 4.39Å; F287-F304 HydrophobicContact CG-CB 4.14Å; F287-F304 HydrophobicContact CG-CD1 4.15Å; F287-F304 AromaticContact CG-CD2 3.8Å; F287-F304 HydrophobicContact CG-CD2 3.8Å; F287-F304 HydrophobicContact CG-CE2 4.23Å; F287-F304 AromaticContact CG-CG 3.76Å; F287-F304 HydrophobicContact CG-CG 3.76Å; F287-F304 HydrophobicContact CZ-CD2 4.48Å; F287-I562 HydrophobicContact CD2-CG2 4.39Å
288	Y	91.8	Very high	93.6	Very high	6 Å²	6	30.5 Å²	30.5	2%	0.024	17%	0.169	C	C	.	.	H	α-helix	trans	-60.4	-43.4	172.8	-175.6	-109.2	0	0	0	112.1	A284 F286 R291 E310 L566 H570 L575 L578 H579	A284-Y288 WeakPolarHBondContact O-CB 3.26Å; A284-Y288 PolarHBondContact O-N 3.37Å; F286-Y288 VanDerWaalsContact C-N 3.29Å; F286-Y288 PolarHBondContact O-N 3.29Å; Y288-R291 PolarHBondContact O-NH1 2.92Å; Y288-R291 PolarHBondContact O-NH2 3.49Å; Y288-E310 HydrophobicContact CE2-CG 3.93Å; Y288-L566 HydrophobicContact CD2-CD2 4.3Å; Y288-L566 HydrophobicContact CG-CD2 4.48Å; Y288-H570 AromaticContact CD2-NE2 4Å; Y288-H570 AromaticContact CE2-CE1 3.85Å; Y288-H570 AromaticContact CE2-NE2 3.43Å; Y288-H570 WeakPolarHBondContact CE2-NE2 3.41Å; Y288-L575 HydrophobicContact CD1-CD1 4.44Å; Y288-L575 HydrophobicContact CD1-CD2 3.83Å; Y288-L575 HydrophobicContact CD2-CD1 3.81Å; Y288-L575 HydrophobicContact CE1-CB 4.38Å; Y288-L575 HydrophobicContact CE1-CD1 4.42Å; Y288-L575 HydrophobicContact CE1-CD2 3.69Å; Y288-L575 HydrophobicContact CE1-CG 4.36Å; Y288-L575 HydrophobicContact CE2-CB 4.31Å; Y288-L575 HydrophobicContact CE2-CD1 3.8Å; Y288-L575 HydrophobicContact CE2-CG 4.42Å; Y288-L575 HydrophobicContact CG-CD1 4.15Å; Y288-L575 HydrophobicContact CG-CD2 4.31Å; Y288-L575 PolarHBondContact OH-O 2.92Å; Y288-L578 HydrophobicContact CD1-CD2 4.44Å; Y288-L578 HydrophobicContact CE1-CB 4Å; Y288-L578 HydrophobicContact CE1-CD1 4.37Å; Y288-L578 HydrophobicContact CE1-CD2 3.76Å; Y288-L578 HydrophobicContact CE1-CG 4.22Å; Y288-H579 PolarHBondContact OH-CD2 3.28Å
289	T	90.1	Very high	93.4	Very high	19 Å²	19	29.6 Å²	29.6	12%	0.117	16%	0.164	C	C	.	.	H	α-helix	trans	-95.6	-15.7	-179.2	63	0	0	0	0	113.9	G223 V225 L285 F286 F287 R291	G223-T289 WeakPolarHBondContact O-CB 3.31Å; G223-T289 WeakPolarHBondContact O-CG2 3.42Å; G223-T289 PolarHBondContact O-OG1 2.86Å; V225-T289 WeakPolarHBondContact CG2-OG1 3.31Å; L285-T289 PolarHBondContact O-N 3.03Å; L285-T289 PolarHBondContact O-OG1 3.11Å; F286-T289 PolarHBondContact O-N 3.38Å; F286-T289 PolarHBondContact O-OG1 2.86Å; F287-T289 VanDerWaalsContact C-N 3.35Å; F287-T289 PolarHBondContact O-N 3.33Å; T289-R291 PolarHBondContact O-N 3.33Å
290	H	92.6	Very high	93.1	Very high	6 Å²	6	34.3 Å²	34.3	3%	0.028	20%	0.196	C	C	.	.			trans	-69.5	130.2	177.7	-174.7	73.5	0	0	0	111.6	Q234 H238 F286	Q234-H290 PolarHBondContact O-CE1 3.14Å; Q234-H290 PolarHBondContact OE1-ND1 3.15Å; H238-H290 AromaticContact CE1-NE2 3.97Å; H238-H290 AromaticContact CG-NE2 3.67Å; H238-H290 AromaticContact ND1-CD2 3.65Å; H238-H290 AromaticContact ND1-CE1 3.87Å; H238-H290 AromaticContact ND1-NE2 2.99Å; H238-H290 PolarHBondContact ND1-NE2 3.25Å; F286-H290 HydrophobicContact CD1-CB 4.2Å; F286-H290 HydrophobicContact CE1-CB 3.8Å; F286-H290 AromaticContact CE1-CG 3.77Å; F286-H290 AromaticContact CE1-ND1 3.93Å; F286-H290 HydrophobicContact CZ-CB 4Å; F286-H290 AromaticContact CZ-CG 3.78Å; F286-H290 AromaticContact CZ-ND1 3.45Å; F286-H290 WeakPolarHBondContact CZ-ND1 3.18Å; F286-H290 WeakPolarHBondContact O-CB 3.33Å; F286-H290 PolarHBondContact O-N 3.43Å
291	R	89.5	Confident	92.9	Very high	71 Å²	71	34.1 Å²	34.1	27%	0.268	20%	0.196	S	C	.	.			trans	-122.7	124.8	166	-61.3	-66.5	174.8	-85	-3.2	108.4	Y288 T289 N293 L306 E310 S313	Y288-R291 PolarHBondContact O-NH1 2.92Å; Y288-R291 PolarHBondContact O-NH2 3.49Å; T289-R291 PolarHBondContact O-N 3.33Å; R291-N293 PolarHBondContact O-N 3.1Å; R291-L306 VanDerWaalsContact NH1-CD1 3.34Å; R291-E310 PolarHBondContact NH2-O 3.42Å; R291-S313 PolarHBondContact NH2-OG 3.02Å
292	C	91.6	Very high	92.6	Very high	58 Å²	58	32.8 Å²	32.8	39%	0.392	20%	0.195	S	C	.	.			trans	-55.3	130.1	178.6	-80.5	0	0	0	0	110.2	H238 C296	H238-C292 VanDerWaalsContact CE1-SG 3.52Å; C292-C296 HydrophobicContact CB-CB 4.06Å
293	N	91.3	Very high	92.4	Very high	21 Å²	21	36.6 Å²	36.6	11%	0.112	22%	0.219	C	C	.	.			trans	-112.6	175.3	179.1	69.5	53.4	0	0	0	110.2	N231 R291 L295 C296 L297	N231-N293 WeakPolarHBondContact CA-ND2 3.3Å; N231-N293 HydrophobicContact CB-CB 4.34Å; N231-N293 WeakPolarHBondContact CB-OD1 3.47Å; N231-N293 PolarHBondContact O-ND2 3.18Å; N231-N293 WeakPolarHBondContact OD1-CB 3.37Å; R291-N293 PolarHBondContact O-N 3.1Å; N293-L295 PolarHBondContact O-N 3.11Å; N293-L295 WeakPolarHBondContact OD1-CA 3.49Å; N293-L295 VanDerWaalsContact OD1-CB 3.3Å; N293-L295 WeakPolarHBondContact OD1-CB 3.37Å; N293-L295 PolarHBondContact OD1-N 3.15Å; N293-C296 WeakPolarHBondContact O-CB 3.32Å; N293-C296 PolarHBondContact O-N 3.29Å; N293-C296 PolarHBondContact OD1-N 3.43Å; N293-L297 PolarHBondContact O-N 2.95Å
294	P	92.4	Very high	92.2	Very high	92 Å²	92	37.1 Å²	37.1	60%	0.597	22%	0.222	S	C	*	.	H	α-helix	trans	-55.4	-25	-178	-29.4	36.9	0	0	0	115.2	A298	P294-A298 WeakPolarHBondContact O-CB 3.26Å; P294-A298 PolarHBondContact O-N 2.99Å
295	L	92.9	Very high	91.9	Very high	22 Å²	22	38.8 Å²	38.8	12%	0.115	23%	0.23	C	C	.	.	H	α-helix	trans	-74.9	-38.1	174.9	-61.8	-177.3	0	0	0	112.3	P183 N231 T232 A235 N293 L297 A298 L299	P183-L295 HydrophobicContact CG-CD2 3.58Å; N231-L295 HydrophobicContact CB-CD1 3.66Å; N231-L295 HydrophobicContact CB-CG 3.89Å; T232-L295 WeakPolarHBondContact OG1-CD1 3.15Å; A235-L295 HydrophobicContact CB-CB 3.66Å; A235-L295 HydrophobicContact CB-CD1 4.43Å; N293-L295 PolarHBondContact O-N 3.11Å; N293-L295 WeakPolarHBondContact OD1-CA 3.49Å; N293-L295 VanDerWaalsContact OD1-CB 3.3Å; N293-L295 WeakPolarHBondContact OD1-CB 3.37Å; N293-L295 PolarHBondContact OD1-N 3.15Å; L295-L297 VanDerWaalsContact C-N 3.25Å; L295-L297 PolarHBondContact O-N 2.82Å; L295-A298 PolarHBondContact O-N 3.46Å; L295-L299 VanDerWaalsContact O-CB 3.3Å; L295-L299 WeakPolarHBondContact O-CB 3.47Å; L295-L299 WeakPolarHBondContact O-CD1 3.4Å; L295-L299 VanDerWaalsContact O-CG 3.26Å; L295-L299 WeakPolarHBondContact O-CG 3.46Å; L295-L299 PolarHBondContact O-N 3.45Å
296	C	93.9	Very high	91.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-57.3	-44.5	173.6	-54.4	0	0	0	0	110.2	C292 N293 L299 S300 L301	C292-C296 HydrophobicContact CB-CB 4.06Å; N293-C296 WeakPolarHBondContact O-CB 3.32Å; N293-C296 PolarHBondContact O-N 3.29Å; N293-C296 PolarHBondContact OD1-N 3.43Å; C296-L299 CarbonylContact O-C 3.59Å; C296-L299 PolarHBondContact O-N 3.49Å; C296-S300 PolarHBondContact O-N 3.39Å; C296-S300 VanDerWaalsContact O-N 3.12Å; C296-L301 HydrophobicContact CB-CB 4.32Å; C296-L301 HydrophobicContact CB-CD1 4.15Å; C296-L301 PolarHBondContact O-N 3.39Å
297	L	91.9	Very high	91.6	Very high	140 Å²	140	37.9 Å²	37.9	73%	0.733	23%	0.226	S	C	*	.	H	α-helix	trans	-63.3	-45.8	175	-176.7	63.1	0	0	0	112.3	N293 L295 L299 S300	N293-L297 PolarHBondContact O-N 2.95Å; L295-L297 VanDerWaalsContact C-N 3.25Å; L295-L297 PolarHBondContact O-N 2.82Å; L297-L299 PolarHBondContact O-N 3.35Å; L297-S300 WeakPolarHBondContact O-CA 3.42Å; L297-S300 PolarHBondContact O-N 2.95Å
298	A	91.7	Very high	91.1	Very high	48 Å²	48	43.6 Å²	43.6	40%	0.397	26%	0.255	S	S	.	.	H	α-helix	trans	-64.5	-29.3	178.3	0	0	0	0	0	113	S181 P294 L295 S300	S181-A298 WeakPolarHBondContact CB-O 3.43Å; S181-A298 PolarHBondContact OG-O 2.85Å; S181-A298 VanDerWaalsContact OG-O 3.06Å; P294-A298 WeakPolarHBondContact O-CB 3.26Å; P294-A298 PolarHBondContact O-N 2.99Å; L295-A298 PolarHBondContact O-N 3.46Å; A298-S300 VanDerWaalsContact C-N 3.26Å
299	L	90.6	Very high	90.7	Very high	22 Å²	22	44.6 Å²	44.6	12%	0.115	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-2.1	173.3	-69.9	162.4	0	0	0	112.6	Y176 Q179 S181 A235 F239 L295 C296 L297 L301	Y176-L299 HydrophobicContact CD2-CD1 4.34Å; Y176-L299 HydrophobicContact CE2-CD1 3.47Å; Y176-L299 VanDerWaalsContact CE2-CD1 3.47Å; Y176-L299 HydrophobicContact CE2-CD2 4.46Å; Q179-L299 HydrophobicContact CB-CD2 3.76Å; Q179-L299 HydrophobicContact CG-CD2 3.94Å; S181-L299 WeakPolarHBondContact OG-CD2 3.25Å; A235-L299 HydrophobicContact CB-CD1 4.34Å; F239-L299 HydrophobicContact CD2-CD2 4.41Å; L295-L299 VanDerWaalsContact O-CB 3.3Å; L295-L299 WeakPolarHBondContact O-CB 3.47Å; L295-L299 WeakPolarHBondContact O-CD1 3.4Å; L295-L299 VanDerWaalsContact O-CG 3.26Å; L295-L299 WeakPolarHBondContact O-CG 3.46Å; L295-L299 PolarHBondContact O-N 3.45Å; C296-L299 CarbonylContact O-C 3.59Å; C296-L299 PolarHBondContact O-N 3.49Å; L297-L299 PolarHBondContact O-N 3.35Å; L299-L301 VanDerWaalsContact C-N 3.25Å; L299-L301 HydrophobicContact CB-CD1 4.26Å; L299-L301 HydrophobicContact CB-CD2 4.03Å; L299-L301 HydrophobicContact CB-CG 3.77Å; L299-L301 HydrophobicContact CD1-CD1 4.4Å; L299-L301 PolarHBondContact O-N 3.49Å
300	S	90.2	Very high	90.5	Very high	103 Å²	103	43.7 Å²	43.7	72%	0.72	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	39.7	-176.7	-54.4	0	0	0	0	112.7	C296 L297 A298	C296-S300 PolarHBondContact O-N 3.39Å; C296-S300 VanDerWaalsContact O-N 3.12Å; L297-S300 WeakPolarHBondContact O-CA 3.42Å; L297-S300 PolarHBondContact O-N 2.95Å; A298-S300 VanDerWaalsContact C-N 3.26Å
301	L	90.8	Very high	90	Very high	18 Å²	18	49 Å²	49	9%	0.094	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-80.3	137.8	173.4	-50.8	-177.2	0	0	0	109.6	H238 F239 E242 C296 L299	H238-L301 HydrophobicContact CB-CD1 3.98Å; F239-L301 HydrophobicContact CB-CD1 4.08Å; F239-L301 HydrophobicContact CB-CD2 4.42Å; F239-L301 HydrophobicContact CD2-CD2 4.2Å; E242-L301 HydrophobicContact CB-CD2 4.06Å; E242-L301 HydrophobicContact CG-CB 4.35Å; E242-L301 HydrophobicContact CG-CD2 4.16Å; C296-L301 HydrophobicContact CB-CB 4.32Å; C296-L301 HydrophobicContact CB-CD1 4.15Å; C296-L301 PolarHBondContact O-N 3.39Å; L299-L301 VanDerWaalsContact C-N 3.25Å; L299-L301 HydrophobicContact CB-CD1 4.26Å; L299-L301 HydrophobicContact CB-CD2 4.03Å; L299-L301 HydrophobicContact CB-CG 3.77Å; L299-L301 HydrophobicContact CD1-CD1 4.4Å; L299-L301 PolarHBondContact O-N 3.49Å
302	S	89.2	Confident	89.3	Confident	28 Å²	28	52 Å²	52	20%	0.196	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-77.4	133.5	178.9	-74.2	0	0	0	0	110.7	H238 E242 F304 S545	H238-S302 PolarHBondContact CE1-O 3.01Å; H238-S302 PolarHBondContact NE2-O 3.42Å; H238-S302 VanDerWaalsContact NE2-O 3.11Å; E242-S302 WeakPolarHBondContact OE1-CB 3.47Å; E242-S302 PolarHBondContact OE1-N 3.2Å; S302-F304 PolarHBondContact O-N 2.83Å; S302-S545 WeakPolarHBondContact CB-OG 3.34Å; S302-S545 WeakPolarHBondContact OG-CB 3.34Å; S302-S545 PolarHBondContact OG-OG 3.2Å
303	P	90.9	Very high	88	Confident	81 Å²	81	50.1 Å²	50.1	53%	0.526	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-61.2	135.5	172	-20.2	32.6	0	0	0	111
304	F	92.4	Very high	86.2	Confident	12 Å²	12	52.1 Å²	52.1	5%	0.053	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-68.6	140.4	168.5	-172.8	-94.6	0	0	0	110.2	F287 S302 L306 L559 I562 H563 L566	F287-F304 HydrophobicContact CB-CD1 3.82Å; F287-F304 HydrophobicContact CB-CD2 4.28Å; F287-F304 HydrophobicContact CB-CE1 4.02Å; F287-F304 HydrophobicContact CB-CE2 4.46Å; F287-F304 HydrophobicContact CB-CG 3.97Å; F287-F304 HydrophobicContact CB-CZ 4.34Å; F287-F304 HydrophobicContact CD1-CB 3.45Å; F287-F304 VanDerWaalsContact CD1-CB 3.45Å; F287-F304 HydrophobicContact CD1-CD1 4.27Å; F287-F304 AromaticContact CD1-CD2 3.88Å; F287-F304 HydrophobicContact CD1-CD2 3.88Å; F287-F304 AromaticContact CD1-CG 3.61Å; F287-F304 HydrophobicContact CD1-CG 3.61Å; F287-F304 HydrophobicContact CD2-CD2 4.05Å; F287-F304 HydrophobicContact CD2-CE2 4.24Å; F287-F304 HydrophobicContact CD2-CG 4.47Å; F287-F304 HydrophobicContact CE1-CB 3.84Å; F287-F304 HydrophobicContact CE1-CD2 4.23Å; F287-F304 HydrophobicContact CE1-CG 4.23Å; F287-F304 HydrophobicContact CE2-CD2 4.39Å; F287-F304 HydrophobicContact CG-CB 4.14Å; F287-F304 HydrophobicContact CG-CD1 4.15Å; F287-F304 AromaticContact CG-CD2 3.8Å; F287-F304 HydrophobicContact CG-CD2 3.8Å; F287-F304 HydrophobicContact CG-CE2 4.23Å; F287-F304 AromaticContact CG-CG 3.76Å; F287-F304 HydrophobicContact CG-CG 3.76Å; F287-F304 HydrophobicContact CZ-CD2 4.48Å; S302-F304 PolarHBondContact O-N 2.83Å; F304-L306 HydrophobicContact CD1-CD2 3.69Å; F304-L306 HydrophobicContact CD1-CG 4.11Å; F304-L306 HydrophobicContact CE1-CD2 3.97Å; F304-L306 PolarHBondContact O-N 3.19Å; F304-L559 HydrophobicContact CD2-CD2 4.44Å; F304-L559 HydrophobicContact CE2-CD2 4.23Å; F304-I562 HydrophobicContact CE2-CB 4.47Å; F304-I562 HydrophobicContact CE2-CG2 3.8Å; F304-I562 HydrophobicContact CZ-CB 4.49Å; F304-I562 HydrophobicContact CZ-CG2 3.61Å; F304-H563 AromaticContact CE1-CE1 3.36Å; F304-H563 WeakPolarHBondContact CE1-CE1 3.36Å; F304-H563 AromaticContact CE1-ND1 3.85Å; F304-H563 AromaticContact CE2-CE1 3.98Å; F304-H563 AromaticContact CE2-NE2 3.87Å; F304-H563 AromaticContact CZ-CE1 3.21Å; F304-H563 WeakPolarHBondContact CZ-CE1 3.43Å; F304-H563 AromaticContact CZ-ND1 3.58Å; F304-H563 AromaticContact CZ-NE2 3.54Å; F304-L566 HydrophobicContact CE1-CD1 3.52Å; F304-L566 HydrophobicContact CZ-CD1 3.81Å
305	D	91.8	Very high	84.2	Confident	34 Å²	34	48.7 Å²	48.7	18%	0.182	28%	0.28	C	S	.	.			trans	-75.3	105.9	-174.7	-68.5	-46.5	0	0	0	111.1	S547 I548 H563 F625 Q629	D305-S547 PolarHBondContact OD1-OG 2.92Å; D305-S547 VanDerWaalsContact OD2-CA 3.32Å; D305-S547 WeakPolarHBondContact OD2-CA 3.39Å; D305-S547 PolarHBondContact OD2-OG 2.9Å; D305-I548 WeakPolarHBondContact OD2-CB 3.47Å; D305-I548 WeakPolarHBondContact OD2-CG1 3.36Å; D305-I548 PolarHBondContact OD2-N 3.05Å; D305-H563 PolarHBondContact O-CE1 3.12Å; D305-F625 HydrophobicContact CB-CZ 4.34Å; D305-F625 WeakPolarHBondContact O-CE1 3.13Å; D305-Q629 HydrophobicContact CB-CG 4.5Å
306	L	91.9	Very high	81.9	Confident	9 Å²	9	50.2 Å²	50.2	5%	0.047	29%	0.288	C	S	.	.			trans	-111.8	146.8	176.4	-63.2	174.9	0	0	0	111.2	R291 F304 E310 K311	R291-L306 VanDerWaalsContact NH1-CD1 3.34Å; F304-L306 HydrophobicContact CD1-CD2 3.69Å; F304-L306 HydrophobicContact CD1-CG 4.11Å; F304-L306 HydrophobicContact CE1-CD2 3.97Å; F304-L306 PolarHBondContact O-N 3.19Å; L306-E310 HydrophobicContact CB-CB 4.42Å; L306-E310 WeakPolarHBondContact CD2-OE2 3.47Å; L306-K311 HydrophobicContact CB-CD 4.49Å; L306-K311 HydrophobicContact CB-CG 3.84Å; L306-K311 WeakPolarHBondContact O-CD 3.43Å; L306-K311 WeakPolarHBondContact O-CE 3.21Å; L306-K311 PolarHBondContact O-NZ 3.31Å
307	P	90.6	Very high	79.5	Confident	5 Å²	5	51.5 Å²	51.5	3%	0.032	30%	0.297	C	S	.	.			trans	-66.6	162	171.7	27.3	-30.1	0	0	0	110.8	S309 E310 K311 S622 F625	P307-S309 VanDerWaalsContact C-N 3.3Å; P307-S309 PolarHBondContact O-N 3.46Å; P307-E310 WeakPolarHBondContact CD-OE1 3.48Å; P307-E310 HydrophobicContact CG-CB 3.95Å; P307-E310 VanDerWaalsContact CG-CD 3.44Å; P307-E310 HydrophobicContact CG-CG 3.83Å; P307-E310 WeakPolarHBondContact CG-OE1 3.41Å; P307-E310 PolarHBondContact O-N 3.25Å; P307-K311 WeakPolarHBondContact O-CG 3.26Å; P307-K311 PolarHBondContact O-N 3.37Å; P307-S622 WeakPolarHBondContact CG-OG 3.34Å; P307-F625 HydrophobicContact CB-CB 4.03Å; P307-F625 HydrophobicContact CB-CD1 3.77Å; P307-F625 HydrophobicContact CB-CD2 4.17Å; P307-F625 HydrophobicContact CB-CE1 4.29Å; P307-F625 HydrophobicContact CB-CG 3.71Å; P307-F625 VanDerWaalsContact CD-CD1 3.47Å; P307-F625 HydrophobicContact CG-CD1 3.86Å; P307-F625 HydrophobicContact CG-CE1 4.41Å; P307-F625 HydrophobicContact CG-CG 4.25Å
308	I	85.5	Confident	77	Confident	120 Å²	120	49.4 Å²	49.4	62%	0.615	28%	0.283	S	S	*	.	H	α-helix	trans	-60.4	-42.8	-177	-64.5	173.3	0	0	0	110.8	E310 K311 L312	I308-E310 VanDerWaalsContact C-N 3.31Å; I308-E310 PolarHBondContact O-N 2.94Å; I308-K311 PolarHBondContact O-N 3.33Å; I308-L312 HydrophobicContact CG2-CD1 3.72Å; I308-L312 HydrophobicContact CG2-CG 4.17Å; I308-L312 WeakPolarHBondContact O-CB 3.36Å; I308-L312 VanDerWaalsContact O-CG 3.28Å; I308-L312 WeakPolarHBondContact O-CG 3.35Å; I308-L312 PolarHBondContact O-N 3.45Å
309	S	82.3	Confident	74.4	Confident	27 Å²	27	49.9 Å²	49.9	19%	0.189	28%	0.279	C	S	.	.	H	α-helix	trans	-54.3	-46.6	177.9	53.2	0	0	0	0	111.6	P307 L312 S313 H579 N619 S622	P307-S309 VanDerWaalsContact C-N 3.3Å; P307-S309 PolarHBondContact O-N 3.46Å; S309-L312 PolarHBondContact O-N 3.01Å; S309-S313 PolarHBondContact O-N 3.21Å; S309-H579 VanDerWaalsContact C-CE1 3.49Å; S309-H579 PolarHBondContact O-CE1 2.56Å; S309-H579 VanDerWaalsContact O-CE1 3.31Å; S309-N619 PolarHBondContact OG-ND2 2.95Å; S309-S622 PolarHBondContact OG-OG 3.11Å
310	E	86.4	Confident	71.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-72.4	-39	178.2	-75	170.9	-128.5	0	0	112.8	Y288 R291 L306 P307 I308 L312 S313 H570 S622 H626	Y288-E310 HydrophobicContact CE2-CG 3.93Å; R291-E310 PolarHBondContact NH2-O 3.42Å; L306-E310 HydrophobicContact CB-CB 4.42Å; L306-E310 WeakPolarHBondContact CD2-OE2 3.47Å; P307-E310 WeakPolarHBondContact CD-OE1 3.48Å; P307-E310 HydrophobicContact CG-CB 3.95Å; P307-E310 VanDerWaalsContact CG-CD 3.44Å; P307-E310 HydrophobicContact CG-CG 3.83Å; P307-E310 WeakPolarHBondContact CG-OE1 3.41Å; P307-E310 PolarHBondContact O-N 3.25Å; I308-E310 VanDerWaalsContact C-N 3.31Å; I308-E310 PolarHBondContact O-N 2.94Å; E310-L312 PolarHBondContact O-N 3.47Å; E310-S313 WeakPolarHBondContact CA-OG 3.48Å; E310-S313 PolarHBondContact O-N 3.42Å; E310-S313 VanDerWaalsContact O-N 3.12Å; E310-S313 PolarHBondContact O-OG 3.47Å; E310-H570 IonicContact OE1-CD2 3.58Å; E310-H570 IonicContact OE1-CE1 2.75Å; E310-H570 IonicContact OE1-NE2 3.18Å; E310-H570 PolarHBondContact OE1-NE2 3.25Å; E310-S622 WeakPolarHBondContact OE1-CB 3.46Å; E310-S622 PolarHBondContact OE1-OG 2.82Å; E310-H626 IonicContact OE1-CD2 2.82Å; E310-H626 IonicContact OE1-NE2 3.55Å; E310-H626 PolarHBondContact OE1-NE2 2.87Å; E310-H626 IonicContact OE2-NE2 2.79Å; E310-H626 PolarHBondContact OE2-NE2 3.2Å
311	K	82.9	Confident	68.8	Low	118 Å²	118	54.5 Å²	54.5	51%	0.513	30%	0.297	S	S	.	.	H	α-helix	trans	-57.8	-35.9	174.2	-75.3	170.1	170.6	151.5	0	111.9	L306 P307 I308	L306-K311 HydrophobicContact CB-CD 4.49Å; L306-K311 HydrophobicContact CB-CG 3.84Å; L306-K311 WeakPolarHBondContact O-CD 3.43Å; L306-K311 WeakPolarHBondContact O-CE 3.21Å; L306-K311 PolarHBondContact O-NZ 3.31Å; P307-K311 WeakPolarHBondContact O-CG 3.26Å; P307-K311 PolarHBondContact O-N 3.37Å; I308-K311 PolarHBondContact O-N 3.33Å
312	L	73.6	Confident	65.8	Low	133 Å²	133	62.6 Å²	62.6	70%	0.696	33%	0.331	S	S	*	.	H	α-helix	trans	-84.3	-23	177.7	-64.7	177.6	0	0	0	113.2	I308 S309 E310 T314	I308-L312 HydrophobicContact CG2-CD1 3.72Å; I308-L312 HydrophobicContact CG2-CG 4.17Å; I308-L312 WeakPolarHBondContact O-CB 3.36Å; I308-L312 VanDerWaalsContact O-CG 3.28Å; I308-L312 WeakPolarHBondContact O-CG 3.35Å; I308-L312 PolarHBondContact O-N 3.45Å; S309-L312 PolarHBondContact O-N 3.01Å; E310-L312 PolarHBondContact O-N 3.47Å; L312-T314 PolarHBondContact O-N 3.19Å; L312-T314 VanDerWaalsContact O-N 3.12Å
313	S	65.8	Low	62.9	Low	19 Å²	19	65.5 Å²	65.5	13%	0.133	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-62.1	116.2	172.1	68.5	0	0	0	0	109.1	R291 S309 E310	R291-S313 PolarHBondContact NH2-OG 3.02Å; S309-S313 PolarHBondContact O-N 3.21Å; E310-S313 WeakPolarHBondContact CA-OG 3.48Å; E310-S313 PolarHBondContact O-N 3.42Å; E310-S313 VanDerWaalsContact O-N 3.12Å; E310-S313 PolarHBondContact O-OG 3.47Å
314	T	53.6	Low	59.9	Low	63 Å²	63	69.1 Å²	69.1	39%	0.387	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-78.9	125	164.4	26.3	0	0	0	0	105.5	L312 L316	L312-T314 PolarHBondContact O-N 3.19Å; L312-T314 VanDerWaalsContact O-N 3.12Å; T314-L316 PolarHBondContact O-N 2.76Å
315	P	50.1	Low	56.8	Low	20 Å²	20	76.2 Å²	76.2	13%	0.13	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-51.6	141.6	172.5	-23.6	32.6	0	0	0	109.2	S317 Q318	P315-S317 PolarHBondContact O-N 3.02Å; P315-Q318 PolarHBondContact O-N 3.23Å
316	L	44.5	Very low	53.7	Low	54 Å²	54	81.5 Å²	81.5	28%	0.283	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-45.4	-30.5	-179.8	-105.6	171.1	0	0	0	113.7	T314 Q318 L319 L577 T581 I600	T314-L316 PolarHBondContact O-N 2.76Å; L316-Q318 PolarHBondContact O-N 3.27Å; L316-L319 HydrophobicContact CD2-CD1 4.45Å; L316-L319 PolarHBondContact O-N 2.9Å; L316-L577 HydrophobicContact CD1-CD2 4.27Å; L316-T581 HydrophobicContact CD1-CG2 3.99Å; L316-T581 VanDerWaalsContact CD2-CB 3.43Å; L316-T581 HydrophobicContact CD2-CG2 3.83Å; L316-T581 WeakPolarHBondContact CD2-OG1 3.04Å; L316-T581 HydrophobicContact CG-CG2 4.27Å; L316-T581 WeakPolarHBondContact CG-OG1 3.21Å; L316-I600 HydrophobicContact CD1-CD1 4.22Å
317	S	42.4	Very low	50.6	Low	28 Å²	28	90.3 Å²	90.3	20%	0.196	48%	0.475	C	S	.	.	G	3₁₀ helix	trans	-53.8	-22.4	174.3	44.3	0	0	0	0	114.8	V225 D227 P315	V225-S317 PolarHBondContact O-OG 2.87Å; D227-S317 WeakPolarHBondContact OD1-CA 3.26Å; D227-S317 WeakPolarHBondContact OD1-CB 3.4Å; P315-S317 PolarHBondContact O-N 3.02Å
318	Q	39.6	Very low	47.3	Very low	95 Å²	95	96 Å²	96	44%	0.444	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-97.5	-9.6	-178.5	-65.6	-168.8	-4.3	0	0	115	P315 L316	P315-Q318 PolarHBondContact O-N 3.23Å; L316-Q318 PolarHBondContact O-N 3.27Å
319	L	36.6	Very low	44.3	Very low	59 Å²	59	99.1 Å²	99.1	31%	0.309	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-83.1	-14.6	-175.8	-72.2	173.5	0	0	0	113.8	L316 M321	L316-L319 HydrophobicContact CD2-CD1 4.45Å; L316-L319 PolarHBondContact O-N 2.9Å; L319-M321 PolarHBondContact O-N 3.03Å; L319-M321 VanDerWaalsContact O-N 3.12Å
320	S	32	Very low	41.6	Very low	56 Å²	56	105.2 Å²	105.2	39%	0.392	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-66.3	-12.1	-179.9	-174.8	0	0	0	0	114.7
321	M	31.2	Very low	38.5	Very low	165 Å²	165	111.7 Å²	111.7	81%	0.813	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-107	-1.2	-175.7	-68.1	-133.9	151.5	0	0	115.7	L319	L319-M321 PolarHBondContact O-N 3.03Å; L319-M321 VanDerWaalsContact O-N 3.12Å
322	K	27.9	Very low	35.6	Very low	188 Å²	188	113.6 Å²	113.6	82%	0.817	60%	0.601	S	S	*	*	S	Bend	trans	-94.9	1.1	-179.1	-79.5	-174.6	177.3	175.6	0	115.1
323	A	28.3	Very low	33.2	Very low	90 Å²	90	110.5 Å²	110.5	74%	0.744	60%	0.601	S	S	*	*	S	Bend	trans	-93.9	-12.6	-175.2	0	0	0	0	0	115.3
324	E	29.2	Very low	31.2	Very low	156 Å²	156	117.4 Å²	117.4	73%	0.729	64%	0.635	S	S	*	*			trans	-123.7	73.2	-172.1	-67.2	-176.9	-176.4	0	0	112.3
325	D	26.9	Very low	29.7	Very low	161 Å²	161	118.9 Å²	118.9	86%	0.861	65%	0.648	S	S	*	*	S	Bend	trans	-134.5	14.6	165.9	-120.4	-3.5	0	0	0	113.1
326	N	25.9	Very low	28.4	Very low	146 Å²	146	124.9 Å²	124.9	78%	0.781	68%	0.679	S	S	*	*	S	Bend	trans	-142.1	79.5	176.1	-81.9	-37.4	0	0	0	110.9
327	Q	27.1	Very low	27.4	Very low	193 Å²	193	129.3 Å²	129.3	90%	0.902	70%	0.703	S	S	*	*			trans	179.5	116.2	137.4	-96.5	155	87.1	0	0	112.3
328	T	22.4	Very low	26.7	Very low	126 Å²	126	134.7 Å²	134.7	77%	0.773	73%	0.729	S	S	*	*			trans	-20.8	129.9	157.1	46	0	0	0	0	118.6
329	E	22.3	Very low	25.9	Very low	185 Å²	185	138.2 Å²	138.2	86%	0.864	75%	0.751	S	S	*	*			trans	33.1	107.3	132.5	-58.4	-175.8	175.2	0	0	119
330	N	24.7	Very low	25.3	Very low	154 Å²	154	142 Å²	142	82%	0.824	78%	0.776	S	S	*	*			trans	-160.9	101.8	140.8	-131.2	-22.3	0	0	0	113.9
331	I	22.2	Very low	24.8	Very low	136 Å²	136	146.5 Å²	146.5	70%	0.697	79%	0.791	S	S	*	*			trans	17.5	128.2	134.7	-57	169.5	0	0	0	120.1
332	D	22.2	Very low	24.4	Very low	158 Å²	158	147.4 Å²	147.4	85%	0.845	80%	0.798	S	S	*	*			trans	51.6	120.3	147.4	-58.8	-24.8	0	0	0	123.2
333	G	21.5	Very low	24.1	Very low	68 Å²	68	142.6 Å²	142.6	70%	0.701	79%	0.789	S	S	*	*			trans	106.6	119.2	138.1	0	0	0	0	0	116.3
334	I	23.9	Very low	23.9	Very low	165 Å²	165	140 Å²	140	85%	0.846	77%	0.771	S	S	*	*				158.1	121.9	129.9	-79.5	159.1	0	0	0	112.1
335	S	23	Very low	23.6	Very low	94 Å²	94	136 Å²	136	66%	0.657	76%	0.757	S	S	*	*			trans	24.5	128.6	150.7	73.9	0	0	0	0	123.5
336	D	22.9	Very low	23.4	Very low	146 Å²	146	132 Å²	132	78%	0.781	74%	0.738	S	S	*	*				36.1	137.1	121.9	-58.1	-23.2	0	0	0	121.5
337	N	23.8	Very low	23.1	Very low	147 Å²	147	129.6 Å²	129.6	79%	0.786	74%	0.738	S	S	*	*			trans	84.5	103.1	170.8	-59.4	-27.1	0	0	0	115.6
338	N	26.4	Very low	23.1	Very low	140 Å²	140	125 Å²	125	75%	0.749	72%	0.719	S	S	*	*			trans	-161.8	102.1	131.5	-86.7	-27.1	0	0	0	109.3	V340	N338-V340 PolarHBondContact O-N 3.07Å
339	N	24.1	Very low	23.1	Very low	169 Å²	169	123.8 Å²	123.8	90%	0.904	71%	0.714	S	S	*	*			trans	-65.9	109.8	165.4	-72.2	-30.2	0	0	0	108
340	V	22.9	Very low	23.2	Very low	138 Å²	138	119.7 Å²	119.7	84%	0.836	71%	0.711	S	S	*	*			trans	-97.3	100.9	174	-177.9	0	0	0	0	107.9	N338	N338-V340 PolarHBondContact O-N 3.07Å
341	E	22.1	Very low	23.2	Very low	151 Å²	151	116.9 Å²	116.9	71%	0.706	70%	0.703	S	S	*	*			trans	-75.7	126.5	176.2	-148.9	172	-169.5	0	0	109.2	R118 S343	R118-E341 IonicContact NH2-OE1 3.38Å; R118-E341 PolarHBondContact NH2-OE1 3.06Å; E341-S343 VanDerWaalsContact C-N 3.28Å; E341-S343 PolarHBondContact O-N 3.37Å
342	L	22.3	Very low	23.4	Very low	184 Å²	184	121.2 Å²	121.2	96%	0.963	71%	0.711	S	S	*	*			trans	-76.6	74.5	-177.9	-164.2	79.2	0	0	0	110.3
343	S	21.7	Very low	23.5	Very low	88 Å²	88	124.2 Å²	124.2	62%	0.615	71%	0.71	S	S	*	*			trans	-96.4	151.2	173.2	-169.8	0	0	0	0	109.1	E341	E341-S343 VanDerWaalsContact C-N 3.28Å; E341-S343 PolarHBondContact O-N 3.37Å
344	G	24.5	Very low	23.7	Very low	35 Å²	35	128.2 Å²	128.2	36%	0.361	72%	0.716	S	S	.	*			cis	-176.9	142.7	-0.5	0	0	0	0	0	105.9
345	T	22.9	Very low	23.7	Very low	72 Å²	72	130.4 Å²	130.4	44%	0.442	71%	0.713	S	S	.	*			trans	-79.8	141.3	-179.6	-60.1	0	0	0	0	110.3	A347	T345-A347 PolarHBondContact O-N 3.02Å
346	V	22.5	Very low	24	Very low	76 Å²	76	132.7 Å²	132.7	46%	0.461	71%	0.709	S	S	.	*			trans	-60	113.4	176.5	179.2	0	0	0	0	110.4	I348	V346-I348 HydrophobicContact CG1-CG1 3.92Å
347	A	20.5	Very low	24.1	Very low	96 Å²	96	129.3 Å²	129.3	79%	0.793	71%	0.708	S	S	*	*			trans	-79.3	130.7	162.3	0	0	0	0	0	109.1	T345	T345-A347 PolarHBondContact O-N 3.02Å
348	I	26.9	Very low	24.4	Very low	97 Å²	97	127.4 Å²	127.4	50%	0.497	70%	0.697	S	S	.	*			trans	-108.1	134	177.9	-59.9	-177.4	0	0	0	109.5	L278 V346	L278-I348 HydrophobicContact CD2-CD1 4.3Å; V346-I348 HydrophobicContact CG1-CG1 3.92Å
349	P	22.4	Very low	24.4	Very low	101 Å²	101	128.2 Å²	128.2	66%	0.656	69%	0.689	S	S	*	*			trans	-62.8	138.9	-178.7	-19.3	30.3	0	0	0	113.1	S351	P349-S351 PolarHBondContact O-N 3.36Å
350	A	24.3	Very low	24.4	Very low	98 Å²	98	127.7 Å²	127.7	81%	0.81	68%	0.675	S	S	*	*	S	Bend	trans	-66.1	0.8	177.2	0	0	0	0	0	115.1	R352	A350-R352 PolarHBondContact O-N 3.39Å
351	S	24.5	Very low	24.4	Very low	95 Å²	95	128.8 Å²	128.8	66%	0.664	68%	0.675	S	S	*	*			trans	-88	84.9	-177.1	70.5	0	0	0	0	111.7	P349	P349-S351 PolarHBondContact O-N 3.36Å
352	R	25.5	Very low	24.5	Very low	227 Å²	227	127.5 Å²	127.5	86%	0.857	68%	0.677	S	S	*	*			trans	169	60.5	148.5	-91.7	175.8	-151.2	-133.4	8.4	108.2	A350	A350-R352 PolarHBondContact O-N 3.39Å
353	R	24.2	Very low	24.4	Very low	221 Å²	221	124.1 Å²	124.1	83%	0.834	67%	0.669	S	S	*	*			trans	-66	145.9	147.2	-83.5	176.5	163.8	127.5	-2.5	106.6
354	D	26.3	Very low	24.5	Very low	152 Å²	152	129.1 Å²	129.1	81%	0.813	68%	0.683	S	S	*	*	S	Bend	trans	80.3	53.6	168.5	-53.4	-26.6	0	0	0	120.5
355	R	25.1	Very low	24.3	Very low	211 Å²	211	135.3 Å²	135.3	80%	0.796	71%	0.708	S	S	*	*			trans	-131.1	-0	145.9	-77.7	-157.5	-159.2	-170	4.7	116.1	G357	R355-G357 PolarHBondContact O-N 3.12Å; R355-G357 VanDerWaalsContact O-N 3.12Å
356	Y	27.8	Very low	24.3	Very low	143 Å²	143	139.9 Å²	139.9	56%	0.561	73%	0.727	S	S	*	*			trans	-89.3	73	167.7	-66.5	-77	0	0	0	108	I358 E565	Y356-I358 PolarHBondContact O-N 3.14Å; Y356-E565 PolarHBondContact OH-OE2 3.07Å; Y356-E565 VanDerWaalsContact OH-OE2 3.07Å
357	G	26.1	Very low	24.2	Very low	74 Å²	74	143.4 Å²	143.4	76%	0.763	74%	0.744	S	S	*	*			trans	-62.7	82.9	158.3	0	0	0	0	0	107.1	R355 R359	R355-G357 PolarHBondContact O-N 3.12Å; R355-G357 VanDerWaalsContact O-N 3.12Å; G357-R359 PolarHBondContact O-N 2.82Å
358	I	28.8	Very low	24.3	Very low	108 Å²	108	144.2 Å²	144.2	55%	0.554	74%	0.743	S	S	*	*			trans	-63.3	94.8	168	-62.4	169.8	0	0	0	104.2	Y356 R360	Y356-I358 PolarHBondContact O-N 3.14Å; I358-R360 HydrophobicContact CG2-CB 3.62Å; I358-R360 HydrophobicContact CG2-CG 3.66Å; I358-R360 PolarHBondContact O-N 2.7Å
359	R	26.7	Very low	24	Very low	156 Å²	156	144.4 Å²	144.4	59%	0.589	75%	0.754	S	S	*	*			trans	-60.4	76.3	158.6	-99.6	-176.8	175.4	170.6	3.1	106.4	G357 D683	G357-R359 PolarHBondContact O-N 2.82Å; R359-D683 IonicContact NH1-OD2 2.66Å; R359-D683 PolarHBondContact NH1-OD2 3.24Å
360	R	24.7	Very low	23.9	Very low	158 Å²	158	150.7 Å²	150.7	60%	0.596	77%	0.766	S	S	*	*			trans	-87.9	117	178.7	-135.2	-176.7	-165.5	178.8	0.5	107.7	I358	I358-R360 HydrophobicContact CG2-CB 3.62Å; I358-R360 HydrophobicContact CG2-CG 3.66Å; I358-R360 PolarHBondContact O-N 2.7Å
361	L	23.8	Very low	23.8	Very low	161 Å²	161	153.1 Å²	153.1	84%	0.843	77%	0.765	S	S	*	*	S	Bend	trans	-58.8	135.5	146.5	-67.1	165.7	0	0	0	107.5
362	V	23.3	Very low	23.6	Very low	124 Å²	124	156.8 Å²	156.8	75%	0.752	78%	0.777	S	S	*	*			trans	95.6	103.2	174.8	-165.2	0	0	0	0	115.5
363	S	20.9	Very low	23.4	Very low	113 Å²	113	157.3 Å²	157.3	79%	0.79	78%	0.779	S	S	*	*			trans	-53.8	143.2	162.5	-45.8	0	0	0	0	112.9
364	E	23.3	Very low	23.4	Very low	193 Å²	193	155.5 Å²	155.5	90%	0.902	78%	0.78	S	S	*	*			trans	-167.3	123.4	142.2	-108.2	168.9	-154.7	0	0	109.8
365	N	20.3	Very low	23.2	Very low	166 Å²	166	156.3 Å²	156.3	89%	0.888	78%	0.784	S	S	*	*			trans	-70.2	130.3	177.8	-73.9	-40.1	0	0	0	110.9
366	I	22.8	Very low	23.1	Very low	167 Å²	167	149.9 Å²	149.9	86%	0.856	78%	0.776	S	S	*	*			trans	-137.5	118.7	152.3	-61.6	-178.3	0	0	0	108.8
367	D	20.5	Very low	22.8	Very low	150 Å²	150	150.3 Å²	150.3	80%	0.802	79%	0.788	S	S	*	*			trans	-89.3	131.8	179.9	-162.3	4.8	0	0	0	109.2
368	S	22.7	Very low	22.8	Very low	113 Å²	113	156.4 Å²	156.4	79%	0.79	79%	0.794	S	S	*	*			trans	-163.2	99.9	160.7	65	0	0	0	0	111.5
369	S	20.5	Very low	22.5	Very low	102 Å²	102	159.5 Å²	159.5	71%	0.713	81%	0.805	S	S	*	*			trans	-85.5	132.7	161.5	48.8	0	0	0	0	109.3
370	Y	20.6	Very low	22.4	Very low	233 Å²	233	159.8 Å²	159.8	91%	0.914	82%	0.819	S	S	*	*			trans	-152.9	122.5	154.4	-135	-95.4	0	0	0	110
371	D	21.4	Very low	22.3	Very low	149 Å²	149	158.6 Å²	158.6	80%	0.797	82%	0.824	S	S	*	*			trans	-68.2	132.4	-172	-78.1	-43.8	0	0	0	113.3
372	L	21.2	Very low	22.3	Very low	172 Å²	172	157.8 Å²	157.8	90%	0.901	82%	0.82	S	S	*	*			trans	-68.8	127.2	165.3	-81.8	137.9	0	0	0	110.3
373	R	21.6	Very low	22.4	Very low	238 Å²	238	158.6 Å²	158.6	90%	0.898	83%	0.826	S	S	*	*			trans	-128.4	122.3	161.3	-74.8	-171.2	178.4	177.8	0.9	111.3
374	E	22.7	Very low	22.6	Very low	183 Å²	183	158.2 Å²	158.2	86%	0.855	82%	0.823	S	S	*	*			trans	-25.1	140.8	168.7	-60.5	173.8	143.3	0	0	116.6
375	N	23.6	Very low	22.7	Very low	168 Å²	168	154.2 Å²	154.2	90%	0.898	82%	0.816	S	S	*	*				-158.2	107.9	129.2	-103.4	-34.4	0	0	0	111.6
376	A	21.2	Very low	23	Very low	77 Å²	77	153.5 Å²	153.5	64%	0.636	81%	0.813	S	S	*	*			trans	-78.5	163.6	166.6	0	0	0	0	0	111.3
377	N	23	Very low	23	Very low	151 Å²	151	154.6 Å²	154.6	81%	0.807	81%	0.812	S	S	*	*			trans	93.8	107.1	165.6	-50.6	-47	0	0	0	116.7
378	K	25.7	Very low	23.2	Very low	203 Å²	203	152.9 Å²	152.9	88%	0.883	81%	0.806	S	S	*	*				175.1	127.3	94.1	-102.7	173.4	178.2	172.7	0	111.6
379	H	21.5	Very low	23.4	Very low	172 Å²	172	152.4 Å²	152.4	80%	0.796	80%	0.795	S	S	*	*			trans	-51.5	143	157.4	-70	-85.6	0	0	0	111.8
380	N	26	Very low	23.7	Very low	163 Å²	163	151.5 Å²	151.5	87%	0.872	79%	0.787	S	S	*	*			trans	-157.4	129.6	134.1	-91.7	-26.3	0	0	0	109.9
381	N	21.8	Very low	24	Very low	133 Å²	133	144.3 Å²	144.3	71%	0.711	77%	0.771	S	S	*	*			trans	-72.7	175	175.9	-69.5	-27.3	0	0	0	111.7
382	D	23.6	Very low	24.4	Very low	143 Å²	143	143 Å²	143	77%	0.765	76%	0.764	S	S	*	*			trans	89.4	108.5	155.7	-53.6	-29.3	0	0	0	115.8
383	T	26.2	Very low	25.1	Very low	141 Å²	141	141.5 Å²	141.5	87%	0.865	75%	0.75	S	S	*	*				-177.5	143.2	101.7	29.7	0	0	0	0	111.3
384	S	23.6	Very low	25.3	Very low	105 Å²	105	136.3 Å²	136.3	73%	0.734	75%	0.745	S	S	*	*			trans	-58.6	125.4	-177	51.1	0	0	0	0	113.5
385	S	25.3	Very low	25.3	Very low	109 Å²	109	136.4 Å²	136.4	76%	0.762	75%	0.745	S	S	*	*			trans	-85.6	107.9	168.8	58.2	0	0	0	0	110	F387	S385-F387 PolarHBondContact O-N 3.09Å
386	D	26.7	Very low	25.3	Very low	152 Å²	152	132.9 Å²	132.9	81%	0.813	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-66.7	116.6	169.1	-71.6	-39.1	0	0	0	109.7
387	F	22.6	Very low	25.3	Very low	189 Å²	189	138.1 Å²	138.1	83%	0.829	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-81.6	128.8	-171.5	-155.2	-97.8	0	0	0	110.6	S385	S385-F387 PolarHBondContact O-N 3.09Å
388	V	26.4	Very low	25.4	Very low	114 Å²	114	136.3 Å²	136.3	69%	0.691	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-101.5	135.1	177	179.4	0	0	0	0	109.9
389	D	26.5	Very low	25.2	Very low	103 Å²	103	132.3 Å²	132.3	55%	0.551	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-64.7	128.9	-173.5	-169.8	-33.4	0	0	0	112.9	S391	D389-S391 PolarHBondContact O-N 2.88Å; D389-S391 WeakPolarHBondContact OD1-CB 3.07Å; D389-S391 PolarHBondContact OD1-N 2.99Å; D389-S391 PolarHBondContact OD1-OG 3.08Å; D389-S391 PolarHBondContact OD2-OG 2.83Å
390	P	27.3	Very low	25.3	Very low	84 Å²	84	129.1 Å²	129.1	55%	0.545	73%	0.731	S	S	.	*	G	3₁₀ helix	trans	-69.4	-6.7	-179.5	-18.9	31.8	0	0	0	116.4	D392 F393	P390-D392 PolarHBondContact O-N 3.21Å; P390-F393 PolarHBondContact O-N 2.88Å; P390-F393 VanDerWaalsContact O-N 3.14Å
391	S	26.7	Very low	25.2	Very low	82 Å²	82	125.7 Å²	125.7	57%	0.573	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-64.9	-8.5	-179.1	42.6	0	0	0	0	114.4	D389 F393	D389-S391 PolarHBondContact O-N 2.88Å; D389-S391 WeakPolarHBondContact OD1-CB 3.07Å; D389-S391 PolarHBondContact OD1-N 2.99Å; D389-S391 PolarHBondContact OD1-OG 3.08Å; D389-S391 PolarHBondContact OD2-OG 2.83Å; S391-F393 PolarHBondContact O-N 3.42Å
392	D	29.8	Very low	25.4	Very low	122 Å²	122	125.7 Å²	125.7	65%	0.652	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-73.1	-4	170.4	-80.6	-15.6	0	0	0	115.2	P390	P390-D392 PolarHBondContact O-N 3.21Å
393	F	35.8	Very low	25.6	Very low	140 Å²	140	128 Å²	128	61%	0.614	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-114.8	3.5	-169.9	-66.5	-80.9	0	0	0	116.2	P390 S391 E395	P390-F393 PolarHBondContact O-N 2.88Å; P390-F393 VanDerWaalsContact O-N 3.14Å; S391-F393 PolarHBondContact O-N 3.42Å; F393-E395 PolarHBondContact O-N 2.96Å; F393-E395 VanDerWaalsContact O-N 3.12Å
394	V	24.1	Very low	25.6	Very low	129 Å²	129	127.9 Å²	127.9	78%	0.782	72%	0.723	S	S	*	*			trans	-87	80.2	178.7	-169	0	0	0	0	110.3
395	E	24.2	Very low	25.7	Very low	184 Å²	184	128.3 Å²	128.3	86%	0.86	72%	0.723	S	S	*	*			trans	-81.9	116.4	165.4	-157.8	168.1	-159	0	0	109.4	F393	F393-E395 PolarHBondContact O-N 2.96Å; F393-E395 VanDerWaalsContact O-N 3.12Å
396	S	23.2	Very low	25.8	Very low	94 Å²	94	132.9 Å²	132.9	66%	0.657	73%	0.73	S	S	*	*			trans	-57.3	136.7	-175.7	51.5	0	0	0	0	113.2	S398	S396-S398 PolarHBondContact O-N 3.37Å
397	H	22.2	Very low	25.8	Very low	188 Å²	188	133 Å²	133	87%	0.87	73%	0.73	S	S	*	*			trans	-32.6	90.6	174.7	-49.6	-72.8	0	0	0	115.4	V399	H397-V399 PolarHBondContact O-N 2.96Å
398	S	23.7	Very low	25.9	Very low	113 Å²	113	129.4 Å²	129.4	79%	0.79	73%	0.725	S	S	*	*			trans	-84.1	91.8	165.4	49.1	0	0	0	0	109	S396	S396-S398 PolarHBondContact O-N 3.37Å
399	V	22.4	Very low	26	Very low	119 Å²	119	130.1 Å²	130.1	72%	0.721	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-48.1	137.6	165.4	-176.6	0	0	0	0	108.7	H397 S401	H397-V399 PolarHBondContact O-N 2.96Å; V399-S401 PolarHBondContact O-N 3.43Å
400	P	24	Very low	26	Very low	105 Å²	105	136 Å²	136	68%	0.682	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-54.3	118	-177.9	-22.7	31.4	0	0	0	110.5
401	S	22.2	Very low	25.9	Very low	91 Å²	91	136.3 Å²	136.3	64%	0.636	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-53.2	130.9	175.8	-91.1	0	0	0	0	110	V399 K403	V399-S401 PolarHBondContact O-N 3.43Å; S401-K403 PolarHBondContact O-N 3.19Å
402	P	27.3	Very low	25.9	Very low	132 Å²	132	138.7 Å²	138.7	86%	0.857	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	9.4	-179.8	-19.1	30.1	0	0	0	115.1
403	K	27.2	Very low	25.8	Very low	192 Å²	192	138.4 Å²	138.4	84%	0.835	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	9.1	-174.2	-71.2	-174.2	178.1	175.7	0	114.2	S401 P405	S401-K403 PolarHBondContact O-N 3.19Å; K403-P405 VanDerWaalsContact O-CD 3.24Å; K403-P405 WeakPolarHBondContact O-CD 3.24Å
404	L	26.2	Very low	25.5	Very low	138 Å²	138	136.9 Å²	136.9	72%	0.723	78%	0.777	S	S	*	*	S	Bend	trans	-68.9	114.6	168.9	-89	159.4	0	0	0	109.4	F406	L404-F406 PolarHBondContact O-N 2.71Å; L404-F406 VanDerWaalsContact O-N 3.12Å
405	P	26.6	Very low	25.6	Very low	114 Å²	114	136.9 Å²	136.9	74%	0.74	78%	0.781	S	S	*	*			trans	-70	115.3	-178.2	27.6	-29.9	0	0	0	108.8	K403 L407	K403-P405 VanDerWaalsContact O-CD 3.24Å; K403-P405 WeakPolarHBondContact O-CD 3.24Å; P405-L407 PolarHBondContact O-N 3.13Å; P405-L407 VanDerWaalsContact O-N 3.12Å
406	F	26.2	Very low	25.6	Very low	205 Å²	205	139.8 Å²	139.8	90%	0.899	78%	0.784	S	S	*	*			trans	-40.7	116.8	170	-82.9	-97.8	0	0	0	110.6	L404	L404-F406 PolarHBondContact O-N 2.71Å; L404-F406 VanDerWaalsContact O-N 3.12Å
407	L	26.3	Very low	25.8	Very low	155 Å²	155	144 Å²	144	81%	0.812	79%	0.79	S	S	*	*			trans	-56.8	137.1	160.8	-72.6	170.3	0	0	0	107.9	P405 S409	P405-L407 PolarHBondContact O-N 3.13Å; P405-L407 VanDerWaalsContact O-N 3.12Å; L407-S409 PolarHBondContact O-N 2.86Å
408	P	26.5	Very low	26.1	Very low	113 Å²	113	142.7 Å²	142.7	73%	0.734	79%	0.79	S	S	*	*			trans	-57.3	128.1	-169.7	-20.9	29.1	0	0	0	111.8	R410	P408-R410 PolarHBondContact O-N 3.37Å
409	S	27.9	Very low	26.2	Very low	129 Å²	129	145.3 Å²	145.3	90%	0.902	79%	0.793	S	S	*	*	S	Bend	trans	-67.8	9.9	179	55.6	0	0	0	0	115	L407	L407-S409 PolarHBondContact O-N 2.86Å
410	R	25.3	Very low	26.3	Very low	226 Å²	226	147.4 Å²	147.4	85%	0.853	80%	0.8	S	S	*	*			trans	-107.4	96.9	-179.2	-85.7	-176.1	170.4	-166.2	-2	111.1	P408	P408-R410 PolarHBondContact O-N 3.37Å
411	S	26.3	Very low	26.5	Very low	92 Å²	92	151.3 Å²	151.3	64%	0.643	81%	0.809	S	S	*	*			trans	-64.5	132.5	152.3	88.5	0	0	0	0	108.3	V413	S411-V413 PolarHBondContact O-N 2.77Å
412	P	25.7	Very low	26.6	Very low	131 Å²	131	157.1 Å²	157.1	85%	0.851	82%	0.823	S	S	*	*	S	Bend	trans	-82	66.4	175.3	33.1	-31.8	0	0	0	109.1
413	V	29.1	Very low	26.5	Very low	116 Å²	116	156.5 Å²	156.5	70%	0.703	82%	0.816	S	S	*	*			trans	-116.4	81.3	166.3	-175.5	0	0	0	0	106.5	S411 C415	S411-V413 PolarHBondContact O-N 2.77Å; V413-C415 PolarHBondContact O-N 3.11Å
414	S	28.6	Very low	26.4	Very low	109 Å²	109	153.9 Å²	153.9	76%	0.762	81%	0.811	S	S	*	*			trans	-56.7	123.1	170.9	-82.3	0	0	0	0	109.6	R416	S414-R416 PolarHBondContact O-N 3.44Å; S414-R416 VanDerWaalsContact O-N 3.13Å
415	C	26.3	Very low	26.5	Very low	128 Å²	128	157.1 Å²	157.1	87%	0.865	82%	0.823	S	S	*	*			trans	-39.7	109.9	173.8	-56.1	0	0	0	0	112.5	V413	V413-C415 PolarHBondContact O-N 3.11Å
416	R	25.1	Very low	26.3	Very low	245 Å²	245	159 Å²	159	93%	0.925	83%	0.825	S	S	*	*			trans	-102.3	68.2	162.2	-76.4	-172	177.6	167.7	0.3	109.6	S414	S414-R416 PolarHBondContact O-N 3.44Å; S414-R416 VanDerWaalsContact O-N 3.13Å
417	K	27.4	Very low	26.3	Very low	182 Å²	182	155.8 Å²	155.8	79%	0.791	82%	0.818	S	S	*	*			trans	-145.5	106.4	161.5	-72.8	-169.8	179.2	178.6	0	106.4
418	N	28	Very low	26.4	Very low	162 Å²	162	154.6 Å²	154.6	87%	0.866	81%	0.812	S	S	*	*			trans	158.2	58.5	157.9	-75.7	-8.8	0	0	0	109
419	I	25.5	Very low	26.5	Very low	168 Å²	168	158.9 Å²	158.9	86%	0.862	82%	0.822	S	S	*	*			trans	-120.8	74.5	157.3	-57.3	176	0	0	0	105.1
420	L	24.3	Very low	26.3	Very low	163 Å²	163	160.1 Å²	160.1	85%	0.853	82%	0.818	S	S	*	*			trans	-164.8	139.6	161.9	-133.8	70.9	0	0	0	105.9
421	Q	27.6	Very low	26.4	Very low	187 Å²	187	153.9 Å²	153.9	87%	0.874	81%	0.809	S	S	*	*			trans	92.4	75.9	-172.7	-53.7	178.7	3.7	0	0	114.7
422	K	24.7	Very low	26.4	Very low	213 Å²	213	157.2 Å²	157.2	93%	0.926	82%	0.82	S	S	*	*			trans	-146.9	62.2	159.7	-115.6	-168.8	-175.7	-174.8	0	110.7
423	T	25.1	Very low	26.3	Very low	118 Å²	118	157.1 Å²	157.1	72%	0.724	82%	0.816	S	S	*	*			trans	-165.5	117.1	167.9	44.9	0	0	0	0	101.8
424	D	26.6	Very low	26.3	Very low	137 Å²	137	157.6 Å²	157.6	73%	0.733	82%	0.819	S	S	*	*			cis	-157.7	141.3	26.5	-66	-56.4	0	0	0	106.2
425	Q	27.9	Very low	26.1	Very low	206 Å²	206	158.4 Å²	158.4	96%	0.963	82%	0.815	S	S	*	*			trans	-170.4	80.9	153.3	-107.2	166.8	92.7	0	0	108
426	I	22.9	Very low	26.1	Very low	154 Å²	154	159.7 Å²	159.7	79%	0.79	81%	0.813	S	S	*	*			trans	-95.6	110.5	163.7	-67.2	166.9	0	0	0	104.9
427	N	25.4	Very low	26.2	Very low	138 Å²	138	151.7 Å²	151.7	74%	0.738	81%	0.807	S	S	*	*				160.8	150.3	129.7	-97.9	-11.4	0	0	0	112.6
428	D	28.1	Very low	26	Very low	130 Å²	130	152.5 Å²	152.5	70%	0.695	81%	0.811	S	S	*	*			trans	81.4	69.1	156.1	-54.9	-23.8	0	0	0	118.5
429	H	29.3	Very low	26	Very low	202 Å²	202	153.8 Å²	153.8	94%	0.935	81%	0.811	S	S	*	*			trans	-136.3	90.3	139.8	-80.6	-51.7	0	0	0	110.8
430	N	23.9	Very low	25.9	Very low	155 Å²	155	151.3 Å²	151.3	83%	0.829	81%	0.809	S	S	*	*			trans	-88.4	146.5	166.3	-113.3	-21.2	0	0	0	110.3
431	S	25.9	Very low	26	Very low	95 Å²	95	149.1 Å²	149.1	66%	0.664	80%	0.802	S	S	*	*			trans	60.3	105.4	160.1	61.6	0	0	0	0	118.4
432	N	28.1	Very low	25.8	Very low	162 Å²	162	149.7 Å²	149.7	87%	0.866	80%	0.802	S	S	*	*				-162.7	105.5	107.4	-90	-28.7	0	0	0	111.1
433	V	22.8	Very low	25.7	Very low	129 Å²	129	149.2 Å²	149.2	78%	0.782	80%	0.796	S	S	*	*			trans	-72	137.8	159	170.5	0	0	0	0	107.3
434	V	28.4	Very low	25.7	Very low	126 Å²	126	149.7 Å²	149.7	76%	0.764	79%	0.794	S	S	*	*			trans	-177.6	111.4	138.7	160.6	0	0	0	0	110.2
435	N	24.8	Very low	25.5	Very low	126 Å²	126	149.7 Å²	149.7	67%	0.674	80%	0.799	S	S	*	*			trans	57.3	129.1	134.4	-68.1	-17.6	0	0	0	125.1
436	N	25.5	Very low	25.5	Very low	155 Å²	155	147.1 Å²	147.1	83%	0.829	79%	0.792	S	S	*	*				78.7	124.2	125.8	-72.8	-13.1	0	0	0	120.4
437	G	28.2	Very low	25.5	Very low	77 Å²	77	145.4 Å²	145.4	79%	0.794	79%	0.789	S	S	*	*			trans	158.1	71.8	156.4	0	0	0	0	0	114.2
438	K	23.5	Very low	25.4	Very low	200 Å²	200	144.9 Å²	144.9	87%	0.87	79%	0.791	S	S	*	*			trans	-65.1	134	161.3	-71.8	173.4	175.1	174.6	0	108.8
439	H	28.3	Very low	25.4	Very low	188 Å²	188	145 Å²	145	87%	0.87	80%	0.797	S	S	*	*			trans	-158.9	108.1	139.2	-94.6	-62.1	0	0	0	110.1
440	S	23.1	Very low	25.3	Very low	116 Å²	116	141.8 Å²	141.8	81%	0.811	79%	0.791	S	S	*	*			trans	-87.5	130.9	162.4	60.5	0	0	0	0	108.7
441	T	26.5	Very low	25.4	Very low	117 Å²	117	137.9 Å²	137.9	72%	0.718	79%	0.787	S	S	*	*			trans	-142.4	106	163	-31.5	0	0	0	0	108.7	Y443	T441-Y443 HydrophobicContact CG2-CD2 4.22Å
442	K	22.7	Very low	25.2	Very low	200 Å²	200	140.6 Å²	140.6	87%	0.87	79%	0.794	S	S	*	*			trans	-82	131.5	163.9	-71.2	177.3	174.2	179.6	0	107.2
443	Y	23.4	Very low	25.1	Very low	203 Å²	203	140.7 Å²	140.7	80%	0.796	80%	0.795	S	S	*	*			trans	-153.1	126.5	152.4	-94.8	-70.6	0	0	0	112.5	T441	T441-Y443 HydrophobicContact CG2-CD2 4.22Å
444	N	24.5	Very low	25.2	Very low	128 Å²	128	141.5 Å²	141.5	68%	0.684	79%	0.793	S	S	*	*			trans	59	101.7	144.3	-72.3	-3.4	0	0	0	122.4
445	T	22.8	Very low	25	Very low	137 Å²	137	143.3 Å²	143.3	84%	0.84	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-49.5	126.3	134.9	34.6	0	0	0	0	113.1
446	N	27.9	Very low	24.9	Very low	152 Å²	152	143.9 Å²	143.9	81%	0.813	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-102.3	125	165.4	-82.7	-17.4	0	0	0	111
447	T	21.4	Very low	24.8	Very low	118 Å²	118	143.9 Å²	143.9	72%	0.724	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-53.2	146.4	162.9	34.2	0	0	0	0	114.4
448	T	24	Very low	24.8	Very low	126 Å²	126	148.2 Å²	148.2	77%	0.773	81%	0.807	S	S	*	*				150.9	125.3	117.3	40	0	0	0	0	112.5
449	T	28.7	Very low	24.8	Very low	134 Å²	134	143.3 Å²	143.3	82%	0.822	80%	0.804	S	S	*	*			trans	169	83.1	142.5	29.2	0	0	0	0	107.4
450	T	26.9	Very low	24.6	Very low	133 Å²	133	146.2 Å²	146.2	82%	0.816	81%	0.807	S	S	*	*				57.1	96.4	101	54.7	0	0	0	0	115.5
451	G	25.2	Very low	24.8	Very low	73 Å²	73	146.5 Å²	146.5	75%	0.753	80%	0.804	S	S	*	*				86.5	97.2	106.1	0	0	0	0	0	118.8
452	N	22.7	Very low	24.7	Very low	152 Å²	152	148.4 Å²	148.4	81%	0.813	81%	0.81	S	S	*	*			trans	24.8	123.9	133	-63.4	-8.9	0	0	0	119.2
453	N	27	Very low	24.8	Very low	165 Å²	165	145.6 Å²	145.6	88%	0.882	81%	0.805	S	S	*	*				-167.3	128.8	108.3	-95.8	-26.7	0	0	0	112
454	I	23.2	Very low	24.8	Very low	145 Å²	145	142.8 Å²	142.8	74%	0.744	80%	0.803	S	S	*	*			trans	-82.1	123.4	172.9	-67.1	161.3	0	0	0	106.7
455	N	25	Very low	24.7	Very low	165 Å²	165	144.1 Å²	144.1	88%	0.882	81%	0.808	S	S	*	*			trans	-134.7	99.4	158.4	-95	-16.6	0	0	0	107.8
456	N	21.7	Very low	24.6	Very low	138 Å²	138	146 Å²	146	74%	0.738	81%	0.805	S	S	*	*			trans	-71.1	125	161.8	-73.8	-33.7	0	0	0	107.6
457	N	25.1	Very low	24.3	Very low	154 Å²	154	140.8 Å²	140.8	82%	0.824	79%	0.787	S	S	*	*			trans	178.4	104.3	147.2	-85.6	-24	0	0	0	106.9
458	D	28	Very low	24.3	Very low	168 Å²	168	141.5 Å²	141.5	90%	0.898	79%	0.794	S	S	*	*			trans	179.7	98.7	131	-86.3	-21.2	0	0	0	109.4
459	A	22.3	Very low	24.2	Very low	98 Å²	98	142.5 Å²	142.5	81%	0.81	79%	0.793	S	S	*	*			trans	-83.1	104.7	174.4	0	0	0	0	0	109.6
460	R	24.6	Very low	23.9	Very low	248 Å²	248	140.2 Å²	140.2	94%	0.936	78%	0.782	S	S	*	*			trans	-154.6	68.1	157.1	-69.6	-163.2	-176.1	-175	1	110.4
461	T	27.1	Very low	23.7	Very low	123 Å²	123	141 Å²	141	76%	0.755	78%	0.78	S	S	*	*			trans	-104.7	105.5	164.2	43.6	0	0	0	0	107.8	D463	T461-D463 PolarHBondContact O-N 3.21Å
462	N	25.3	Very low	23.6	Very low	156 Å²	156	144.6 Å²	144.6	83%	0.834	78%	0.777	S	S	*	*			trans	-61.4	104.7	170.5	-79.1	-24.7	0	0	0	108.4	L464	N462-L464 VanDerWaalsContact C-N 3.26Å; N462-L464 PolarHBondContact O-N 3.42Å
463	D	23.9	Very low	23.6	Very low	142 Å²	142	143.8 Å²	143.8	76%	0.759	77%	0.773	S	S	*	*			trans	-66.7	86.7	169	-73.9	-30.8	0	0	0	108.9	T461 I465	T461-D463 PolarHBondContact O-N 3.21Å; D463-I465 VanDerWaalsContact C-N 3.25Å; D463-I465 PolarHBondContact O-N 3.4Å
464	L	23.5	Very low	23.4	Very low	144 Å²	144	143.6 Å²	143.6	75%	0.754	77%	0.772	S	S	*	*			trans	-71.9	91	161	-72.2	171.8	0	0	0	107.1	N462 F466	N462-L464 VanDerWaalsContact C-N 3.26Å; N462-L464 PolarHBondContact O-N 3.42Å; L464-F466 VanDerWaalsContact C-N 3.26Å; L464-F466 PolarHBondContact O-N 3.33Å
465	I	22.3	Very low	23.4	Very low	155 Å²	155	140.1 Å²	140.1	80%	0.795	76%	0.761	S	S	*	*			trans	-61	88.6	171.2	-59.7	171.3	0	0	0	107.7	D463 G467	D463-I465 VanDerWaalsContact C-N 3.25Å; D463-I465 PolarHBondContact O-N 3.4Å; I465-G467 VanDerWaalsContact C-N 3.31Å; I465-G467 PolarHBondContact O-N 2.89Å; I465-G467 VanDerWaalsContact O-N 3.09Å
466	F	21.9	Very low	24	Very low	177 Å²	177	135.1 Å²	135.1	78%	0.776	73%	0.734	S	S	*	*			trans	-73.8	94.5	159.1	-87.1	-85	0	0	0	107	L464	L464-F466 VanDerWaalsContact C-N 3.26Å; L464-F466 PolarHBondContact O-N 3.33Å
467	G	20.3	Very low	24.8	Very low	42 Å²	42	130.7 Å²	130.7	43%	0.433	71%	0.71	S	S	.	*			trans	-53.3	153.8	166.1	0	0	0	0	0	110.7	I465 I469	I465-G467 VanDerWaalsContact C-N 3.31Å; I465-G467 PolarHBondContact O-N 2.89Å; I465-G467 VanDerWaalsContact O-N 3.09Å; G467-I469 PolarHBondContact O-N 2.95Å
468	P	22.6	Very low	25.4	Very low	134 Å²	134	126.3 Å²	126.3	87%	0.87	69%	0.692	S	S	*	*			trans	-58	116	-173.1	24.7	-32.4	0	0	0	109.3	S470	P468-S470 PolarHBondContact O-N 2.92Å
469	I	21	Very low	25.5	Very low	147 Å²	147	119.4 Å²	119.4	75%	0.754	66%	0.66	S	S	*	*			trans	-54.9	107.3	174.5	-63.3	169.2	0	0	0	106.5	G467 L471	G467-I469 PolarHBondContact O-N 2.95Å; I469-L471 PolarHBondContact O-N 3.01Å
470	S	22.3	Very low	25.9	Very low	85 Å²	85	119.7 Å²	119.7	59%	0.594	65%	0.647	S	S	*	*			trans	-51.5	114.3	169	177.7	0	0	0	0	106.4	P468 H472	P468-S470 PolarHBondContact O-N 2.92Å; S470-H472 PolarHBondContact O-N 2.93Å
471	L	22.2	Very low	25.8	Very low	150 Å²	150	112 Å²	112	79%	0.785	63%	0.632	S	S	*	*			trans	-69.5	75.2	175.5	-159.1	83	0	0	0	106.3	I469 N473	I469-L471 PolarHBondContact O-N 3.01Å; L471-N473 PolarHBondContact O-N 3.15Å
472	H	22.6	Very low	25.7	Very low	149 Å²	149	115 Å²	115	69%	0.69	63%	0.634	S	S	*	*			trans	-61.8	114.3	171	-100.1	-60	0	0	0	106.5	S470 N474	S470-H472 PolarHBondContact O-N 2.93Å; H472-N474 PolarHBondContact O-N 3.39Å
473	N	23.8	Very low	25.7	Very low	135 Å²	135	114.6 Å²	114.6	72%	0.722	63%	0.632	S	S	*	*			trans	-60.1	80.6	-179.8	-74.3	-30.9	0	0	0	110.1	L471 S475	L471-N473 PolarHBondContact O-N 3.15Å; N473-S475 PolarHBondContact O-N 3.11Å
474	N	23.4	Very low	25.7	Very low	161 Å²	161	110.6 Å²	110.6	86%	0.861	62%	0.624	S	S	*	*			trans	-79.5	51.3	175	-73.3	-9.6	0	0	0	111.1	H472	H472-N474 PolarHBondContact O-N 3.39Å
475	S	23.4	Very low	25.8	Very low	72 Å²	72	109.2 Å²	109.2	50%	0.503	62%	0.624	S	S	.	*			trans	-128.2	124.7	178.3	62.2	0	0	0	0	110.7	N473	N473-S475 PolarHBondContact O-N 3.11Å
476	N	37.2	Very low	25.8	Very low	60 Å²	60	107.6 Å²	107.6	32%	0.321	63%	0.626	S	S	.	*			trans	105	68.8	158	-45.2	-21.4	0	0	0	117.9	F133	F133-N476 VanDerWaalsContact CE2-O 3.23Å; F133-N476 WeakPolarHBondContact CE2-O 3.23Å
477	D	37.2	Very low	25.9	Very low	44 Å²	44	108.9 Å²	108.9	24%	0.235	63%	0.632	C	S	.	*	S	Bend	trans	-84.2	-0.5	143.5	-163.9	13.6	0	0	0	111	R92 K129 G479	R92-D477 IonicContact CZ-OD1 2.66Å; R92-D477 IonicContact NH1-OD1 2.8Å; R92-D477 PolarHBondContact NH1-OD1 2.97Å; R92-D477 VanDerWaalsContact NH1-OD1 3.13Å; R92-D477 IonicContact NH1-OD2 3.76Å; R92-D477 IonicContact NH2-OD1 3.58Å; R92-D477 PolarHBondContact NH2-OD1 2.81Å; K129-D477 IonicContact NZ-OD1 3.58Å; K129-D477 IonicContact NZ-OD2 3.8Å; K129-D477 PolarHBondContact NZ-OD2 3.15Å; D477-G479 PolarHBondContact O-N 3.38Å; D477-G479 VanDerWaalsContact O-N 3.15Å
478	S	38.8	Very low	26.1	Very low	63 Å²	63	109.5 Å²	109.5	44%	0.441	64%	0.638	S	S	.	*	S	Bend	trans	-74.5	5.7	176.4	45.7	0	0	0	0	114.8	Q190	Q190-S478 PolarHBondContact NE2-O 2.96Å
479	G	30.5	Very low	26	Very low	23 Å²	23	108.1 Å²	108.1	24%	0.237	63%	0.632	C	S	.	*	S	Bend	trans	78.5	132.4	176.9	0	0	0	0	0	113.7	D477	D477-G479 PolarHBondContact O-N 3.38Å; D477-G479 VanDerWaalsContact O-N 3.15Å
480	I	29.2	Very low	26.1	Very low	103 Å²	103	106.8 Å²	106.8	53%	0.528	63%	0.63	S	S	.	*			trans	102.1	124	172.3	-57	152.2	0	0	0	114.4
481	S	24.4	Very low	26.1	Very low	88 Å²	88	112.3 Å²	112.3	62%	0.615	64%	0.644	S	S	*	*			trans	-77	152.6	-178.3	70	0	0	0	0	112.4
482	F	24.5	Very low	26.1	Very low	185 Å²	185	114 Å²	114	81%	0.811	65%	0.645	S	S	*	*			trans	-109.8	88	168.7	-94.9	-92.3	0	0	0	108.3	G484	F482-G484 PolarHBondContact O-N 2.92Å
483	D	24	Very low	26.1	Very low	148 Å²	148	111.9 Å²	111.9	79%	0.791	65%	0.653	S	S	*	*			trans	-90	79.6	164.8	-73.9	-38	0	0	0	108.8
484	G	24.5	Very low	26	Very low	57 Å²	57	115 Å²	115	59%	0.588	66%	0.663	S	S	*	*			trans	-89.5	138.4	169.4	0	0	0	0	0	110.6	F482 S486	F482-G484 PolarHBondContact O-N 2.92Å; G484-S486 PolarHBondContact O-N 3.44Å
485	P	25.9	Very low	25.9	Very low	116 Å²	116	117.2 Å²	117.2	75%	0.753	67%	0.665	S	S	*	*			trans	-64.6	121.6	-179.5	23.9	-30.7	0	0	0	111	F487	P485-F487 PolarHBondContact O-N 3.06Å
486	S	23.4	Very low	25.8	Very low	120 Å²	120	118.8 Å²	118.8	84%	0.839	68%	0.676	S	S	*	*			trans	-69.1	113.1	176.1	-173.3	0	0	0	0	110.2	G484 G488	G484-S486 PolarHBondContact O-N 3.44Å; S486-G488 PolarHBondContact O-N 3.49Å
487	F	22.7	Very low	25.2	Very low	205 Å²	205	124.3 Å²	124.3	90%	0.899	70%	0.704	S	S	*	*			trans	-73.6	73.8	171	-77.9	-89.2	0	0	0	110.1	P485 S489	P485-F487 PolarHBondContact O-N 3.06Å; F487-S489 PolarHBondContact O-N 3.33Å
488	G	24.1	Very low	24.5	Very low	54 Å²	54	129.1 Å²	129.1	56%	0.557	73%	0.729	S	S	*	*			trans	-85.6	95.9	169.5	0	0	0	0	0	110.8	S486 V490	S486-G488 PolarHBondContact O-N 3.49Å; G488-V490 PolarHBondContact O-N 2.84Å
489	S	21.4	Very low	23.8	Very low	106 Å²	106	130.9 Å²	130.9	74%	0.741	74%	0.741	S	S	*	*			trans	-58.9	103.6	167.9	175.5	0	0	0	0	110.1	F487	F487-S489 PolarHBondContact O-N 3.33Å
490	V	23.7	Very low	23.6	Very low	118 Å²	118	137.1 Å²	137.1	72%	0.715	77%	0.769	S	S	*	*			trans	-119.6	85.8	171.5	-176.2	0	0	0	0	108.7	G488 K492	G488-V490 PolarHBondContact O-N 2.84Å; V490-K492 HydrophobicContact CG1-CB 4.15Å; V490-K492 HydrophobicContact CG1-CG 4.41Å; V490-K492 PolarHBondContact O-N 2.83Å
491	F	20.8	Very low	23.5	Very low	202 Å²	202	138 Å²	138	89%	0.886	78%	0.781	S	S	*	*			trans	-74	99.7	155	-83.4	-90.5	0	0	0	107.7
492	K	23.6	Very low	23.6	Very low	186 Å²	186	137.2 Å²	137.2	81%	0.809	79%	0.787	S	S	*	*			trans	-120.2	111.3	163.8	-107.9	-179	177.4	177.1	0	109.2	V490 Q494	V490-K492 HydrophobicContact CG1-CB 4.15Å; V490-K492 HydrophobicContact CG1-CG 4.41Å; V490-K492 PolarHBondContact O-N 2.83Å; K492-Q494 PolarHBondContact O-N 2.94Å
493	A	21.9	Very low	23.8	Very low	103 Å²	103	135.1 Å²	135.1	85%	0.851	79%	0.794	S	S	*	*			trans	-59.6	125.2	177.7	0	0	0	0	0	111.1	K495	A493-K495 PolarHBondContact O-N 3.32Å
494	Q	21.9	Very low	24	Very low	200 Å²	200	135.9 Å²	135.9	94%	0.935	80%	0.798	S	S	*	*			trans	-65.6	120	170.3	-78.9	166.3	-75.5	0	0	109.8	K492	K492-Q494 PolarHBondContact O-N 2.94Å
495	K	22	Very low	24.4	Very low	209 Å²	209	138.8 Å²	138.8	91%	0.909	81%	0.806	S	S	*	*			trans	-104.5	124.5	159.5	-97.8	-176.4	174.9	-178.9	0	108.3	A493	A493-K495 PolarHBondContact O-N 3.32Å
496	S	20.5	Very low	24.5	Very low	105 Å²	105	140.2 Å²	140.2	73%	0.734	81%	0.813	S	S	*	*			trans	-67.2	134.1	175.8	55.6	0	0	0	0	111.8
497	L	25.4	Very low	24.5	Very low	175 Å²	175	140.1 Å²	140.1	92%	0.916	81%	0.811	S	S	*	*			trans	-134.5	128.3	152.7	-117.5	108.8	0	0	0	109.2
498	I	21.3	Very low	24.7	Very low	146 Å²	146	135.3 Å²	135.3	75%	0.749	80%	0.802	S	S	*	*			trans	-94.6	165.1	-179.5	-71.4	157.6	0	0	0	108.2
499	S	24.5	Very low	24.7	Very low	100 Å²	100	140.3 Å²	140.3	70%	0.699	82%	0.817	S	S	*	*			trans	92.8	134.4	171.6	71.8	0	0	0	0	114.5
500	D	27.1	Very low	24.9	Very low	153 Å²	153	142.7 Å²	142.7	82%	0.818	82%	0.82	S	S	*	*			cis	-155.6	159.7	12.3	-111.4	-24	0	0	0	110.6
501	P	25.9	Very low	25	Very low	121 Å²	121	143.4 Å²	143.4	79%	0.786	82%	0.82	S	S	*	*			trans	-99.5	145.4	178.5	36.7	-27.4	0	0	0	112.7
502	G	27.8	Very low	25.2	Very low	72 Å²	72	143.6 Å²	143.6	74%	0.742	82%	0.824	S	S	*	*			trans	147.4	101	159.8	0	0	0	0	0	115.3
503	C	28.2	Very low	25.2	Very low	141 Å²	141	139 Å²	139	95%	0.953	82%	0.815	S	S	*	*			trans	-172.4	124.3	135.8	-94.7	0	0	0	0	108.9
504	D	26.8	Very low	25.3	Very low	165 Å²	165	142 Å²	142	88%	0.882	82%	0.816	S	S	*	*			trans	-78	170.2	-177.2	-91.7	-31.2	0	0	0	113.3
505	P	33.7	Very low	25.4	Very low	117 Å²	117	137.1 Å²	137.1	76%	0.76	81%	0.805	S	S	*	*			trans	-99.2	149.9	-147.6	37	-32.9	0	0	0	114.4
506	V	28.3	Very low	25.6	Very low	146 Å²	146	135.8 Å²	135.8	89%	0.885	80%	0.801	S	S	*	*			trans	-118.6	124.1	162.6	-179.2	0	0	0	0	108.7
507	C	22.1	Very low	25.8	Very low	118 Å²	118	138.9 Å²	138.9	80%	0.797	81%	0.809	S	S	*	*			trans	-81.7	130.3	-177.4	-175.6	0	0	0	0	110.7
508	S	27.2	Very low	25.8	Very low	104 Å²	104	137.6 Å²	137.6	73%	0.727	80%	0.803	S	S	*	*			trans	-168.7	120.8	146.5	56.7	0	0	0	0	110.4	L510	S508-L510 PolarHBondContact O-N 3.02Å
509	D	24.1	Very low	25.9	Very low	160 Å²	160	135.5 Å²	135.5	86%	0.856	80%	0.801	S	S	*	*			trans	-27.8	113.2	172.7	-57.6	-51.6	0	0	0	115.9
510	L	26.4	Very low	26.1	Very low	155 Å²	155	136.7 Å²	136.7	81%	0.812	80%	0.804	S	S	*	*			trans	-145.3	116.5	162.9	-154.4	73.8	0	0	0	110.4	S508	S508-L510 PolarHBondContact O-N 3.02Å
511	D	25.4	Very low	26.2	Very low	133 Å²	133	138 Å²	138	71%	0.711	81%	0.806	S	S	*	*			trans	48.8	96.6	156	-61.2	-25.8	0	0	0	119.2	S513	D511-S513 VanDerWaalsContact C-N 3.26Å; D511-S513 PolarHBondContact O-N 3Å
512	Q	26.1	Very low	26.4	Very low	207 Å²	207	139.5 Å²	139.5	97%	0.967	81%	0.807	S	S	*	*			trans	-66.9	80.3	158.8	-68.3	178.9	6	0	0	110.4
513	S	22.5	Very low	26.9	Very low	90 Å²	90	140.9 Å²	140.9	63%	0.629	81%	0.805	S	S	*	*			trans	-138.5	74	163.2	68.8	0	0	0	0	110	D511	D511-S513 VanDerWaalsContact C-N 3.26Å; D511-S513 PolarHBondContact O-N 3Å
514	N	23.5	Very low	27.6	Very low	164 Å²	164	142.4 Å²	142.4	88%	0.877	80%	0.798	S	S	*	*			trans	-161.7	121.1	161.6	-95.2	-36.3	0	0	0	110.3
515	S	25	Very low	28.8	Very low	99 Å²	99	142.7 Å²	142.7	69%	0.692	79%	0.794	S	S	*	*			trans	137.2	71.4	138.8	78.4	0	0	0	0	113.7
516	H	27.1	Very low	29.7	Very low	181 Å²	181	141.6 Å²	141.6	84%	0.838	78%	0.782	S	S	*	*			trans	-135.4	80.7	136.1	-88.8	-65.5	0	0	0	107.9	N518	H516-N518 PolarHBondContact O-N 2.67Å
517	L	24.1	Very low	31.8	Very low	169 Å²	169	138.2 Å²	138.2	89%	0.885	76%	0.764	S	S	*	*			trans	-61.9	84.5	158.6	-74	162.6	0	0	0	107.2	S519	L517-S519 PolarHBondContact O-N 3.4Å
518	N	25.7	Very low	33.8	Very low	149 Å²	149	137.2 Å²	137.2	80%	0.797	75%	0.747	S	S	*	*			trans	-74.1	86.4	163.8	-89.1	-8.3	0	0	0	107.8	H516 T520	H516-N518 PolarHBondContact O-N 2.67Å; N518-T520 PolarHBondContact O-N 3.37Å
519	S	23.2	Very low	35.7	Very low	101 Å²	101	138.1 Å²	138.1	71%	0.706	74%	0.739	S	S	*	*			trans	-62.2	107.2	156	55	0	0	0	0	108.5	L517	L517-S519 PolarHBondContact O-N 3.4Å
520	T	27.4	Very low	38	Very low	125 Å²	125	131.9 Å²	131.9	77%	0.767	71%	0.71	S	S	*	*			trans	152.8	78.5	140.6	45.6	0	0	0	0	111.2	N518	N518-T520 PolarHBondContact O-N 3.37Å
521	E	31.1	Very low	40.2	Very low	182 Å²	182	127.5 Å²	127.5	85%	0.85	69%	0.685	S	S	*	*			trans	-124.6	65.9	145.7	-75.8	-168.2	178.9	0	0	107.5	S523	E521-S523 PolarHBondContact O-N 2.97Å
522	N	29.7	Very low	42.3	Very low	151 Å²	151	121.4 Å²	121.4	81%	0.807	65%	0.652	S	S	*	*			trans	-68.1	76.5	155.2	-84.9	-15.6	0	0	0	106.7	Q524	N522-Q524 PolarHBondContact O-N 3.07Å
523	S	38.2	Very low	44.6	Very low	102 Å²	102	114.5 Å²	114.5	71%	0.713	62%	0.622	S	S	*	*			trans	-63.2	96	159.9	22.7	0	0	0	0	105.3	E521 Q525	E521-S523 PolarHBondContact O-N 2.97Å; S523-Q525 VanDerWaalsContact C-N 3.32Å; S523-Q525 PolarHBondContact O-N 3.42Å
524	Q	43.1	Very low	47.1	Very low	173 Å²	173	114.4 Å²	114.4	81%	0.808	61%	0.611	S	S	*	*			trans	-58	101.4	174.4	-71.2	-179.6	-3.1	0	0	106.8	N522 L526	N522-Q524 PolarHBondContact O-N 3.07Å; Q524-L526 PolarHBondContact O-N 3.15Å
525	Q	50.7	Low	49.6	Very low	170 Å²	170	108.8 Å²	108.8	79%	0.794	58%	0.579	S	S	*	*			trans	-63.3	108.9	177.7	-150.8	164.3	3.6	0	0	106.5	S523	S523-Q525 VanDerWaalsContact C-N 3.32Å; S523-Q525 PolarHBondContact O-N 3.42Å
526	L	53.8	Low	51.9	Low	95 Å²	95	104.4 Å²	104.4	50%	0.497	55%	0.547	S	S	.	.			trans	-60.2	149.8	178.2	-74.1	175	0	0	0	108.4	Q524 A530 E531	Q524-L526 PolarHBondContact O-N 3.15Å; L526-A530 HydrophobicContact CB-CB 3.98Å; L526-A530 HydrophobicContact CD2-CB 4.15Å; L526-A530 HydrophobicContact CG-CB 4.46Å; L526-E531 HydrophobicContact CB-CG 3.77Å
527	S	71.7	Confident	54.1	Low	74 Å²	74	102.8 Å²	102.8	52%	0.517	53%	0.534	S	S	.	.			trans	-59.4	150	168.8	66	0	0	0	0	109.2	E529 A530 E531	S527-E529 PolarHBondContact O-N 2.78Å; S527-A530 WeakPolarHBondContact O-CA 3.33Å; S527-A530 WeakPolarHBondContact O-CB 3.42Å; S527-A530 PolarHBondContact O-N 2.65Å; S527-A530 WeakPolarHBondContact OG-CB 3.46Å; S527-A530 PolarHBondContact OG-N 3.26Å; S527-E531 PolarHBondContact O-N 3.46Å
528	K	63.3	Low	56.1	Low	98 Å²	98	98.7 Å²	98.7	43%	0.426	52%	0.52	S	S	.	.	H	α-helix	trans	-49.1	-38.6	176.2	-178	-177.6	174.5	-172.1	0	112.2	E174 L532	E174-K528 IonicContact OE1-NZ 3.71Å; K528-L532 WeakPolarHBondContact O-CB 3.41Å; K528-L532 PolarHBondContact O-N 3.42Å; K528-L532 VanDerWaalsContact O-N 3.08Å
529	E	66.8	Low	58	Low	123 Å²	123	96.5 Å²	96.5	58%	0.575	51%	0.505	S	S	*	.	H	α-helix	trans	-63.9	-40.7	176.3	-174	174.5	-171.9	0	0	112.2	S527 I533	S527-E529 PolarHBondContact O-N 2.78Å; E529-I533 HydrophobicContact CG-CD1 3.96Å; E529-I533 WeakPolarHBondContact O-CB 3.27Å; E529-I533 WeakPolarHBondContact O-CD1 3.28Å; E529-I533 WeakPolarHBondContact O-CG1 3.49Å; E529-I533 PolarHBondContact O-N 3.21Å
530	A	72.7	Confident	59.8	Low	28 Å²	28	95 Å²	95	23%	0.231	49%	0.486	C	S	.	.	H	α-helix	trans	-70.7	-40.6	177.4	0	0	0	0	0	112.7	L526 S527 L532 I533 E534	L526-A530 HydrophobicContact CB-CB 3.98Å; L526-A530 HydrophobicContact CD2-CB 4.15Å; L526-A530 HydrophobicContact CG-CB 4.46Å; S527-A530 WeakPolarHBondContact O-CA 3.33Å; S527-A530 WeakPolarHBondContact O-CB 3.42Å; S527-A530 PolarHBondContact O-N 2.65Å; S527-A530 WeakPolarHBondContact OG-CB 3.46Å; S527-A530 PolarHBondContact OG-N 3.26Å; A530-L532 VanDerWaalsContact C-N 3.3Å; A530-L532 PolarHBondContact O-N 2.85Å; A530-I533 PolarHBondContact O-N 3.29Å; A530-E534 WeakPolarHBondContact O-CB 3.41Å; A530-E534 PolarHBondContact O-N 3.07Å
531	E	73.7	Confident	61.3	Low	63 Å²	63	89.5 Å²	89.5	29%	0.294	45%	0.453	S	S	.	.	H	α-helix	trans	-59.1	-43.6	173.6	-67.1	-174.4	167.1	0	0	111.3	I98 L526 S527 E534 F535	I98-E531 HydrophobicContact CG2-CB 4.21Å; L526-E531 HydrophobicContact CB-CG 3.77Å; S527-E531 PolarHBondContact O-N 3.46Å; E531-E534 PolarHBondContact O-N 3.48Å; E531-F535 WeakPolarHBondContact O-CB 3.3Å; E531-F535 PolarHBondContact O-N 2.84Å
532	L	69.3	Low	62.5	Low	5 Å²	5	84.7 Å²	84.7	3%	0.026	45%	0.453	C	S	.	.	H	α-helix	trans	-68.4	-41.4	179.9	-169.8	62.7	0	0	0	112.4	I98 L171 E174 K528 A530 E534 F535 F536	I98-L532 HydrophobicContact CD1-CB 4.35Å; I98-L532 HydrophobicContact CD1-CD1 4.01Å; I98-L532 HydrophobicContact CG1-CD1 4.1Å; L171-L532 HydrophobicContact CB-CD1 4.3Å; L171-L532 HydrophobicContact CD1-CD1 4.33Å; L171-L532 HydrophobicContact CD2-CD1 3.81Å; L171-L532 HydrophobicContact CG-CD1 4.38Å; E174-L532 HydrophobicContact CB-CD2 4.03Å; E174-L532 VanDerWaalsContact OE2-CD2 3.22Å; E174-L532 WeakPolarHBondContact OE2-CD2 3.38Å; K528-L532 WeakPolarHBondContact O-CB 3.41Å; K528-L532 PolarHBondContact O-N 3.42Å; K528-L532 VanDerWaalsContact O-N 3.08Å; A530-L532 VanDerWaalsContact C-N 3.3Å; A530-L532 PolarHBondContact O-N 2.85Å; L532-E534 VanDerWaalsContact C-N 3.29Å; L532-E534 PolarHBondContact O-N 3.05Å; L532-F535 WeakPolarHBondContact O-CB 3.09Å; L532-F535 PolarHBondContact O-N 2.9Å; L532-F536 HydrophobicContact CD1-CD2 4.05Å; L532-F536 HydrophobicContact CD1-CE2 3.52Å; L532-F536 HydrophobicContact CG-CD2 4.08Å; L532-F536 HydrophobicContact CG-CE2 3.88Å; L532-F536 WeakPolarHBondContact O-CD2 3.46Å; L532-F536 PolarHBondContact O-N 3.43Å
533	I	74.3	Confident	63.8	Low	63 Å²	63	79.6 Å²	79.6	32%	0.323	42%	0.424	S	S	.	.	H	α-helix	trans	-60	-42.5	173.7	-72.8	165	0	0	0	110.4	E529 A530 F536 R537	E529-I533 HydrophobicContact CG-CD1 3.96Å; E529-I533 WeakPolarHBondContact O-CB 3.27Å; E529-I533 WeakPolarHBondContact O-CD1 3.28Å; E529-I533 WeakPolarHBondContact O-CG1 3.49Å; E529-I533 PolarHBondContact O-N 3.21Å; A530-I533 PolarHBondContact O-N 3.29Å; I533-F536 PolarHBondContact O-N 2.87Å; I533-R537 VanDerWaalsContact O-CB 3.25Å; I533-R537 WeakPolarHBondContact O-CB 3.5Å; I533-R537 PolarHBondContact O-N 3.39Å
534	E	73.8	Confident	64.9	Low	88 Å²	88	80 Å²	80	41%	0.411	41%	0.41	S	S	.	.	H	α-helix	trans	-70.9	-36.7	-179.7	-161.5	59.4	-157	0	0	112.2	A530 E531 L532 R537 S538	A530-E534 WeakPolarHBondContact O-CB 3.41Å; A530-E534 PolarHBondContact O-N 3.07Å; E531-E534 PolarHBondContact O-N 3.48Å; L532-E534 VanDerWaalsContact C-N 3.29Å; L532-E534 PolarHBondContact O-N 3.05Å; E534-R537 PolarHBondContact O-N 3.06Å; E534-R537 IonicContact OE2-CZ 2.66Å; E534-R537 IonicContact OE2-NH1 2.79Å; E534-R537 PolarHBondContact OE2-NH1 3.29Å; E534-S538 WeakPolarHBondContact O-CB 3.43Å; E534-S538 PolarHBondContact O-N 3.18Å; E534-S538 PolarHBondContact O-OG 3.26Å
535	F	76.1	Confident	66.1	Low	46 Å²	46	72.3 Å²	72.3	20%	0.202	38%	0.375	C	S	.	.	H	α-helix	trans	-56	-52.8	170	176.3	-91.4	0	0	0	110.9	L171 E531 L532 R537 S538 H539	L171-F535 HydrophobicContact CD1-CD1 4.37Å; L171-F535 HydrophobicContact CD1-CE1 4.05Å; L171-F535 HydrophobicContact CD1-CZ 4.28Å; E531-F535 WeakPolarHBondContact O-CB 3.3Å; E531-F535 PolarHBondContact O-N 2.84Å; L532-F535 WeakPolarHBondContact O-CB 3.09Å; L532-F535 PolarHBondContact O-N 2.9Å; F535-R537 VanDerWaalsContact C-N 3.34Å; F535-R537 PolarHBondContact O-N 2.88Å; F535-S538 PolarHBondContact O-N 3.16Å; F535-S538 PolarHBondContact O-OG 2.95Å; F535-H539 AromaticContact CD2-CE1 3.74Å; F535-H539 AromaticContact CE2-CE1 3.45Å; F535-H539 VanDerWaalsContact CE2-CE1 3.45Å; F535-H539 WeakPolarHBondContact CE2-CE1 3.38Å; F535-H539 AromaticContact CE2-ND1 3.95Å; F535-H539 AromaticContact CZ-CE1 3.85Å; F535-H539 PolarHBondContact O-N 3Å; F535-H539 PolarHBondContact O-ND1 2.77Å
536	F	75	Confident	67.2	Low	6 Å²	6	64.2 Å²	64.2	3%	0.026	34%	0.338	C	S	.	.	H	α-helix	trans	-70.2	-30.2	179.7	-76	-66.9	0	0	0	113.5	L171 W172 E175 R178 L532 I533 Q540	L171-F536 HydrophobicContact CB-CE2 4.23Å; L171-F536 HydrophobicContact CB-CZ 3.8Å; L171-F536 VanDerWaalsContact O-CZ 3.31Å; L171-F536 WeakPolarHBondContact O-CZ 3.31Å; W172-F536 AromaticContact CD2-CE1 3.85Å; W172-F536 HydrophobicContact CD2-CE1 3.85Å; W172-F536 HydrophobicContact CD2-CZ 4.4Å; W172-F536 AromaticContact CE2-CE1 3.97Å; W172-F536 HydrophobicContact CE3-CD1 4.42Å; W172-F536 AromaticContact CE3-CE1 3.66Å; W172-F536 HydrophobicContact CE3-CE1 3.66Å; W172-F536 HydrophobicContact CE3-CZ 4.38Å; W172-F536 HydrophobicContact CH2-CD1 4Å; W172-F536 AromaticContact CH2-CE1 3.74Å; W172-F536 HydrophobicContact CH2-CE1 3.74Å; W172-F536 AromaticContact CZ2-CE1 3.93Å; W172-F536 HydrophobicContact CZ2-CE1 3.93Å; W172-F536 AromaticContact CZ3-CD1 3.95Å; W172-F536 HydrophobicContact CZ3-CD1 3.95Å; W172-F536 AromaticContact CZ3-CE1 3.61Å; W172-F536 HydrophobicContact CZ3-CE1 3.61Å; E175-F536 HydrophobicContact CB-CD1 4.49Å; E175-F536 HydrophobicContact CB-CD2 3.99Å; E175-F536 HydrophobicContact CB-CE1 4.14Å; E175-F536 HydrophobicContact CB-CE2 3.6Å; E175-F536 HydrophobicContact CB-CG 4.43Å; E175-F536 HydrophobicContact CB-CZ 3.69Å; E175-F536 HydrophobicContact CG-CD1 4.16Å; E175-F536 HydrophobicContact CG-CD2 4.08Å; E175-F536 HydrophobicContact CG-CE1 4.24Å; E175-F536 HydrophobicContact CG-CE2 4.17Å; E175-F536 HydrophobicContact CG-CG 4.09Å; E175-F536 HydrophobicContact CG-CZ 4.25Å; E175-F536 WeakPolarHBondContact OE2-CD2 3.24Å; R178-F536 VanDerWaalsContact NH2-CE2 3.33Å; L532-F536 HydrophobicContact CD1-CD2 4.05Å; L532-F536 HydrophobicContact CD1-CE2 3.52Å; L532-F536 HydrophobicContact CG-CD2 4.08Å; L532-F536 HydrophobicContact CG-CE2 3.88Å; L532-F536 WeakPolarHBondContact O-CD2 3.46Å; L532-F536 PolarHBondContact O-N 3.43Å; I533-F536 PolarHBondContact O-N 2.87Å; F536-Q540 WeakPolarHBondContact O-CB 3.48Å; F536-Q540 PolarHBondContact O-N 3.11Å; F536-Q540 VanDerWaalsContact O-N 3.11Å
537	R	72.9	Confident	68.2	Low	147 Å²	147	60.6 Å²	60.6	56%	0.555	32%	0.32	S	S	*	.	H	α-helix	trans	-66.5	-42.3	175.6	-176	-177.7	-71.8	150.8	-6.2	111.6	I533 E534 F535 H539 Q540	I533-R537 VanDerWaalsContact O-CB 3.25Å; I533-R537 WeakPolarHBondContact O-CB 3.5Å; I533-R537 PolarHBondContact O-N 3.39Å; E534-R537 PolarHBondContact O-N 3.06Å; E534-R537 IonicContact OE2-CZ 2.66Å; E534-R537 IonicContact OE2-NH1 2.79Å; E534-R537 PolarHBondContact OE2-NH1 3.29Å; F535-R537 VanDerWaalsContact C-N 3.34Å; F535-R537 PolarHBondContact O-N 2.88Å; R537-H539 VanDerWaalsContact C-N 3.32Å; R537-Q540 WeakPolarHBondContact O-CB 3.39Å; R537-Q540 PolarHBondContact O-N 3.1Å
538	S	64.6	Low	68	Low	84 Å²	84	58.4 Å²	58.4	59%	0.587	30%	0.302	S	S	*	.	H	α-helix	trans	-69.5	-28.1	178.1	55	0	0	0	0	113.3	E534 F535	E534-S538 WeakPolarHBondContact O-CB 3.43Å; E534-S538 PolarHBondContact O-N 3.18Å; E534-S538 PolarHBondContact O-OG 3.26Å; F535-S538 PolarHBondContact O-N 3.16Å; F535-S538 PolarHBondContact O-OG 2.95Å
539	H	65.8	Low	67.9	Low	103 Å²	103	58.4 Å²	58.4	48%	0.477	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	2.5	174.9	-65.8	78.2	0	0	0	113.4	F535 R537 A541	F535-H539 AromaticContact CD2-CE1 3.74Å; F535-H539 AromaticContact CE2-CE1 3.45Å; F535-H539 VanDerWaalsContact CE2-CE1 3.45Å; F535-H539 WeakPolarHBondContact CE2-CE1 3.38Å; F535-H539 AromaticContact CE2-ND1 3.95Å; F535-H539 AromaticContact CZ-CE1 3.85Å; F535-H539 PolarHBondContact O-N 3Å; F535-H539 PolarHBondContact O-ND1 2.77Å; R537-H539 VanDerWaalsContact C-N 3.32Å; H539-A541 PolarHBondContact O-N 3.32Å
540	Q	62.5	Low	67.4	Low	68 Å²	68	55 Å²	55	32%	0.318	31%	0.313	S	S	.	.			trans	-78.5	124.1	-176.5	-151.7	-169	-68.8	0	0	110.6	F536 R537 R544	F536-Q540 WeakPolarHBondContact O-CB 3.48Å; F536-Q540 PolarHBondContact O-N 3.11Å; F536-Q540 VanDerWaalsContact O-N 3.11Å; R537-Q540 WeakPolarHBondContact O-CB 3.39Å; R537-Q540 PolarHBondContact O-N 3.1Å; Q540-R544 VanDerWaalsContact OE1-NH2 3.11Å
541	A	57.8	Low	66.8	Low	10 Å²	10	54.4 Å²	54.4	8%	0.083	31%	0.306	C	S	.	.			trans	-69.3	155.1	163.1	0	0	0	0	0	110.6	H539 H543	H539-A541 PolarHBondContact O-N 3.32Å; A541-H543 PolarHBondContact O-N 3.19Å
542	G	56.7	Low	65.9	Low	81 Å²	81	61 Å²	61	84%	0.835	34%	0.336	S	S	*	.	S	Bend	trans	-64.2	-31.2	176	0	0	0	0	0	112.1
543	H	57.4	Low	65.4	Low	45 Å²	45	62.9 Å²	62.9	21%	0.208	36%	0.358	C	S	.	.			trans	-107.5	152.1	-177.3	-168.2	-83.7	0	0	0	113	A541 S545 A550 L551	A541-H543 PolarHBondContact O-N 3.19Å; H543-S545 VanDerWaalsContact CE1-CA 3.5Å; H543-S545 WeakPolarHBondContact CE1-CA 3.49Å; H543-S545 WeakPolarHBondContact CE1-CB 3.47Å; H543-S545 PolarHBondContact CE1-N 2.92Å; H543-S545 PolarHBondContact CE1-O 3.49Å; H543-S545 PolarHBondContact ND1-N 3.41Å; H543-A550 PolarHBondContact NE2-O 3.4Å; H543-L551 WeakPolarHBondContact CE1-CD2 3.43Å; H543-L551 VanDerWaalsContact ND1-CD2 3.31Å; H543-L551 WeakPolarHBondContact ND1-CD2 3.32Å; H543-L551 VanDerWaalsContact NE2-CD2 3.3Å; H543-L551 WeakPolarHBondContact NE2-CD2 3.46Å
544	R	61.5	Low	64.5	Low	111 Å²	111	64.2 Å²	64.2	42%	0.419	38%	0.378	S	S	.	.			trans	-148.7	35.8	-172.6	-54.7	-173	-173.6	-173.2	8.9	113.4	Q540	Q540-R544 VanDerWaalsContact OE1-NH2 3.11Å
545	S	68	Low	63.9	Low	10 Å²	10	62.6 Å²	62.6	7%	0.07	37%	0.372	C	S	.	.			trans	-128.8	118.7	177.4	167.7	0	0	0	0	111.1	E242 S302 H543 S547 A550	E242-S545 WeakPolarHBondContact OE2-CA 3.31Å; E242-S545 PolarHBondContact OE2-N 2.95Å; S302-S545 WeakPolarHBondContact CB-OG 3.34Å; S302-S545 WeakPolarHBondContact OG-CB 3.34Å; S302-S545 PolarHBondContact OG-OG 3.2Å; H543-S545 VanDerWaalsContact CE1-CA 3.5Å; H543-S545 WeakPolarHBondContact CE1-CA 3.49Å; H543-S545 WeakPolarHBondContact CE1-CB 3.47Å; H543-S545 PolarHBondContact CE1-N 2.92Å; H543-S545 PolarHBondContact CE1-O 3.49Å; H543-S545 PolarHBondContact ND1-N 3.41Å; S545-S547 PolarHBondContact O-N 3.12Å; S545-S547 VanDerWaalsContact O-N 3.12Å; S545-S547 PolarHBondContact OG-N 3.33Å; S545-S547 PolarHBondContact OG-O 2.95Å; S545-A550 VanDerWaalsContact CB-CB 3.43Å; S545-A550 WeakPolarHBondContact OG-CB 3.43Å
546	S	73.7	Confident	63.8	Low	1 Å²	1	61.3 Å²	61.3	1%	0.007	37%	0.368	C	S	.	.	S	Bend	trans	-68.5	1.3	171.5	-55.7	0	0	0	0	114.4	F241 E242	F241-S546 WeakPolarHBondContact CE1-OG 3.46Å; E242-S546 WeakPolarHBondContact OE1-CB 3.43Å; E242-S546 PolarHBondContact OE1-N 3.15Å; E242-S546 PolarHBondContact OE1-OG 3.3Å; E242-S546 PolarHBondContact OE2-N 2.93Å
547	S	74.2	Confident	64.1	Low	18 Å²	18	64.7 Å²	64.7	13%	0.126	39%	0.389	C	S	.	.	S	Bend	trans	-104.1	137.4	176.1	-178.8	0	0	0	0	112.5	D305 S545 A549 A550 L551	D305-S547 PolarHBondContact OD1-OG 2.92Å; D305-S547 VanDerWaalsContact OD2-CA 3.32Å; D305-S547 WeakPolarHBondContact OD2-CA 3.39Å; D305-S547 PolarHBondContact OD2-OG 2.9Å; S545-S547 PolarHBondContact O-N 3.12Å; S545-S547 VanDerWaalsContact O-N 3.12Å; S545-S547 PolarHBondContact OG-N 3.33Å; S545-S547 PolarHBondContact OG-O 2.95Å; S547-A549 PolarHBondContact O-N 3.34Å; S547-A549 PolarHBondContact OG-N 3.42Å; S547-A550 PolarHBondContact O-N 3Å; S547-A550 VanDerWaalsContact O-N 3.14Å; S547-L551 WeakPolarHBondContact O-CD1 3.37Å
548	I	68	Low	64.8	Low	29 Å²	29	58.7 Å²	58.7	15%	0.149	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-57.6	-37	175	-66.9	164.3	0	0	0	111.7	D305 A550 L551 Q629 K632 L633	D305-I548 WeakPolarHBondContact OD2-CB 3.47Å; D305-I548 WeakPolarHBondContact OD2-CG1 3.36Å; D305-I548 PolarHBondContact OD2-N 3.05Å; I548-A550 PolarHBondContact O-N 2.76Å; I548-L551 PolarHBondContact O-N 3.49Å; I548-Q629 HydrophobicContact CD1-CB 3.34Å; I548-Q629 HydrophobicContact CD1-CG 3.39Å; I548-K632 HydrophobicContact CG2-CB 4.39Å; I548-L633 HydrophobicContact CD1-CD1 3.85Å; I548-L633 HydrophobicContact CD1-CG 4.15Å; I548-L633 HydrophobicContact CG1-CD1 3.68Å; I548-L633 HydrophobicContact CG1-CD2 3.86Å; I548-L633 HydrophobicContact CG1-CG 3.77Å
549	A	61.3	Low	66	Low	98 Å²	98	54.7 Å²	54.7	81%	0.81	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-60.4	-18.7	179.9	0	0	0	0	0	113.4	S547	S547-A549 PolarHBondContact O-N 3.34Å; S547-A549 PolarHBondContact OG-N 3.42Å
550	A	56.1	Low	67.3	Low	51 Å²	51	49.8 Å²	49.8	42%	0.421	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-97.8	1.6	-179.4	0	0	0	0	0	114.1	H543 S545 S547 I548	H543-A550 PolarHBondContact NE2-O 3.4Å; S545-A550 VanDerWaalsContact CB-CB 3.43Å; S545-A550 WeakPolarHBondContact OG-CB 3.43Å; S547-A550 PolarHBondContact O-N 3Å; S547-A550 VanDerWaalsContact O-N 3.14Å; I548-A550 PolarHBondContact O-N 2.76Å
551	L	60.6	Low	68.7	Low	15 Å²	15	49 Å²	49	8%	0.079	32%	0.315	C	S	.	.			trans	-115.1	132.9	-160.3	-76.5	163.2	0	0	0	114.5	H543 S547 I548 T556 L559 L633	H543-L551 WeakPolarHBondContact CE1-CD2 3.43Å; H543-L551 VanDerWaalsContact ND1-CD2 3.31Å; H543-L551 WeakPolarHBondContact ND1-CD2 3.32Å; H543-L551 VanDerWaalsContact NE2-CD2 3.3Å; H543-L551 WeakPolarHBondContact NE2-CD2 3.46Å; S547-L551 WeakPolarHBondContact O-CD1 3.37Å; I548-L551 PolarHBondContact O-N 3.49Å; L551-T556 HydrophobicContact CB-CG2 3.73Å; L551-T556 HydrophobicContact CD1-CG2 4.05Å; L551-T556 HydrophobicContact CD2-CG2 3.59Å; L551-T556 HydrophobicContact CG-CG2 3.99Å; L551-L559 HydrophobicContact CD1-CD1 3.36Å; L551-L633 HydrophobicContact CD1-CD2 3.59Å
552	H	54.8	Low	70.5	Confident	201 Å²	201	48.5 Å²	48.5	93%	0.931	31%	0.311	S	S	*	.			trans	-151.4	93.1	154.8	-63.6	96.3	0	0	0	107.8
553	G	57.5	Low	72.4	Confident	46 Å²	46	44.7 Å²	44.7	47%	0.474	27%	0.271	S	S	.	.	S	Bend	trans	174.7	171.4	179.1	0	0	0	0	0	115	D555 T556	G553-D555 VanDerWaalsContact C-N 3.27Å; G553-D555 PolarHBondContact O-N 3.43Å; G553-T556 WeakPolarHBondContact O-CB 3.17Å; G553-T556 WeakPolarHBondContact O-CG2 3.47Å; G553-T556 PolarHBondContact O-N 3.4Å; G553-T556 PolarHBondContact O-OG1 3.31Å
554	A	56.8	Low	74.2	Confident	91 Å²	91	43.5 Å²	43.5	75%	0.752	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-66.4	-20.7	-174.6	0	0	0	0	0	115	T556 V557	A554-T556 PolarHBondContact O-N 3.13Å; A554-V557 WeakPolarHBondContact O-CG2 3.46Å
555	D	59.5	Low	75.9	Confident	54 Å²	54	38.3 Å²	38.3	29%	0.289	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-74.3	-3.6	178.6	-66.5	-33.7	0	0	0	113	G553 V557	G553-D555 VanDerWaalsContact C-N 3.27Å; G553-D555 PolarHBondContact O-N 3.43Å; D555-V557 VanDerWaalsContact C-N 3.29Å; D555-V557 PolarHBondContact O-N 2.62Å
556	T	74.9	Confident	77.2	Confident	18 Å²	18	37.9 Å²	37.9	11%	0.11	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-70.4	-22.8	177.9	56.3	0	0	0	0	113.9	L551 G553 A554 I558 L559 G560 L633	L551-T556 HydrophobicContact CB-CG2 3.73Å; L551-T556 HydrophobicContact CD1-CG2 4.05Å; L551-T556 HydrophobicContact CD2-CG2 3.59Å; L551-T556 HydrophobicContact CG-CG2 3.99Å; G553-T556 WeakPolarHBondContact O-CB 3.17Å; G553-T556 WeakPolarHBondContact O-CG2 3.47Å; G553-T556 PolarHBondContact O-N 3.4Å; G553-T556 PolarHBondContact O-OG1 3.31Å; A554-T556 PolarHBondContact O-N 3.13Å; T556-I558 PolarHBondContact O-N 3.35Å; T556-L559 WeakPolarHBondContact O-CB 3.46Å; T556-L559 PolarHBondContact O-N 3.43Å; T556-G560 PolarHBondContact O-N 3.25Å; T556-L633 HydrophobicContact CG2-CD2 3.85Å; T556-L633 PolarHBondContact OG1-O 3.38Å
557	V	81.2	Confident	78.3	Confident	78 Å²	78	37.8 Å²	37.8	47%	0.473	24%	0.243	S	C	.	.	H	α-helix	trans	-58	-40.3	-168.6	176.7	0	0	0	0	110.8	A554 D555 L559 G560 L561	A554-V557 WeakPolarHBondContact O-CG2 3.46Å; D555-V557 VanDerWaalsContact C-N 3.29Å; D555-V557 PolarHBondContact O-N 2.62Å; V557-L559 PolarHBondContact O-N 3.12Å; V557-G560 PolarHBondContact O-N 2.96Å; V557-L561 HydrophobicContact CG1-CD1 4.28Å; V557-L561 HydrophobicContact CG1-CG 4.49Å; V557-L561 WeakPolarHBondContact O-CG 3.48Å; V557-L561 PolarHBondContact O-N 3.22Å
558	I	88	Confident	79.3	Confident	20 Å²	20	40.3 Å²	40.3	10%	0.103	25%	0.249	C	C	.	.	H	α-helix	trans	-64.8	-42.2	-179.9	-60.3	170.6	0	0	0	111.3	H246 R247 F268 I280 M283 T556 G560 L561 I562	H246-I558 HydrophobicContact CB-CB 4.14Å; H246-I558 HydrophobicContact CB-CD1 4.34Å; H246-I558 HydrophobicContact CB-CG2 3.97Å; H246-I558 WeakPolarHBondContact O-CG2 3.37Å; R247-I558 HydrophobicContact CG-CD1 4.25Å; F268-I558 HydrophobicContact CB-CD1 3.72Å; F268-I558 HydrophobicContact CB-CG1 3.93Å; F268-I558 HydrophobicContact CB-CG2 4.05Å; F268-I558 HydrophobicContact CD1-CD1 4.23Å; F268-I558 HydrophobicContact CD2-CD1 4.25Å; F268-I558 HydrophobicContact CD2-CG1 4.3Å; F268-I558 HydrophobicContact CG-CD1 3.79Å; F268-I558 HydrophobicContact CG-CG1 4.19Å; I280-I558 HydrophobicContact CD1-CG2 3.82Å; M283-I558 HydrophobicContact SD-CG2 4.43Å; T556-I558 PolarHBondContact O-N 3.35Å; I558-G560 VanDerWaalsContact C-N 3.3Å; I558-G560 PolarHBondContact O-N 3.26Å; I558-L561 PolarHBondContact O-N 2.91Å; I558-I562 HydrophobicContact CG2-CD1 4.1Å; I558-I562 WeakPolarHBondContact O-CG1 3.3Å; I558-I562 PolarHBondContact O-N 2.84Å
559	L	90.5	Very high	80.4	Confident	1 Å²	1	39 Å²	39	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-64	-39.1	175.7	-68.9	170.4	0	0	0	111.2	F241 H246 F304 L551 T556 V557 L561 I562 H563 L633	F241-L559 HydrophobicContact CE1-CD2 3.83Å; F241-L559 HydrophobicContact CZ-CD2 3.79Å; H246-L559 VanDerWaalsContact CE1-CD1 3.46Å; H246-L559 WeakPolarHBondContact CE1-CD1 3.35Å; F304-L559 HydrophobicContact CD2-CD2 4.44Å; F304-L559 HydrophobicContact CE2-CD2 4.23Å; L551-L559 HydrophobicContact CD1-CD1 3.36Å; T556-L559 WeakPolarHBondContact O-CB 3.46Å; T556-L559 PolarHBondContact O-N 3.43Å; V557-L559 PolarHBondContact O-N 3.12Å; L559-L561 VanDerWaalsContact C-N 3.3Å; L559-L561 PolarHBondContact O-N 2.97Å; L559-I562 PolarHBondContact O-N 3.47Å; L559-H563 PolarHBondContact O-CD2 3.04Å; L559-H563 PolarHBondContact O-N 3.33Å; L559-L633 HydrophobicContact CB-CD1 3.75Å; L559-L633 HydrophobicContact CB-CD2 4.42Å
560	G	91.6	Very high	81.8	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.4	-43.3	175	0	0	0	0	0	111.6	T556 V557 I558 H563 H564 S630	T556-G560 PolarHBondContact O-N 3.25Å; V557-G560 PolarHBondContact O-N 2.96Å; I558-G560 VanDerWaalsContact C-N 3.3Å; I558-G560 PolarHBondContact O-N 3.26Å; G560-H563 PolarHBondContact O-N 3.29Å; G560-H564 PolarHBondContact O-N 2.8Å; G560-S630 WeakPolarHBondContact O-CB 3.35Å; G560-S630 PolarHBondContact O-OG 3.02Å
561	L	93.3	Very high	83.5	Confident	50 Å²	50	32.9 Å²	32.9	26%	0.262	19%	0.191	S	C	.	.	H	α-helix	trans	-66	-39.5	176.4	-67.3	173.5	0	0	0	112.5	I280 V557 I558 L559 H564 E565	I280-L561 HydrophobicContact CD1-CB 4.09Å; I280-L561 HydrophobicContact CD1-CD1 4.36Å; I280-L561 HydrophobicContact CG1-CB 4.2Å; I280-L561 HydrophobicContact CG1-CD1 4.43Å; I280-L561 HydrophobicContact CG2-CB 3.97Å; I280-L561 WeakPolarHBondContact CG2-O 3.17Å; V557-L561 HydrophobicContact CG1-CD1 4.28Å; V557-L561 HydrophobicContact CG1-CG 4.49Å; V557-L561 WeakPolarHBondContact O-CG 3.48Å; V557-L561 PolarHBondContact O-N 3.22Å; I558-L561 PolarHBondContact O-N 2.91Å; L559-L561 VanDerWaalsContact C-N 3.3Å; L559-L561 PolarHBondContact O-N 2.97Å; L561-H564 PolarHBondContact O-N 3.49Å; L561-E565 WeakPolarHBondContact O-CB 3.48Å; L561-E565 PolarHBondContact O-N 3.33Å
562	I	95.3	Very high	84.8	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-46.3	176.4	-67.6	166.8	0	0	0	110.5	F241 I280 M283 A284 F287 F304 I558 L559 E565 L566	F241-I562 HydrophobicContact CE2-CD1 3.61Å; F241-I562 HydrophobicContact CZ-CD1 3.45Å; F241-I562 VanDerWaalsContact CZ-CD1 3.45Å; I280-I562 HydrophobicContact CD1-CG1 4.34Å; I280-I562 HydrophobicContact CG2-CG1 4.09Å; M283-I562 HydrophobicContact CB-CD1 3.84Å; M283-I562 HydrophobicContact CB-CG1 3.98Å; M283-I562 HydrophobicContact SD-CD1 4.12Å; A284-I562 HydrophobicContact CB-CG2 4.13Å; F287-I562 HydrophobicContact CD2-CG2 4.39Å; F304-I562 HydrophobicContact CE2-CB 4.47Å; F304-I562 HydrophobicContact CE2-CG2 3.8Å; F304-I562 HydrophobicContact CZ-CB 4.49Å; F304-I562 HydrophobicContact CZ-CG2 3.61Å; I558-I562 HydrophobicContact CG2-CD1 4.1Å; I558-I562 WeakPolarHBondContact O-CG1 3.3Å; I558-I562 PolarHBondContact O-N 2.84Å; L559-I562 PolarHBondContact O-N 3.47Å; I562-E565 PolarHBondContact O-N 3.26Å; I562-L566 HydrophobicContact CG2-CD1 4.41Å; I562-L566 WeakPolarHBondContact O-CG 3.2Å; I562-L566 PolarHBondContact O-N 2.92Å
563	H	96.4	Very high	86.1	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-62.5	-42.4	174.8	-81.9	-55.9	0	0	0	112.6	F304 D305 L559 G560 E565 L566 A567 H626 Q629	F304-H563 AromaticContact CE1-CE1 3.36Å; F304-H563 WeakPolarHBondContact CE1-CE1 3.36Å; F304-H563 AromaticContact CE1-ND1 3.85Å; F304-H563 AromaticContact CE2-CE1 3.98Å; F304-H563 AromaticContact CE2-NE2 3.87Å; F304-H563 AromaticContact CZ-CE1 3.21Å; F304-H563 WeakPolarHBondContact CZ-CE1 3.43Å; F304-H563 AromaticContact CZ-ND1 3.58Å; F304-H563 AromaticContact CZ-NE2 3.54Å; D305-H563 PolarHBondContact O-CE1 3.12Å; L559-H563 PolarHBondContact O-CD2 3.04Å; L559-H563 PolarHBondContact O-N 3.33Å; G560-H563 PolarHBondContact O-N 3.29Å; H563-E565 VanDerWaalsContact C-N 3.28Å; H563-E565 PolarHBondContact O-N 2.57Å; H563-L566 PolarHBondContact O-N 3.29Å; H563-A567 PolarHBondContact O-N 2.73Å; H563-H626 WeakPolarHBondContact CB-O 3.43Å; H563-H626 AromaticContact CE1-ND1 3.73Å; H563-H626 AromaticContact ND1-CE1 3.71Å; H563-H626 AromaticContact ND1-CG 3.99Å; H563-H626 AromaticContact ND1-ND1 3.01Å; H563-H626 PolarHBondContact ND1-ND1 3.09Å; H563-H626 WeakPolarHBondContact O-CB 3.21Å; H563-Q629 HydrophobicContact CB-CB 4.35Å
564	H	95.6	Very high	87.3	Confident	21 Å²	21	28.1 Å²	28.1	10%	0.097	16%	0.155	C	C	.	.	H	α-helix	trans	-59.4	-42.5	176	-168.2	81.1	0	0	0	111.5	G560 L561 A567 R568 S630	G560-H564 PolarHBondContact O-N 2.8Å; L561-H564 PolarHBondContact O-N 3.49Å; H564-A567 WeakPolarHBondContact O-CB 3.35Å; H564-A567 PolarHBondContact O-N 3.47Å; H564-R568 PolarHBondContact O-N 2.98Å; H564-S630 WeakPolarHBondContact CB-OG 3.44Å
565	E	96.7	Very high	88.5	Confident	2 Å²	2	24.1 Å²	24.1	1%	0.009	12%	0.121	C	C	.	.	H	α-helix	trans	-69.2	-36.5	179.1	-178.2	58.9	-175.3	0	0	112.4	I280 R281 A284 Y356 L561 I562 H563 R568 L569	I280-E565 HydrophobicContact CG2-CB 3.89Å; I280-E565 HydrophobicContact CG2-CG 4.31Å; R281-E565 HydrophobicContact CB-CG 4.05Å; R281-E565 WeakPolarHBondContact CB-OE1 3.14Å; R281-E565 WeakPolarHBondContact CG-OE1 3.45Å; R281-E565 IonicContact CZ-OE1 3.53Å; R281-E565 IonicContact NE-OE1 2.63Å; R281-E565 PolarHBondContact NE-OE1 3.09Å; R281-E565 IonicContact NH2-OE1 3.7Å; A284-E565 HydrophobicContact CB-CB 4.2Å; A284-E565 HydrophobicContact CB-CG 3.94Å; Y356-E565 PolarHBondContact OH-OE2 3.07Å; Y356-E565 VanDerWaalsContact OH-OE2 3.07Å; L561-E565 WeakPolarHBondContact O-CB 3.48Å; L561-E565 PolarHBondContact O-N 3.33Å; I562-E565 PolarHBondContact O-N 3.26Å; H563-E565 VanDerWaalsContact C-N 3.28Å; H563-E565 PolarHBondContact O-N 2.57Å; E565-R568 PolarHBondContact O-N 3.3Å; E565-R568 IonicContact OE1-CZ 3.65Å; E565-R568 IonicContact OE1-NE 2.74Å; E565-R568 IonicContact OE1-NH2 3.35Å; E565-R568 PolarHBondContact OE1-NH2 3.49Å; E565-R568 IonicContact OE2-CZ 3.63Å; E565-R568 IonicContact OE2-NE 3.2Å; E565-R568 PolarHBondContact OE2-NE 3.27Å; E565-R568 IonicContact OE2-NH2 3.73Å; E565-R568 PolarHBondContact OE2-NH2 3.46Å; E565-R568 VanDerWaalsContact OE2-NH2 3.15Å; E565-L569 HydrophobicContact CG-CD1 4.46Å; E565-L569 WeakPolarHBondContact O-CB 3.45Å; E565-L569 VanDerWaalsContact O-CG 3.27Å; E565-L569 WeakPolarHBondContact O-CG 3.38Å; E565-L569 PolarHBondContact O-N 3.04Å
566	L	95.7	Very high	88.9	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.5	-45.2	169.9	-76	171.8	0	0	0	111.8	A284 Y288 F304 I562 H563 R568 L569 H570 H626	A284-L566 HydrophobicContact CB-CD2 3.94Å; A284-L566 HydrophobicContact CB-CG 3.87Å; A284-L566 WeakPolarHBondContact O-CD2 3.49Å; Y288-L566 HydrophobicContact CD2-CD2 4.3Å; Y288-L566 HydrophobicContact CG-CD2 4.48Å; F304-L566 HydrophobicContact CE1-CD1 3.52Å; F304-L566 HydrophobicContact CZ-CD1 3.81Å; I562-L566 HydrophobicContact CG2-CD1 4.41Å; I562-L566 WeakPolarHBondContact O-CG 3.2Å; I562-L566 PolarHBondContact O-N 2.92Å; H563-L566 PolarHBondContact O-N 3.29Å; L566-R568 VanDerWaalsContact C-N 3.3Å; L566-R568 PolarHBondContact O-N 3.38Å; L566-L569 PolarHBondContact O-N 3.28Å; L566-H570 PolarHBondContact O-CD2 3.02Å; L566-H570 PolarHBondContact O-N 3.21Å; L566-H626 HydrophobicContact CB-CB 4.47Å
567	A	96.2	Very high	88	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-59	-43.3	175.4	0	0	0	0	0	111.5	H563 H564 L569 H570 A571 V623 H626 L627 P654	H563-A567 PolarHBondContact O-N 2.73Å; H564-A567 WeakPolarHBondContact O-CB 3.35Å; H564-A567 PolarHBondContact O-N 3.47Å; A567-L569 PolarHBondContact O-N 3.27Å; A567-H570 PolarHBondContact O-N 2.79Å; A567-A571 VanDerWaalsContact O-CB 3.3Å; A567-A571 WeakPolarHBondContact O-CB 3.47Å; A567-A571 PolarHBondContact O-N 2.97Å; A567-V623 HydrophobicContact CB-CG1 4.29Å; A567-H626 HydrophobicContact CB-CB 3.92Å; A567-L627 HydrophobicContact CB-CD2 4.05Å; A567-L627 HydrophobicContact CB-CG 3.73Å; A567-P654 HydrophobicContact CB-CB 4.38Å; A567-P654 HydrophobicContact CB-CG 4.42Å
568	R	94.4	Very high	86.7	Confident	71 Å²	71	21 Å²	21	27%	0.268	10%	0.101	S	C	.	.	H	α-helix	trans	-64.8	-38	177	-157.9	-167.4	60.8	55.2	20.7	112.4	R281 H564 E565 L566 S572 P654	R281-R568 VanDerWaalsContact CZ-NH2 3.31Å; H564-R568 PolarHBondContact O-N 2.98Å; E565-R568 PolarHBondContact O-N 3.3Å; E565-R568 IonicContact OE1-CZ 3.65Å; E565-R568 IonicContact OE1-NE 2.74Å; E565-R568 IonicContact OE1-NH2 3.35Å; E565-R568 PolarHBondContact OE1-NH2 3.49Å; E565-R568 IonicContact OE2-CZ 3.63Å; E565-R568 IonicContact OE2-NE 3.2Å; E565-R568 PolarHBondContact OE2-NE 3.27Å; E565-R568 IonicContact OE2-NH2 3.73Å; E565-R568 PolarHBondContact OE2-NH2 3.46Å; E565-R568 VanDerWaalsContact OE2-NH2 3.15Å; L566-R568 VanDerWaalsContact C-N 3.3Å; L566-R568 PolarHBondContact O-N 3.38Å; R568-S572 WeakPolarHBondContact O-CB 3.48Å; R568-S572 PolarHBondContact O-N 2.91Å; R568-S572 VanDerWaalsContact O-N 3.1Å; R568-S572 PolarHBondContact O-OG 3.24Å; R568-P654 HydrophobicContact CB-CG 4.22Å; R568-P654 HydrophobicContact CG-CG 4.46Å
569	L	92	Very high	84.8	Confident	2 Å²	2	22 Å²	22	1%	0.01	11%	0.105	C	C	.	.	H	α-helix	trans	-66.5	-44.5	175.7	-73.1	170.3	0	0	0	111.7	A284 L285 E565 L566 A567 S572 L575	A284-L569 HydrophobicContact CB-CD1 4.29Å; L285-L569 HydrophobicContact CD2-CD1 3.92Å; L285-L569 HydrophobicContact CG-CD1 4.25Å; E565-L569 HydrophobicContact CG-CD1 4.46Å; E565-L569 WeakPolarHBondContact O-CB 3.45Å; E565-L569 VanDerWaalsContact O-CG 3.27Å; E565-L569 WeakPolarHBondContact O-CG 3.38Å; E565-L569 PolarHBondContact O-N 3.04Å; L566-L569 PolarHBondContact O-N 3.28Å; A567-L569 PolarHBondContact O-N 3.27Å; L569-S572 PolarHBondContact O-N 3.32Å; L569-S572 PolarHBondContact O-OG 3.44Å; L569-L575 HydrophobicContact CB-CD1 3.63Å; L569-L575 HydrophobicContact CB-CG 3.97Å
570	H	91.7	Very high	82.6	Confident	2 Å²	2	24 Å²	24	1%	0.009	11%	0.114	C	C	.	.	H	α-helix	trans	-60.8	-51	173.5	-88.4	-79.3	0	0	0	112	Y288 E310 L566 A567 S572 G573 L575 V618 V623	Y288-H570 AromaticContact CD2-NE2 4Å; Y288-H570 AromaticContact CE2-CE1 3.85Å; Y288-H570 AromaticContact CE2-NE2 3.43Å; Y288-H570 WeakPolarHBondContact CE2-NE2 3.41Å; E310-H570 IonicContact OE1-CD2 3.58Å; E310-H570 IonicContact OE1-CE1 2.75Å; E310-H570 IonicContact OE1-NE2 3.18Å; E310-H570 PolarHBondContact OE1-NE2 3.25Å; L566-H570 PolarHBondContact O-CD2 3.02Å; L566-H570 PolarHBondContact O-N 3.21Å; A567-H570 PolarHBondContact O-N 2.79Å; H570-S572 PolarHBondContact O-N 3.46Å; H570-G573 PolarHBondContact O-N 3.05Å; H570-L575 VanDerWaalsContact CD2-CD1 3.46Å; H570-L575 WeakPolarHBondContact CD2-CD1 3.46Å; H570-L575 WeakPolarHBondContact NE2-CD1 3.3Å; H570-V618 WeakPolarHBondContact O-CG1 3Å; H570-V623 HydrophobicContact CB-CG2 3.52Å
571	A	91.2	Very high	80	Confident	17 Å²	17	26.4 Å²	26.4	14%	0.14	13%	0.129	C	C	.	.	H	α-helix	trans	-58.2	-32.3	-179.6	0	0	0	0	0	112.6	A567 G573 V623 P654	A567-A571 VanDerWaalsContact O-CB 3.3Å; A567-A571 WeakPolarHBondContact O-CB 3.47Å; A567-A571 PolarHBondContact O-N 2.97Å; A571-G573 PolarHBondContact O-N 2.97Å; A571-V623 HydrophobicContact CB-CG1 4.31Å; A571-V623 HydrophobicContact CB-CG2 4.17Å; A571-P654 HydrophobicContact CB-CB 3.82Å; A571-P654 WeakPolarHBondContact CB-O 3.03Å
572	S	87.5	Confident	77	Confident	35 Å²	35	26.6 Å²	26.6	25%	0.245	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	2.3	176.5	70.8	0	0	0	0	115.1	R568 L569 H570 R574 N613	R568-S572 WeakPolarHBondContact O-CB 3.48Å; R568-S572 PolarHBondContact O-N 2.91Å; R568-S572 VanDerWaalsContact O-N 3.1Å; R568-S572 PolarHBondContact O-OG 3.24Å; L569-S572 PolarHBondContact O-N 3.32Å; L569-S572 PolarHBondContact O-OG 3.44Å; H570-S572 PolarHBondContact O-N 3.46Å; S572-R574 PolarHBondContact O-N 3.3Å; S572-R574 VanDerWaalsContact O-N 3.11Å; S572-R574 WeakPolarHBondContact OG-CD 3.28Å; S572-R574 WeakPolarHBondContact OG-CG 3.41Å; S572-N613 PolarHBondContact O-OD1 3.23Å
573	G	83	Confident	73.8	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	-11	-177.1	0	0	0	0	0	115	H570 A571 L575 A576	H570-G573 PolarHBondContact O-N 3.05Å; A571-G573 PolarHBondContact O-N 2.97Å; G573-L575 PolarHBondContact O-N 3.28Å; G573-L575 VanDerWaalsContact O-N 3.15Å; G573-A576 WeakPolarHBondContact O-CB 3.34Å; G573-A576 PolarHBondContact O-N 3.4Å
574	R	81.6	Confident	70.5	Confident	127 Å²	127	43.4 Å²	43.4	48%	0.479	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-29	-175.9	-68.8	-178.3	-177.3	-143.7	1.7	114.5	S572	S572-R574 PolarHBondContact O-N 3.3Å; S572-R574 VanDerWaalsContact O-N 3.11Å; S572-R574 WeakPolarHBondContact OG-CD 3.28Å; S572-R574 WeakPolarHBondContact OG-CG 3.41Å
575	L	81.6	Confident	67	Low	8 Å²	8	51.2 Å²	51.2	4%	0.042	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-2.8	177.6	-57.8	-179.7	0	0	0	112.9	Y288 L569 H570 G573 L577 L578	Y288-L575 HydrophobicContact CD1-CD1 4.44Å; Y288-L575 HydrophobicContact CD1-CD2 3.83Å; Y288-L575 HydrophobicContact CD2-CD1 3.81Å; Y288-L575 HydrophobicContact CE1-CB 4.38Å; Y288-L575 HydrophobicContact CE1-CD1 4.42Å; Y288-L575 HydrophobicContact CE1-CD2 3.69Å; Y288-L575 HydrophobicContact CE1-CG 4.36Å; Y288-L575 HydrophobicContact CE2-CB 4.31Å; Y288-L575 HydrophobicContact CE2-CD1 3.8Å; Y288-L575 HydrophobicContact CE2-CG 4.42Å; Y288-L575 HydrophobicContact CG-CD1 4.15Å; Y288-L575 HydrophobicContact CG-CD2 4.31Å; Y288-L575 PolarHBondContact OH-O 2.92Å; L569-L575 HydrophobicContact CB-CD1 3.63Å; L569-L575 HydrophobicContact CB-CG 3.97Å; H570-L575 VanDerWaalsContact CD2-CD1 3.46Å; H570-L575 WeakPolarHBondContact CD2-CD1 3.46Å; H570-L575 WeakPolarHBondContact NE2-CD1 3.3Å; G573-L575 PolarHBondContact O-N 3.28Å; G573-L575 VanDerWaalsContact O-N 3.15Å; L575-L577 VanDerWaalsContact C-N 3.33Å; L575-L577 PolarHBondContact O-N 3.38Å; L575-L578 PolarHBondContact O-N 3.3Å
576	A	68	Low	63.7	Low	4 Å²	4	58.7 Å²	58.7	3%	0.033	28%	0.279	C	S	.	.	H	α-helix	trans	-65.2	-36.5	179.7	0	0	0	0	0	112	G573 L578 H579 Q580 N617	G573-A576 WeakPolarHBondContact O-CB 3.34Å; G573-A576 PolarHBondContact O-N 3.4Å; A576-L578 VanDerWaalsContact C-N 3.27Å; A576-L578 PolarHBondContact O-N 2.95Å; A576-H579 PolarHBondContact O-N 2.96Å; A576-H579 VanDerWaalsContact O-N 3.14Å; A576-Q580 PolarHBondContact O-N 3.43Å; A576-N617 HydrophobicContact CB-CB 4.48Å; A576-N617 WeakPolarHBondContact CB-O 3.38Å
577	L	56.1	Low	60.2	Low	31 Å²	31	68.3 Å²	68.3	16%	0.162	32%	0.32	C	S	.	.	H	α-helix	trans	-62.3	-34.9	179.8	-149.7	105.6	0	0	0	112.3	L316 L575 H579 T581 I600 L604 L612	L316-L577 HydrophobicContact CD1-CD2 4.27Å; L575-L577 VanDerWaalsContact C-N 3.33Å; L575-L577 PolarHBondContact O-N 3.38Å; L577-H579 VanDerWaalsContact C-N 3.26Å; L577-H579 PolarHBondContact O-N 3.45Å; L577-T581 PolarHBondContact O-OG1 3.36Å; L577-I600 HydrophobicContact CD1-CG2 4.4Å; L577-I600 HydrophobicContact CD2-CB 3.93Å; L577-I600 HydrophobicContact CD2-CD1 3.65Å; L577-I600 HydrophobicContact CD2-CG1 4.35Å; L577-I600 HydrophobicContact CD2-CG2 3.76Å; L577-L604 HydrophobicContact CD1-CD1 4.1Å; L577-L612 HydrophobicContact CB-CD2 3.74Å; L577-L612 HydrophobicContact CD1-CD1 3.86Å; L577-L612 HydrophobicContact CD1-CD2 3.3Å; L577-L612 HydrophobicContact CD1-CG 4.21Å; L577-L612 HydrophobicContact CG-CD2 4.11Å
578	L	53.5	Low	56.8	Low	48 Å²	48	72.5 Å²	72.5	25%	0.251	35%	0.349	S	S	.	.	H	α-helix	trans	-71.3	-20.8	179.7	-82.5	97.7	0	0	0	113	Y288 L575 A576	Y288-L578 HydrophobicContact CD1-CD2 4.44Å; Y288-L578 HydrophobicContact CE1-CB 4Å; Y288-L578 HydrophobicContact CE1-CD1 4.37Å; Y288-L578 HydrophobicContact CE1-CD2 3.76Å; Y288-L578 HydrophobicContact CE1-CG 4.22Å; L575-L578 PolarHBondContact O-N 3.3Å; A576-L578 VanDerWaalsContact C-N 3.27Å; A576-L578 PolarHBondContact O-N 2.95Å
579	H	50.1	Low	53.5	Low	42 Å²	42	76.9 Å²	76.9	19%	0.194	38%	0.378	C	S	.	.	H	α-helix	trans	-90.4	-42	173.5	-91	-92.9	0	0	0	113	Y288 S309 A576 L577 T581 G582	Y288-H579 PolarHBondContact OH-CD2 3.28Å; S309-H579 VanDerWaalsContact C-CE1 3.49Å; S309-H579 PolarHBondContact O-CE1 2.56Å; S309-H579 VanDerWaalsContact O-CE1 3.31Å; A576-H579 PolarHBondContact O-N 2.96Å; A576-H579 VanDerWaalsContact O-N 3.14Å; L577-H579 VanDerWaalsContact C-N 3.26Å; L577-H579 PolarHBondContact O-N 3.45Å; H579-T581 VanDerWaalsContact C-N 3.32Å; H579-T581 PolarHBondContact O-N 3.28Å; H579-G582 PolarHBondContact O-N 3.02Å
580	Q	43.7	Very low	50.4	Low	42 Å²	42	85.6 Å²	85.6	20%	0.196	42%	0.418	C	S	.	.	H	α-helix	trans	-69.6	-27	-170	-88.6	-172.2	-5	0	0	113.1	A576 G582 Y583 Y584 N617	A576-Q580 PolarHBondContact O-N 3.43Å; Q580-G582 PolarHBondContact O-N 2.89Å; Q580-G582 VanDerWaalsContact O-N 3.09Å; Q580-Y583 CarbonylContact O-C 3.47Å; Q580-Y583 PolarHBondContact O-N 3.38Å; Q580-Y584 HydrophobicContact CB-CD2 4.25Å; Q580-Y584 HydrophobicContact CG-CD2 3.96Å; Q580-Y584 HydrophobicContact CG-CE2 4.47Å; Q580-Y584 WeakPolarHBondContact O-CB 3.33Å; Q580-Y584 PolarHBondContact O-N 3.23Å; Q580-N617 PolarHBondContact NE2-OD1 2.83Å
581	T	36.5	Very low	47.4	Very low	51 Å²	51	91.5 Å²	91.5	31%	0.313	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-4.6	179.8	51.1	0	0	0	0	114.7	L316 L577 H579	L316-T581 HydrophobicContact CD1-CG2 3.99Å; L316-T581 VanDerWaalsContact CD2-CB 3.43Å; L316-T581 HydrophobicContact CD2-CG2 3.83Å; L316-T581 WeakPolarHBondContact CD2-OG1 3.04Å; L316-T581 HydrophobicContact CG-CG2 4.27Å; L316-T581 WeakPolarHBondContact CG-OG1 3.21Å; L577-T581 PolarHBondContact O-OG1 3.36Å; H579-T581 VanDerWaalsContact C-N 3.32Å; H579-T581 PolarHBondContact O-N 3.28Å
582	G	30.5	Very low	44.4	Very low	54 Å²	54	99.3 Å²	99.3	56%	0.557	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-18.9	161.6	0	0	0	0	0	114.8	H579 Q580	H579-G582 PolarHBondContact O-N 3.02Å; Q580-G582 PolarHBondContact O-N 2.89Å; Q580-G582 VanDerWaalsContact O-N 3.09Å
583	Y	28.7	Very low	41.6	Very low	217 Å²	217	105.3 Å²	105.3	85%	0.851	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.6	-23.6	-172.9	-89.1	-83.1	0	0	0	115.2	Q580 Q585	Q580-Y583 CarbonylContact O-C 3.47Å; Q580-Y583 PolarHBondContact O-N 3.38Å; Y583-Q585 PolarHBondContact O-N 3.01Å
584	Y	26.8	Very low	39	Very low	138 Å²	138	112.7 Å²	112.7	54%	0.541	55%	0.549	S	S	.	.			trans	-96.2	75.1	178.6	-98.5	-92	0	0	0	110.1	Q580 F586	Q580-Y584 HydrophobicContact CB-CD2 4.25Å; Q580-Y584 HydrophobicContact CG-CD2 3.96Å; Q580-Y584 HydrophobicContact CG-CE2 4.47Å; Q580-Y584 WeakPolarHBondContact O-CB 3.33Å; Q580-Y584 PolarHBondContact O-N 3.23Å; Y584-F586 HydrophobicContact CD1-CD2 4.47Å; Y584-F586 HydrophobicContact CD1-CE2 4.25Å; Y584-F586 PolarHBondContact O-N 3.35Å
585	Q	22.6	Very low	36.3	Very low	185 Å²	185	113.3 Å²	113.3	86%	0.864	56%	0.557	S	S	*	*			trans	-68.1	88.1	159.8	-167.9	161.6	-1.2	0	0	107.5	Y583 K587	Y583-Q585 PolarHBondContact O-N 3.01Å; Q585-K587 PolarHBondContact O-N 3.41Å
586	F	25.9	Very low	33.8	Very low	159 Å²	159	117.1 Å²	117.1	70%	0.697	58%	0.582	S	S	*	*			trans	-56.4	129.5	172	-105.4	-87.8	0	0	0	109.1	Y584 C588	Y584-F586 HydrophobicContact CD1-CD2 4.47Å; Y584-F586 HydrophobicContact CD1-CE2 4.25Å; Y584-F586 PolarHBondContact O-N 3.35Å; F586-C588 PolarHBondContact O-N 3.17Å
587	K	22.5	Very low	32	Very low	201 Å²	201	122.5 Å²	122.5	87%	0.874	62%	0.619	S	S	*	*			trans	-62.5	49.3	161.1	-80.4	176.8	165.6	176.8	0	111.6	Q585 N589	Q585-K587 PolarHBondContact O-N 3.41Å; K587-N589 PolarHBondContact O-N 3.17Å
588	C	24.8	Very low	30.9	Very low	89 Å²	89	125.1 Å²	125.1	60%	0.601	63%	0.633	S	S	*	*			trans	-83.3	65.5	165.8	-70.6	0	0	0	0	108.4	F586 E590	F586-C588 PolarHBondContact O-N 3.17Å; C588-E590 PolarHBondContact O-N 3.42Å; C588-E590 VanDerWaalsContact O-N 3.09Å
589	N	24.6	Very low	30	Very low	163 Å²	163	127.8 Å²	127.8	87%	0.872	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	19.7	176.2	-114.2	11.2	0	0	0	112.9	K587	K587-N589 PolarHBondContact O-N 3.17Å
590	E	28.5	Very low	29.5	Very low	184 Å²	184	128.8 Å²	128.8	86%	0.86	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.1	3.6	-173.3	-70.3	-167.2	163.7	0	0	116.7	C588	C588-E590 PolarHBondContact O-N 3.42Å; C588-E590 VanDerWaalsContact O-N 3.09Å
591	V	28.9	Very low	29.1	Very low	126 Å²	126	132.6 Å²	132.6	76%	0.764	67%	0.671	S	S	*	*			trans	-106	107.6	173.5	-170.7	0	0	0	0	110.4
592	K	27.4	Very low	29.3	Very low	181 Å²	181	136.3 Å²	136.3	79%	0.787	69%	0.685	S	S	*	*			trans	-62.4	130.5	179.1	-63.5	171.1	177.2	176.3	0	111.1	H594	K592-H594 PolarHBondContact O-N 2.76Å
593	N	28.1	Very low	29.8	Very low	161 Å²	161	140.4 Å²	140.4	86%	0.861	69%	0.689	S	S	*	*	S	Bend	trans	52.2	40.9	146.9	-65.5	-1.5	0	0	0	120.4
594	H	28.5	Very low	30.6	Very low	156 Å²	156	131.7 Å²	131.7	72%	0.722	66%	0.658	S	S	*	*			trans	-119.3	120.9	166.1	-73	3.9	0	0	0	111.2	K592	K592-H594 PolarHBondContact O-N 2.76Å
595	Q	25.6	Very low	31.6	Very low	140 Å²	140	130.9 Å²	130.9	65%	0.654	66%	0.662	S	S	*	*			trans	-60	134.7	179.6	-148.9	101.9	15.5	0	0	110.4	S597	Q595-S597 PolarHBondContact O-N 3.28Å; Q595-S597 VanDerWaalsContact O-N 3.15Å
596	P	27.7	Very low	33	Very low	88 Å²	88	124.4 Å²	124.4	57%	0.571	65%	0.646	S	S	*	*	S	Bend	trans	-90	85	-172.3	34.4	-31.7	0	0	0	111.4
597	S	30.8	Very low	34.3	Very low	116 Å²	116	122.8 Å²	122.8	81%	0.811	64%	0.644	S	S	*	*			trans	-118.6	63.3	155.7	67	0	0	0	0	107.9	Q595	Q595-S597 PolarHBondContact O-N 3.28Å; Q595-S597 VanDerWaalsContact O-N 3.15Å
598	I	33.3	Very low	35.9	Very low	86 Å²	86	117.8 Å²	117.8	44%	0.441	62%	0.624	S	S	.	*			trans	-115.6	121	-169.4	-60.3	174.6	0	0	0	108.7	I600	I598-I600 VanDerWaalsContact C-N 3.33Å; I598-I600 WeakPolarHBondContact O-CG1 3.3Å; I598-I600 PolarHBondContact O-N 3.28Å
599	D	34.7	Very low	37.4	Very low	104 Å²	104	116.5 Å²	116.5	56%	0.556	61%	0.611	S	S	*	*			trans	-61.2	89.1	170.7	-73.1	-46.4	0	0	0	109.9	E601 Q602	D599-E601 PolarHBondContact O-N 3.2Å; D599-Q602 PolarHBondContact O-N 3.18Å; D599-Q602 VanDerWaalsContact O-N 3.17Å
600	I	38.5	Very low	39.1	Very low	64 Å²	64	113.7 Å²	113.7	33%	0.328	60%	0.596	S	S	.	*	H	α-helix	trans	-58.1	-28	-169.9	-56.2	175.6	0	0	0	111.8	L316 L577 I598 Q602 L604	L316-I600 HydrophobicContact CD1-CD1 4.22Å; L577-I600 HydrophobicContact CD1-CG2 4.4Å; L577-I600 HydrophobicContact CD2-CB 3.93Å; L577-I600 HydrophobicContact CD2-CD1 3.65Å; L577-I600 HydrophobicContact CD2-CG1 4.35Å; L577-I600 HydrophobicContact CD2-CG2 3.76Å; I598-I600 VanDerWaalsContact C-N 3.33Å; I598-I600 WeakPolarHBondContact O-CG1 3.3Å; I598-I600 PolarHBondContact O-N 3.28Å; I600-Q602 PolarHBondContact O-N 3.34Å; I600-L604 HydrophobicContact CG2-CD1 3.55Å; I600-L604 HydrophobicContact CG2-CD2 4.29Å; I600-L604 HydrophobicContact CG2-CG 3.71Å; I600-L604 WeakPolarHBondContact O-CB 2.98Å; I600-L604 WeakPolarHBondContact O-CD1 3.5Å; I600-L604 WeakPolarHBondContact O-CG 3.31Å; I600-L604 PolarHBondContact O-N 2.64Å
601	E	36.8	Very low	40.8	Very low	122 Å²	122	111.2 Å²	111.2	57%	0.57	58%	0.584	S	S	*	*	H	α-helix	trans	-72.7	-25.9	-178.3	-67.2	-166.6	162	0	0	115	D599	D599-E601 PolarHBondContact O-N 3.2Å
602	Q	41.1	Very low	42.3	Very low	128 Å²	128	106.6 Å²	106.6	60%	0.598	56%	0.555	S	S	*	*	H	α-helix	trans	-80.4	-26.1	177.6	-76.2	-171.8	10	0	0	112.8	D599 I600	D599-Q602 PolarHBondContact O-N 3.18Å; D599-Q602 VanDerWaalsContact O-N 3.17Å; I600-Q602 PolarHBondContact O-N 3.34Å
603	E	39.5	Very low	44.1	Very low	140 Å²	140	100.3 Å²	100.3	65%	0.654	53%	0.53	S	S	*	.	H	α-helix	trans	-96	-15.9	177.9	-71.8	-165.4	158.3	0	0	114.2	N605	E603-N605 PolarHBondContact O-N 3.37Å
604	L	45.7	Very low	46.4	Very low	35 Å²	35	96.7 Å²	96.7	18%	0.183	51%	0.51	C	S	.	.	S	Bend	trans	-68.8	99.9	172.4	-76.6	167.6	0	0	0	109.2	L577 I600 G606 Q608 L609	L577-L604 HydrophobicContact CD1-CD1 4.1Å; I600-L604 HydrophobicContact CG2-CD1 3.55Å; I600-L604 HydrophobicContact CG2-CD2 4.29Å; I600-L604 HydrophobicContact CG2-CG 3.71Å; I600-L604 WeakPolarHBondContact O-CB 2.98Å; I600-L604 WeakPolarHBondContact O-CD1 3.5Å; I600-L604 WeakPolarHBondContact O-CG 3.31Å; I600-L604 PolarHBondContact O-N 2.64Å; L604-G606 PolarHBondContact O-N 3.49Å; L604-Q608 HydrophobicContact CB-CB 4.44Å; L604-Q608 HydrophobicContact CD2-CB 3.52Å; L604-Q608 HydrophobicContact CD2-CG 4.38Å; L604-L609 HydrophobicContact CB-CD1 3.72Å; L604-L609 HydrophobicContact CD1-CD1 3.91Å; L604-L609 HydrophobicContact CG-CD1 4.49Å
605	N	47.1	Very low	48.7	Very low	120 Å²	120	91.1 Å²	91.1	64%	0.642	49%	0.488	S	S	*	.			trans	-47.7	143.1	166.4	-86.3	-26.5	0	0	0	109.4	E603 N607 Q608 L609	E603-N605 PolarHBondContact O-N 3.37Å; N605-N607 CarbonylContact O-C 3.51Å; N605-N607 PolarHBondContact O-N 3.35Å; N605-Q608 PolarHBondContact O-N 3.02Å; N605-L609 PolarHBondContact O-N 3.45Å
606	G	52.1	Low	51.2	Low	50 Å²	50	93.1 Å²	93.1	52%	0.515	50%	0.497	S	S	.	.	H	α-helix	trans	-50.9	-25.1	-176.5	0	0	0	0	0	114.7	L604 N610	L604-G606 PolarHBondContact O-N 3.49Å; G606-N610 PolarHBondContact O-N 2.79Å; G606-N610 VanDerWaalsContact O-N 3.09Å; G606-N610 PolarHBondContact O-ND2 2.99Å
607	N	55	Low	53.8	Low	124 Å²	124	90.9 Å²	90.9	66%	0.663	48%	0.481	S	S	*	.	H	α-helix	trans	-65.4	-43.8	172	-66.7	-8.9	0	0	0	113.5	N605 N610 E611	N605-N607 CarbonylContact O-C 3.51Å; N605-N607 PolarHBondContact O-N 3.35Å; N607-N610 PolarHBondContact O-N 3.26Å; N607-E611 PolarHBondContact O-N 3.38Å
608	Q	55.8	Low	56.4	Low	96 Å²	96	85.9 Å²	85.9	45%	0.449	45%	0.445	S	S	.	.	H	α-helix	trans	-70	-35.5	178.2	-66.2	175.5	-26.4	0	0	111.3	L604 N605 N610 E611 L612	L604-Q608 HydrophobicContact CB-CB 4.44Å; L604-Q608 HydrophobicContact CD2-CB 3.52Å; L604-Q608 HydrophobicContact CD2-CG 4.38Å; N605-Q608 PolarHBondContact O-N 3.02Å; Q608-N610 VanDerWaalsContact C-N 3.3Å; Q608-N610 PolarHBondContact O-N 2.78Å; Q608-E611 PolarHBondContact O-N 2.76Å; Q608-L612 PolarHBondContact O-N 3.18Å
609	L	55.7	Low	59	Low	62 Å²	62	83.3 Å²	83.3	33%	0.325	43%	0.432	S	S	.	.	H	α-helix	trans	-60.4	-41.8	171.6	-129	98.7	0	0	0	111.1	L604 N605 L612 N613	L604-L609 HydrophobicContact CB-CD1 3.72Å; L604-L609 HydrophobicContact CD1-CD1 3.91Å; L604-L609 HydrophobicContact CG-CD1 4.49Å; N605-L609 PolarHBondContact O-N 3.45Å; L609-L612 PolarHBondContact O-N 2.9Å; L609-N613 PolarHBondContact O-N 3.07Å; L609-N613 PolarHBondContact O-ND2 3.4Å; L609-N613 VanDerWaalsContact O-ND2 3.1Å; L609-N613 PolarHBondContact O-OD1 3.13Å
610	N	60	Low	61.7	Low	105 Å²	105	79 Å²	79	56%	0.561	41%	0.409	S	S	*	.	H	α-helix	trans	-67.1	-38.3	177.2	-72.2	-21.7	0	0	0	112.8	G606 N607 Q608 L612 N613	G606-N610 PolarHBondContact O-N 2.79Å; G606-N610 VanDerWaalsContact O-N 3.09Å; G606-N610 PolarHBondContact O-ND2 2.99Å; N607-N610 PolarHBondContact O-N 3.26Å; Q608-N610 VanDerWaalsContact C-N 3.3Å; Q608-N610 PolarHBondContact O-N 2.78Å; N610-L612 VanDerWaalsContact C-N 3.27Å; N610-L612 PolarHBondContact O-N 2.8Å; N610-N613 PolarHBondContact O-N 2.71Å
611	E	63.9	Low	64.1	Low	131 Å²	131	81.8 Å²	81.8	61%	0.612	42%	0.42	S	S	*	.	H	α-helix	trans	-62.7	-36.3	172	-76.6	-179.1	-179.3	0	0	111.7	N607 Q608 L614 N617	N607-E611 PolarHBondContact O-N 3.38Å; Q608-E611 PolarHBondContact O-N 2.76Å; E611-L614 WeakPolarHBondContact O-CB 3.41Å; E611-L614 VanDerWaalsContact O-CD1 3.26Å; E611-L614 WeakPolarHBondContact O-CD1 3.36Å; E611-L614 VanDerWaalsContact O-CG 3.24Å; E611-L614 WeakPolarHBondContact O-CG 3.27Å; E611-L614 PolarHBondContact O-N 3.22Å; E611-N617 PolarHBondContact O-ND2 2.62Å
612	L	60.5	Low	66.8	Low	29 Å²	29	76 Å²	76	15%	0.152	39%	0.393	C	S	.	.	H	α-helix	trans	-71.4	-31.8	177.2	-153	82.2	0	0	0	113	L577 Q608 L609 N610 L614 N617	L577-L612 HydrophobicContact CB-CD2 3.74Å; L577-L612 HydrophobicContact CD1-CD1 3.86Å; L577-L612 HydrophobicContact CD1-CD2 3.3Å; L577-L612 HydrophobicContact CD1-CG 4.21Å; L577-L612 HydrophobicContact CG-CD2 4.11Å; Q608-L612 PolarHBondContact O-N 3.18Å; L609-L612 PolarHBondContact O-N 2.9Å; N610-L612 VanDerWaalsContact C-N 3.27Å; N610-L612 PolarHBondContact O-N 2.8Å; L612-L614 PolarHBondContact O-N 2.78Å; L612-N617 WeakPolarHBondContact O-CB 3.41Å
613	N	66.9	Low	69.4	Low	50 Å²	50	69.9 Å²	69.9	27%	0.267	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	3.6	178.2	-63.9	-23.7	0	0	0	113.6	S572 L609 N610	S572-N613 PolarHBondContact O-OD1 3.23Å; L609-N613 PolarHBondContact O-N 3.07Å; L609-N613 PolarHBondContact O-ND2 3.4Å; L609-N613 VanDerWaalsContact O-ND2 3.1Å; L609-N613 PolarHBondContact O-OD1 3.13Å; N610-N613 PolarHBondContact O-N 2.71Å
614	L	75.6	Confident	71.9	Confident	84 Å²	84	64.5 Å²	64.5	44%	0.44	34%	0.34	S	S	.	.	S	Bend	trans	-60.2	136.1	173.7	-72.8	169.1	0	0	0	110.4	E611 L612 Q616 N617	E611-L614 WeakPolarHBondContact O-CB 3.41Å; E611-L614 VanDerWaalsContact O-CD1 3.26Å; E611-L614 WeakPolarHBondContact O-CD1 3.36Å; E611-L614 VanDerWaalsContact O-CG 3.24Å; E611-L614 WeakPolarHBondContact O-CG 3.27Å; E611-L614 PolarHBondContact O-N 3.22Å; L612-L614 PolarHBondContact O-N 2.78Å; L614-Q616 PolarHBondContact O-N 3.14Å; L614-N617 PolarHBondContact O-N 2.73Å
615	P	76.1	Confident	74.3	Confident	40 Å²	40	65.2 Å²	65.2	26%	0.26	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-52	-26.3	178.9	-31.5	36.3	0	0	0	114.6	N617 V618 W620 E657	P615-N617 VanDerWaalsContact C-N 3.29Å; P615-N617 PolarHBondContact O-N 2.73Å; P615-V618 PolarHBondContact O-N 3.43Å; P615-W620 HydrophobicContact CB-CZ2 4.13Å; P615-W620 PolarHBondContact O-NE1 3.48Å; P615-E657 HydrophobicContact CG-CB 4.16Å
616	Q	79.5	Confident	76.6	Confident	181 Å²	181	59.5 Å²	59.5	85%	0.846	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-70.5	-22.9	179.1	-62.6	173.5	26.8	0	0	113.5	L614	L614-Q616 PolarHBondContact O-N 3.14Å
617	N	80.6	Confident	78.7	Confident	42 Å²	42	57.1 Å²	57.1	23%	0.225	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-90.4	-13.2	178.8	-69.2	-32.4	0	0	0	112.7	A576 Q580 E611 L612 L614 P615	A576-N617 HydrophobicContact CB-CB 4.48Å; A576-N617 WeakPolarHBondContact CB-O 3.38Å; Q580-N617 PolarHBondContact NE2-OD1 2.83Å; E611-N617 PolarHBondContact O-ND2 2.62Å; L612-N617 WeakPolarHBondContact O-CB 3.41Å; L614-N617 PolarHBondContact O-N 2.73Å; P615-N617 VanDerWaalsContact C-N 3.29Å; P615-N617 PolarHBondContact O-N 2.73Å
618	V	86.1	Confident	80.5	Confident	11 Å²	11	54 Å²	54	7%	0.067	27%	0.268	C	S	.	.	S	Bend	trans	-74	130.5	-179.9	172.4	0	0	0	0	110.2	H570 P615 W620 V623	H570-V618 WeakPolarHBondContact O-CG1 3Å; P615-V618 PolarHBondContact O-N 3.43Å; V618-W620 VanDerWaalsContact C-N 3.32Å; V618-W620 HydrophobicContact CB-CD2 4.38Å; V618-W620 HydrophobicContact CB-CZ2 4.07Å; V618-W620 HydrophobicContact CG1-CD2 3.79Å; V618-W620 HydrophobicContact CG1-CE3 4.22Å; V618-W620 HydrophobicContact CG1-CG 4.15Å; V618-W620 HydrophobicContact CG1-CH2 4.37Å; V618-W620 HydrophobicContact CG1-CZ2 3.96Å; V618-W620 HydrophobicContact CG1-CZ3 4.48Å; V618-W620 HydrophobicContact CG2-CZ2 4.44Å; V618-W620 PolarHBondContact O-N 2.99Å; V618-V623 HydrophobicContact CG1-CG2 3.97Å
619	N	88.1	Confident	82.3	Confident	31 Å²	31	50.2 Å²	50.2	17%	0.166	25%	0.25	C	S	.	.			trans	-75.9	84.5	169.2	-179.9	-2.6	0	0	0	109.8	S309 E621 S622 V623	S309-N619 PolarHBondContact OG-ND2 2.95Å; N619-E621 PolarHBondContact O-N 3.44Å; N619-E621 WeakPolarHBondContact OD1-CB 3.39Å; N619-E621 PolarHBondContact OD1-N 3.2Å; N619-S622 PolarHBondContact ND2-OG 3.12Å; N619-S622 WeakPolarHBondContact O-CB 3.43Å; N619-S622 PolarHBondContact O-N 3.2Å; N619-S622 PolarHBondContact OD1-N 3.45Å; N619-V623 PolarHBondContact O-N 3.14Å
620	W	91	Very high	84.1	Confident	15 Å²	15	47.3 Å²	47.3	6%	0.057	24%	0.235	C	C	.	.	H	α-helix	trans	-64.7	-25.2	-179.4	-68.1	102.3	0	0	0	113.9	P615 V618 S622 V623 L624 P654 L655 E657 C658 I660	P615-W620 HydrophobicContact CB-CZ2 4.13Å; P615-W620 PolarHBondContact O-NE1 3.48Å; V618-W620 VanDerWaalsContact C-N 3.32Å; V618-W620 HydrophobicContact CB-CD2 4.38Å; V618-W620 HydrophobicContact CB-CZ2 4.07Å; V618-W620 HydrophobicContact CG1-CD2 3.79Å; V618-W620 HydrophobicContact CG1-CE3 4.22Å; V618-W620 HydrophobicContact CG1-CG 4.15Å; V618-W620 HydrophobicContact CG1-CH2 4.37Å; V618-W620 HydrophobicContact CG1-CZ2 3.96Å; V618-W620 HydrophobicContact CG1-CZ3 4.48Å; V618-W620 HydrophobicContact CG2-CZ2 4.44Å; V618-W620 PolarHBondContact O-N 2.99Å; W620-S622 VanDerWaalsContact C-N 3.33Å; W620-V623 HydrophobicContact CE3-CB 4.15Å; W620-V623 HydrophobicContact CE3-CG1 4.25Å; W620-V623 HydrophobicContact CE3-CG2 4.05Å; W620-V623 HydrophobicContact CZ3-CG1 4.33Å; W620-V623 HydrophobicContact CZ3-CG2 4.42Å; W620-V623 PolarHBondContact O-N 2.65Å; W620-L624 WeakPolarHBondContact O-CG 3.13Å; W620-L624 PolarHBondContact O-N 2.85Å; W620-P654 WeakPolarHBondContact CZ3-O 3.13Å; W620-L655 HydrophobicContact CE3-CD2 4.1Å; W620-L655 HydrophobicContact CZ3-CD2 4.22Å; W620-E657 VanDerWaalsContact CH2-C 3.48Å; W620-E657 HydrophobicContact CH2-CB 4.17Å; W620-E657 HydrophobicContact CZ2-CB 4.39Å; W620-E657 WeakPolarHBondContact CZ2-O 3.42Å; W620-C658 HydrophobicContact CD2-CB 4.16Å; W620-C658 HydrophobicContact CE3-CB 3.63Å; W620-C658 HydrophobicContact CH2-CB 4.11Å; W620-C658 HydrophobicContact CZ3-CB 3.6Å; W620-I660 HydrophobicContact CB-CD1 3.67Å; W620-I660 HydrophobicContact CB-CG1 4.47Å; W620-I660 HydrophobicContact CG-CD1 4.46Å
621	E	90	Very high	85.7	Confident	121 Å²	121	43 Å²	43	57%	0.565	21%	0.214	S	C	*	.	H	α-helix	trans	-62.4	-42.9	173.4	-172	-174.5	177.8	0	0	110.7	N619 F625	N619-E621 PolarHBondContact O-N 3.44Å; N619-E621 WeakPolarHBondContact OD1-CB 3.39Å; N619-E621 PolarHBondContact OD1-N 3.2Å; E621-F625 VanDerWaalsContact O-CB 3.32Å; E621-F625 WeakPolarHBondContact O-CB 3.23Å; E621-F625 PolarHBondContact O-N 3.05Å
622	S	92.6	Very high	86.9	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.4	-41.7	173	-78.8	0	0	0	0	112.7	P307 S309 E310 N619 W620 L624 F625 H626	P307-S622 WeakPolarHBondContact CG-OG 3.34Å; S309-S622 PolarHBondContact OG-OG 3.11Å; E310-S622 WeakPolarHBondContact OE1-CB 3.46Å; E310-S622 PolarHBondContact OE1-OG 2.82Å; N619-S622 PolarHBondContact ND2-OG 3.12Å; N619-S622 WeakPolarHBondContact O-CB 3.43Å; N619-S622 PolarHBondContact O-N 3.2Å; N619-S622 PolarHBondContact OD1-N 3.45Å; W620-S622 VanDerWaalsContact C-N 3.33Å; S622-L624 PolarHBondContact O-N 3.3Å; S622-F625 PolarHBondContact O-N 3.04Å; S622-H626 WeakPolarHBondContact O-CB 3.5Å; S622-H626 PolarHBondContact O-CD2 3.18Å; S622-H626 PolarHBondContact O-N 3.25Å
623	V	94.8	Very high	88.2	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.1	-50.3	176.8	-178.7	0	0	0	0	110.4	A567 H570 A571 V618 N619 W620 L627 P654 L655	A567-V623 HydrophobicContact CB-CG1 4.29Å; H570-V623 HydrophobicContact CB-CG2 3.52Å; A571-V623 HydrophobicContact CB-CG1 4.31Å; A571-V623 HydrophobicContact CB-CG2 4.17Å; V618-V623 HydrophobicContact CG1-CG2 3.97Å; N619-V623 PolarHBondContact O-N 3.14Å; W620-V623 HydrophobicContact CE3-CB 4.15Å; W620-V623 HydrophobicContact CE3-CG1 4.25Å; W620-V623 HydrophobicContact CE3-CG2 4.05Å; W620-V623 HydrophobicContact CZ3-CG1 4.33Å; W620-V623 HydrophobicContact CZ3-CG2 4.42Å; W620-V623 PolarHBondContact O-N 2.65Å; V623-L627 HydrophobicContact CG1-CD1 4.16Å; V623-L627 WeakPolarHBondContact O-CB 3.25Å; V623-L627 WeakPolarHBondContact O-CG 3.33Å; V623-L627 PolarHBondContact O-N 3.24Å; V623-P654 HydrophobicContact CG1-CB 3.98Å; V623-L655 HydrophobicContact CG1-CD2 3.75Å; V623-L655 HydrophobicContact CG1-CG 4.37Å
624	L	93.8	Very high	89.1	Confident	27 Å²	27	42 Å²	42	14%	0.141	22%	0.219	C	C	.	.	H	α-helix	trans	-62.6	-49.5	179	-77.3	165.7	0	0	0	111.5	W620 S622 H626 L627 E628 L642 Y645 L655	W620-L624 WeakPolarHBondContact O-CG 3.13Å; W620-L624 PolarHBondContact O-N 2.85Å; S622-L624 PolarHBondContact O-N 3.3Å; L624-H626 VanDerWaalsContact C-N 3.31Å; L624-H626 PolarHBondContact O-N 3.12Å; L624-L627 PolarHBondContact O-N 3.06Å; L624-E628 WeakPolarHBondContact O-CG 3.06Å; L624-E628 PolarHBondContact O-N 3.41Å; L624-L642 HydrophobicContact CD2-CD2 4.43Å; L624-Y645 HydrophobicContact CD2-CD1 4.41Å; L624-Y645 HydrophobicContact CD2-CE1 3.91Å; L624-L655 HydrophobicContact CD2-CD1 3.82Å; L624-L655 HydrophobicContact CD2-CD2 3.86Å; L624-L655 HydrophobicContact CG-CD2 4.1Å
625	F	95.1	Very high	89.8	Confident	50 Å²	50	38.4 Å²	38.4	22%	0.219	20%	0.2	C	C	.	.	H	α-helix	trans	-55.5	-46.4	179.8	173.1	-90.2	0	0	0	112.2	D305 P307 E621 S622 E628 Q629	D305-F625 HydrophobicContact CB-CZ 4.34Å; D305-F625 WeakPolarHBondContact O-CE1 3.13Å; P307-F625 HydrophobicContact CB-CB 4.03Å; P307-F625 HydrophobicContact CB-CD1 3.77Å; P307-F625 HydrophobicContact CB-CD2 4.17Å; P307-F625 HydrophobicContact CB-CE1 4.29Å; P307-F625 HydrophobicContact CB-CG 3.71Å; P307-F625 VanDerWaalsContact CD-CD1 3.47Å; P307-F625 HydrophobicContact CG-CD1 3.86Å; P307-F625 HydrophobicContact CG-CE1 4.41Å; P307-F625 HydrophobicContact CG-CG 4.25Å; E621-F625 VanDerWaalsContact O-CB 3.32Å; E621-F625 WeakPolarHBondContact O-CB 3.23Å; E621-F625 PolarHBondContact O-N 3.05Å; S622-F625 PolarHBondContact O-N 3.04Å; F625-E628 PolarHBondContact O-N 3.34Å; F625-Q629 HydrophobicContact CD1-CG 4.25Å; F625-Q629 HydrophobicContact CE1-CG 3.75Å; F625-Q629 HydrophobicContact CE2-CG 4.35Å; F625-Q629 HydrophobicContact CZ-CG 3.81Å; F625-Q629 WeakPolarHBondContact O-CB 3.33Å; F625-Q629 WeakPolarHBondContact O-CG 3.08Å; F625-Q629 PolarHBondContact O-N 3.14Å; F625-Q629 PolarHBondContact O-NE2 3.49Å
626	H	96.2	Very high	90.4	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-70.5	-38.2	179.9	-78.5	-40.7	0	0	0	112.6	E310 H563 L566 A567 S622 L624 Q629 S630	E310-H626 IonicContact OE1-CD2 2.82Å; E310-H626 IonicContact OE1-NE2 3.55Å; E310-H626 PolarHBondContact OE1-NE2 2.87Å; E310-H626 IonicContact OE2-NE2 2.79Å; E310-H626 PolarHBondContact OE2-NE2 3.2Å; H563-H626 WeakPolarHBondContact CB-O 3.43Å; H563-H626 AromaticContact CE1-ND1 3.73Å; H563-H626 AromaticContact ND1-CE1 3.71Å; H563-H626 AromaticContact ND1-CG 3.99Å; H563-H626 AromaticContact ND1-ND1 3.01Å; H563-H626 PolarHBondContact ND1-ND1 3.09Å; H563-H626 WeakPolarHBondContact O-CB 3.21Å; L566-H626 HydrophobicContact CB-CB 4.47Å; A567-H626 HydrophobicContact CB-CB 3.92Å; S622-H626 WeakPolarHBondContact O-CB 3.5Å; S622-H626 PolarHBondContact O-CD2 3.18Å; S622-H626 PolarHBondContact O-N 3.25Å; L624-H626 VanDerWaalsContact C-N 3.31Å; L624-H626 PolarHBondContact O-N 3.12Å; H626-Q629 PolarHBondContact O-N 2.74Å; H626-S630 VanDerWaalsContact O-CB 3.23Å; H626-S630 WeakPolarHBondContact O-CB 3.47Å; H626-S630 PolarHBondContact O-N 3.2Å
627	L	95.7	Very high	90.8	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.5	-42.1	172.6	-79.6	174.6	0	0	0	112.2	A567 V623 L624 Q629 S630 A631 A638 L642 P654 L655	A567-L627 HydrophobicContact CB-CD2 4.05Å; A567-L627 HydrophobicContact CB-CG 3.73Å; V623-L627 HydrophobicContact CG1-CD1 4.16Å; V623-L627 WeakPolarHBondContact O-CB 3.25Å; V623-L627 WeakPolarHBondContact O-CG 3.33Å; V623-L627 PolarHBondContact O-N 3.24Å; L624-L627 PolarHBondContact O-N 3.06Å; L627-Q629 PolarHBondContact O-N 3Å; L627-S630 WeakPolarHBondContact O-CB 3.37Å; L627-S630 PolarHBondContact O-N 3.4Å; L627-A631 WeakPolarHBondContact O-CB 3.43Å; L627-A631 PolarHBondContact O-N 3.02Å; L627-A638 HydrophobicContact CD2-CB 3.92Å; L627-L642 HydrophobicContact CB-CD1 4.18Å; L627-L642 HydrophobicContact CB-CD2 3.98Å; L627-L642 HydrophobicContact CB-CG 4.07Å; L627-L642 HydrophobicContact CD1-CD2 4.36Å; L627-P654 HydrophobicContact CD1-CB 4.24Å; L627-P654 HydrophobicContact CD2-CG 4.25Å; L627-L655 HydrophobicContact CD1-CD1 3.5Å; L627-L655 HydrophobicContact CD1-CD2 4.18Å; L627-L655 HydrophobicContact CD1-CG 3.45Å; L627-L655 VanDerWaalsContact CD1-CG 3.45Å
628	E	93.4	Very high	91.4	Very high	59 Å²	59	31 Å²	31	28%	0.276	16%	0.164	S	C	.	.	H	α-helix	trans	-62.5	-44	176.8	-74	177.3	-174	0	0	111.9	L624 F625 S630 A631 K632 L642	L624-E628 WeakPolarHBondContact O-CG 3.06Å; L624-E628 PolarHBondContact O-N 3.41Å; F625-E628 PolarHBondContact O-N 3.34Å; E628-S630 VanDerWaalsContact C-N 3.34Å; E628-A631 PolarHBondContact O-N 3.46Å; E628-K632 WeakPolarHBondContact O-CB 3.46Å; E628-K632 VanDerWaalsContact O-CG 3.25Å; E628-K632 WeakPolarHBondContact O-CG 3.49Å; E628-K632 PolarHBondContact O-N 2.78Å; E628-L642 HydrophobicContact CG-CD1 4.35Å
629	Q	93.5	Very high	91.7	Very high	17 Å²	17	31.1 Å²	31.1	8%	0.079	16%	0.164	C	C	.	.	H	α-helix	trans	-60.5	-44.8	173.9	-79.1	-7.3	-74.9	0	0	111.4	D305 I548 H563 F625 H626 L627 A631 K632 L633	D305-Q629 HydrophobicContact CB-CG 4.5Å; I548-Q629 HydrophobicContact CD1-CB 3.34Å; I548-Q629 HydrophobicContact CD1-CG 3.39Å; H563-Q629 HydrophobicContact CB-CB 4.35Å; F625-Q629 HydrophobicContact CD1-CG 4.25Å; F625-Q629 HydrophobicContact CE1-CG 3.75Å; F625-Q629 HydrophobicContact CE2-CG 4.35Å; F625-Q629 HydrophobicContact CZ-CG 3.81Å; F625-Q629 WeakPolarHBondContact O-CB 3.33Å; F625-Q629 WeakPolarHBondContact O-CG 3.08Å; F625-Q629 PolarHBondContact O-N 3.14Å; F625-Q629 PolarHBondContact O-NE2 3.49Å; H626-Q629 PolarHBondContact O-N 2.74Å; L627-Q629 PolarHBondContact O-N 3Å; Q629-A631 PolarHBondContact O-N 3.39Å; Q629-K632 PolarHBondContact O-N 3.23Å; Q629-L633 WeakPolarHBondContact O-CD1 3.5Å; Q629-L633 WeakPolarHBondContact O-CG 3.35Å; Q629-L633 PolarHBondContact O-N 3.16Å; Q629-L633 VanDerWaalsContact O-N 3.14Å
630	S	93.4	Very high	91.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.4	-43.7	177.5	-173.2	0	0	0	0	112.3	G560 H564 H626 L627 E628 L633 G634 C635 A638	G560-S630 WeakPolarHBondContact O-CB 3.35Å; G560-S630 PolarHBondContact O-OG 3.02Å; H564-S630 WeakPolarHBondContact CB-OG 3.44Å; H626-S630 VanDerWaalsContact O-CB 3.23Å; H626-S630 WeakPolarHBondContact O-CB 3.47Å; H626-S630 PolarHBondContact O-N 3.2Å; L627-S630 WeakPolarHBondContact O-CB 3.37Å; L627-S630 PolarHBondContact O-N 3.4Å; E628-S630 VanDerWaalsContact C-N 3.34Å; S630-L633 PolarHBondContact O-N 3.31Å; S630-G634 PolarHBondContact O-N 2.94Å; S630-C635 WeakPolarHBondContact O-CB 3.32Å; S630-C635 PolarHBondContact O-N 3.42Å; S630-C635 WeakPolarHBondContact OG-CB 3.47Å; S630-C635 PolarHBondContact OG-SG 3.44Å; S630-A638 VanDerWaalsContact OG-CB 3.27Å; S630-A638 WeakPolarHBondContact OG-CB 3.32Å
631	A	92	Very high	91.8	Very high	14 Å²	14	30.9 Å²	30.9	12%	0.116	16%	0.163	C	C	.	.	H	α-helix	trans	-66.2	-41.8	177.5	0	0	0	0	0	112.3	L627 E628 Q629 L633 G634 A638 I639 L642	L627-A631 WeakPolarHBondContact O-CB 3.43Å; L627-A631 PolarHBondContact O-N 3.02Å; E628-A631 PolarHBondContact O-N 3.46Å; Q629-A631 PolarHBondContact O-N 3.39Å; A631-L633 PolarHBondContact O-N 2.88Å; A631-G634 PolarHBondContact O-N 2.93Å; A631-A638 HydrophobicContact CB-CB 4.26Å; A631-I639 HydrophobicContact CB-CG1 3.76Å; A631-L642 HydrophobicContact CB-CD1 3.74Å
632	K	89.5	Confident	92	Very high	133 Å²	133	25.2 Å²	25.2	58%	0.578	14%	0.136	S	C	*	.	H	α-helix	trans	-59.1	-30.2	172.9	-73.5	166.7	-172	162.2	0	112.7	I548 E628 Q629 G634	I548-K632 HydrophobicContact CG2-CB 4.39Å; E628-K632 WeakPolarHBondContact O-CB 3.46Å; E628-K632 VanDerWaalsContact O-CG 3.25Å; E628-K632 WeakPolarHBondContact O-CG 3.49Å; E628-K632 PolarHBondContact O-N 2.78Å; Q629-K632 PolarHBondContact O-N 3.23Å; K632-G634 VanDerWaalsContact C-N 3.28Å
633	L	88.6	Confident	91.8	Very high	8 Å²	8	25.2 Å²	25.2	4%	0.042	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	1	177.2	-70.2	164.3	0	0	0	113.8	I548 L551 T556 L559 Q629 S630 A631	I548-L633 HydrophobicContact CD1-CD1 3.85Å; I548-L633 HydrophobicContact CD1-CG 4.15Å; I548-L633 HydrophobicContact CG1-CD1 3.68Å; I548-L633 HydrophobicContact CG1-CD2 3.86Å; I548-L633 HydrophobicContact CG1-CG 3.77Å; L551-L633 HydrophobicContact CD1-CD2 3.59Å; T556-L633 HydrophobicContact CG2-CD2 3.85Å; T556-L633 PolarHBondContact OG1-O 3.38Å; L559-L633 HydrophobicContact CB-CD1 3.75Å; L559-L633 HydrophobicContact CB-CD2 4.42Å; Q629-L633 WeakPolarHBondContact O-CD1 3.5Å; Q629-L633 WeakPolarHBondContact O-CG 3.35Å; Q629-L633 PolarHBondContact O-N 3.16Å; Q629-L633 VanDerWaalsContact O-N 3.14Å; S630-L633 PolarHBondContact O-N 3.31Å; A631-L633 PolarHBondContact O-N 2.88Å
634	G	85.1	Confident	91.5	Very high	50 Å²	50	26.1 Å²	26.1	52%	0.515	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	85	17.2	177	0	0	0	0	0	114.5	S630 A631 K632 L636	S630-G634 PolarHBondContact O-N 2.94Å; A631-G634 PolarHBondContact O-N 2.93Å; K632-G634 VanDerWaalsContact C-N 3.28Å; G634-L636 PolarHBondContact O-N 3.26Å
635	C	89.9	Confident	91.4	Very high	8 Å²	8	25.6 Å²	25.6	5%	0.054	14%	0.137	C	C	.	.			trans	-69.8	110.8	174.3	-176.8	0	0	0	0	110.1	S630 D637 A638 I639	S630-C635 WeakPolarHBondContact O-CB 3.32Å; S630-C635 PolarHBondContact O-N 3.42Å; S630-C635 WeakPolarHBondContact OG-CB 3.47Å; S630-C635 PolarHBondContact OG-SG 3.44Å; C635-D637 PolarHBondContact O-N 2.8Å; C635-A638 HydrophobicContact CB-CB 4.03Å; C635-A638 PolarHBondContact O-N 3.27Å; C635-I639 WeakPolarHBondContact O-CG1 3.36Å; C635-I639 PolarHBondContact O-N 3.37Å
636	L	89	Confident	91.1	Very high	32 Å²	32	24.5 Å²	24.5	17%	0.168	13%	0.132	C	C	.	.	H	α-helix	trans	-60.1	-44.1	-174.6	-179.4	60.1	0	0	0	112.4	G634 A638 I639 Q640 A678 A681 D683	G634-L636 PolarHBondContact O-N 3.26Å; L636-A638 PolarHBondContact O-N 3.25Å; L636-I639 PolarHBondContact O-N 3.09Å; L636-I639 VanDerWaalsContact O-N 3.11Å; L636-Q640 HydrophobicContact CD1-CG 4.17Å; L636-Q640 HydrophobicContact CG-CG 4.35Å; L636-Q640 WeakPolarHBondContact O-CG 3.3Å; L636-Q640 PolarHBondContact O-N 2.68Å; L636-A678 HydrophobicContact CD1-CB 3.88Å; L636-A681 HydrophobicContact CD1-CB 4.35Å; L636-D683 HydrophobicContact CD1-CB 3.82Å; L636-D683 HydrophobicContact CD2-CB 4.07Å; L636-D683 HydrophobicContact CG-CB 4.49Å
637	D	89.4	Confident	90.7	Very high	75 Å²	75	25.2 Å²	25.2	40%	0.401	14%	0.135	S	C	.	.	H	α-helix	trans	-60	-36.2	179.7	-57.6	-18	0	0	0	111.8	C635 C641	C635-D637 PolarHBondContact O-N 2.8Å; D637-C641 VanDerWaalsContact O-CB 3.31Å; D637-C641 WeakPolarHBondContact O-CB 3.31Å; D637-C641 PolarHBondContact O-N 3.18Å
638	A	93	Very high	90.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-71.6	-42.3	175.7	0	0	0	0	0	112.2	L627 S630 A631 C635 L636 Q640 C641 L642	L627-A638 HydrophobicContact CD2-CB 3.92Å; S630-A638 VanDerWaalsContact OG-CB 3.27Å; S630-A638 WeakPolarHBondContact OG-CB 3.32Å; A631-A638 HydrophobicContact CB-CB 4.26Å; C635-A638 HydrophobicContact CB-CB 4.03Å; C635-A638 PolarHBondContact O-N 3.27Å; L636-A638 PolarHBondContact O-N 3.25Å; A638-Q640 VanDerWaalsContact C-N 3.31Å; A638-Q640 PolarHBondContact O-N 3.4Å; A638-C641 PolarHBondContact O-N 3.06Å; A638-L642 WeakPolarHBondContact O-CB 3.4Å; A638-L642 WeakPolarHBondContact O-CG 3.35Å; A638-L642 PolarHBondContact O-N 3.07Å
639	I	92	Very high	89.5	Confident	13 Å²	13	26 Å²	26	7%	0.067	14%	0.141	C	C	.	.	H	α-helix	trans	-60.6	-44.5	176.7	-62.9	166.4	0	0	0	109.9	A631 C635 L636 A643 L674 A677 A678	A631-I639 HydrophobicContact CB-CG1 3.76Å; C635-I639 WeakPolarHBondContact O-CG1 3.36Å; C635-I639 PolarHBondContact O-N 3.37Å; L636-I639 PolarHBondContact O-N 3.09Å; L636-I639 VanDerWaalsContact O-N 3.11Å; I639-A643 VanDerWaalsContact O-CB 3.25Å; I639-A643 WeakPolarHBondContact O-CB 3.41Å; I639-A643 PolarHBondContact O-N 3.38Å; I639-L674 HydrophobicContact CG2-CB 4.26Å; I639-L674 HydrophobicContact CG2-CD2 4.2Å; I639-L674 WeakPolarHBondContact CG2-O 3.15Å; I639-A677 HydrophobicContact CG2-CB 4.4Å; I639-A678 HydrophobicContact CG2-CB 3.82Å
640	Q	89.8	Confident	89	Confident	38 Å²	38	30 Å²	30	18%	0.178	16%	0.161	C	C	.	.	H	α-helix	trans	-63	-49.6	177.8	-73.9	177	-24.8	0	0	112.3	L636 A638 L642 A643 Q644 A678 D683	L636-Q640 HydrophobicContact CD1-CG 4.17Å; L636-Q640 HydrophobicContact CG-CG 4.35Å; L636-Q640 WeakPolarHBondContact O-CG 3.3Å; L636-Q640 PolarHBondContact O-N 2.68Å; A638-Q640 VanDerWaalsContact C-N 3.31Å; A638-Q640 PolarHBondContact O-N 3.4Å; Q640-L642 VanDerWaalsContact C-N 3.33Å; Q640-L642 PolarHBondContact O-N 2.98Å; Q640-A643 PolarHBondContact O-N 2.88Å; Q640-Q644 WeakPolarHBondContact O-CG 3.48Å; Q640-Q644 PolarHBondContact O-N 3.11Å; Q640-A678 HydrophobicContact CG-CB 4.49Å; Q640-D683 PolarHBondContact NE2-OD1 3.27Å; Q640-D683 PolarHBondContact NE2-OD2 2.87Å
641	C	91.9	Very high	88.5	Confident	3 Å²	3	31.6 Å²	31.6	2%	0.02	17%	0.171	C	C	.	.	H	α-helix	trans	-59.3	-44.1	179.4	-176	0	0	0	0	111.4	D637 A638 Y645 D652	D637-C641 VanDerWaalsContact O-CB 3.31Å; D637-C641 WeakPolarHBondContact O-CB 3.31Å; D637-C641 PolarHBondContact O-N 3.18Å; A638-C641 PolarHBondContact O-N 3.06Å; C641-Y645 WeakPolarHBondContact O-CB 3.33Å; C641-Y645 PolarHBondContact O-N 3.18Å; C641-D652 PolarHBondContact SG-O 3.24Å
642	L	92.5	Very high	88.1	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-67.8	-40.9	175.8	-70.8	174.5	0	0	0	112.5	L624 L627 E628 A631 A638 Q640 Q644 Y645 Y646 L655 L674	L624-L642 HydrophobicContact CD2-CD2 4.43Å; L627-L642 HydrophobicContact CB-CD1 4.18Å; L627-L642 HydrophobicContact CB-CD2 3.98Å; L627-L642 HydrophobicContact CB-CG 4.07Å; L627-L642 HydrophobicContact CD1-CD2 4.36Å; E628-L642 HydrophobicContact CG-CD1 4.35Å; A631-L642 HydrophobicContact CB-CD1 3.74Å; A638-L642 WeakPolarHBondContact O-CB 3.4Å; A638-L642 WeakPolarHBondContact O-CG 3.35Å; A638-L642 PolarHBondContact O-N 3.07Å; Q640-L642 VanDerWaalsContact C-N 3.33Å; Q640-L642 PolarHBondContact O-N 2.98Å; L642-Q644 VanDerWaalsContact C-N 3.33Å; L642-Q644 PolarHBondContact O-N 3.18Å; L642-Y645 PolarHBondContact O-N 3.25Å; L642-Y646 HydrophobicContact CB-CD2 4.32Å; L642-Y646 HydrophobicContact CB-CE2 4.4Å; L642-Y646 HydrophobicContact CD2-CE2 4.14Å; L642-Y646 WeakPolarHBondContact O-CD2 3.33Å; L642-Y646 PolarHBondContact O-N 3.03Å; L642-L655 HydrophobicContact CD2-CD1 3.82Å; L642-L674 HydrophobicContact CB-CD1 3.65Å; L642-L674 HydrophobicContact CB-CD2 4.48Å
643	A	90.3	Very high	88.1	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.1	-45.7	176.9	0	0	0	0	0	111.1	I639 Q640 L647 L674 I675	I639-A643 VanDerWaalsContact O-CB 3.25Å; I639-A643 WeakPolarHBondContact O-CB 3.41Å; I639-A643 PolarHBondContact O-N 3.38Å; Q640-A643 PolarHBondContact O-N 2.88Å; A643-L647 VanDerWaalsContact O-CB 3.24Å; A643-L647 WeakPolarHBondContact O-CB 3.47Å; A643-L647 VanDerWaalsContact O-CG 3.22Å; A643-L647 WeakPolarHBondContact O-CG 3.36Å; A643-L647 PolarHBondContact O-N 3.41Å; A643-L674 HydrophobicContact CB-CB 3.85Å; A643-I675 HydrophobicContact CB-CB 4.08Å; A643-I675 HydrophobicContact CB-CD1 4.01Å
644	Q	88.2	Confident	88.2	Confident	20 Å²	20	31.3 Å²	31.3	9%	0.093	18%	0.181	C	C	.	.	H	α-helix	trans	-61.7	-45	176	-69.5	166	-11.1	0	0	111.6	Q640 L642 L647 N648 L649 V651 F762	Q640-Q644 WeakPolarHBondContact O-CG 3.48Å; Q640-Q644 PolarHBondContact O-N 3.11Å; L642-Q644 VanDerWaalsContact C-N 3.33Å; L642-Q644 PolarHBondContact O-N 3.18Å; Q644-L647 PolarHBondContact O-N 2.95Å; Q644-N648 PolarHBondContact O-N 2.99Å; Q644-L649 HydrophobicContact CB-CB 4.3Å; Q644-L649 PolarHBondContact O-N 3.22Å; Q644-V651 HydrophobicContact CB-CB 4.48Å; Q644-V651 HydrophobicContact CB-CG2 4.22Å; Q644-F762 HydrophobicContact CG-CD1 3.95Å; Q644-F762 HydrophobicContact CG-CE1 3.93Å; Q644-F762 HydrophobicContact CG-CZ 4.48Å; Q644-F762 VanDerWaalsContact NE2-CE1 3.3Å
645	Y	90.8	Very high	88.6	Confident	16 Å²	16	29.1 Å²	29.1	6%	0.063	16%	0.157	C	C	.	.	H	α-helix	trans	-61	-49.4	179.3	174.7	-105.6	0	0	0	112.3	L624 C641 L642 N648 L655 C658 I660 P662	L624-Y645 HydrophobicContact CD2-CD1 4.41Å; L624-Y645 HydrophobicContact CD2-CE1 3.91Å; C641-Y645 WeakPolarHBondContact O-CB 3.33Å; C641-Y645 PolarHBondContact O-N 3.18Å; L642-Y645 PolarHBondContact O-N 3.25Å; Y645-N648 PolarHBondContact O-N 3.44Å; Y645-L655 HydrophobicContact CD1-CD1 3.99Å; Y645-L655 HydrophobicContact CD2-CB 4.24Å; Y645-L655 HydrophobicContact CD2-CD1 4.12Å; Y645-L655 HydrophobicContact CG-CD1 3.73Å; Y645-C658 HydrophobicContact CE2-CB 4.3Å; Y645-I660 VanDerWaalsContact CE2-O 3.31Å; Y645-I660 WeakPolarHBondContact CE2-O 3.18Å; Y645-I660 PolarHBondContact OH-O 3.01Å; Y645-P662 HydrophobicContact CD1-CB 4.46Å; Y645-P662 HydrophobicContact CD1-CG 4.47Å; Y645-P662 HydrophobicContact CE1-CB 3.8Å; Y645-P662 HydrophobicContact CE1-CG 4.11Å
646	Y	89.7	Confident	88.5	Confident	27 Å²	27	32.2 Å²	32.2	11%	0.106	18%	0.18	C	C	.	.	H	α-helix	trans	-73.6	-28.3	-179.6	-76.1	-65.2	0	0	0	113.9	L642 N648 P662 S667 H670 L674	L642-Y646 HydrophobicContact CB-CD2 4.32Å; L642-Y646 HydrophobicContact CB-CE2 4.4Å; L642-Y646 HydrophobicContact CD2-CE2 4.14Å; L642-Y646 WeakPolarHBondContact O-CD2 3.33Å; L642-Y646 PolarHBondContact O-N 3.03Å; Y646-N648 PolarHBondContact O-N 3.04Å; Y646-P662 HydrophobicContact CD1-CB 3.67Å; Y646-P662 HydrophobicContact CD1-CG 4.23Å; Y646-P662 HydrophobicContact CE1-CB 3.84Å; Y646-S667 WeakPolarHBondContact O-CB 3.49Å; Y646-H670 AromaticContact CD2-ND1 3.76Å; Y646-H670 AromaticContact CE1-ND1 3.73Å; Y646-H670 AromaticContact CE2-CE1 3.37Å; Y646-H670 WeakPolarHBondContact CE2-CE1 3.38Å; Y646-H670 AromaticContact CE2-ND1 3.27Å; Y646-H670 VanDerWaalsContact CE2-ND1 3.27Å; Y646-H670 WeakPolarHBondContact CE2-ND1 3.46Å; Y646-H670 AromaticContact CZ-CE1 3.59Å; Y646-H670 AromaticContact CZ-ND1 3.25Å; Y646-L674 HydrophobicContact CD2-CD1 3.63Å; Y646-L674 HydrophobicContact CE2-CD1 4.1Å
647	L	86.3	Confident	88.5	Confident	15 Å²	15	36.5 Å²	36.5	8%	0.079	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	4.7	173.7	-65	171.9	0	0	0	112.8	A643 Q644 L649 I675 Y689	A643-L647 VanDerWaalsContact O-CB 3.24Å; A643-L647 WeakPolarHBondContact O-CB 3.47Å; A643-L647 VanDerWaalsContact O-CG 3.22Å; A643-L647 WeakPolarHBondContact O-CG 3.36Å; A643-L647 PolarHBondContact O-N 3.41Å; Q644-L647 PolarHBondContact O-N 2.95Å; L647-L649 HydrophobicContact CB-CD1 3.62Å; L647-L649 HydrophobicContact CB-CG 3.69Å; L647-L649 HydrophobicContact CD1-CD1 3.97Å; L647-L649 HydrophobicContact CG-CD1 4.46Å; L647-L649 PolarHBondContact O-N 3.48Å; L647-I675 HydrophobicContact CD1-CB 4.18Å; L647-I675 HydrophobicContact CD1-CG2 4.16Å; L647-Y689 HydrophobicContact CD1-CE1 3.85Å
648	N	83.4	Confident	88.4	Confident	56 Å²	56	34 Å²	34	30%	0.299	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	38.2	-176.2	-166.8	36.3	0	0	0	112.4	Q644 Y645 Y646 P702 D703	Q644-N648 PolarHBondContact O-N 2.99Å; Y645-N648 PolarHBondContact O-N 3.44Å; Y646-N648 PolarHBondContact O-N 3.04Å; N648-P702 WeakPolarHBondContact O-CD 3.49Å; N648-P702 WeakPolarHBondContact O-CG 3.25Å; N648-D703 PolarHBondContact ND2-OD2 2.94Å
649	L	80.7	Confident	88.1	Confident	19 Å²	19	38.1 Å²	38.1	10%	0.099	21%	0.214	C	C	.	.			trans	-90.4	174.1	177.7	-58.7	170.5	0	0	0	110	Q644 L647 V651 Y689 F762	Q644-L649 HydrophobicContact CB-CB 4.3Å; Q644-L649 PolarHBondContact O-N 3.22Å; L647-L649 HydrophobicContact CB-CD1 3.62Å; L647-L649 HydrophobicContact CB-CG 3.69Å; L647-L649 HydrophobicContact CD1-CD1 3.97Å; L647-L649 HydrophobicContact CG-CD1 4.46Å; L647-L649 PolarHBondContact O-N 3.48Å; L649-V651 WeakPolarHBondContact O-CG2 3.02Å; L649-V651 PolarHBondContact O-N 3.39Å; L649-Y689 HydrophobicContact CD1-CE2 3.94Å; L649-Y689 HydrophobicContact CD2-CE2 4.42Å; L649-F762 HydrophobicContact CB-CB 4.21Å; L649-F762 HydrophobicContact CD1-CB 4Å; L649-F762 HydrophobicContact CD1-CD2 3.44Å; L649-F762 VanDerWaalsContact CD1-CD2 3.44Å; L649-F762 HydrophobicContact CD1-CE2 4.07Å; L649-F762 HydrophobicContact CD1-CG 3.86Å; L649-F762 HydrophobicContact CD2-CB 4.46Å; L649-F762 HydrophobicContact CG-CB 4.46Å
650	M	83	Confident	87.8	Confident	100 Å²	100	41.3 Å²	41.3	49%	0.493	23%	0.23	S	C	.	.			trans	-62.7	112	168.1	-71.4	-170.7	73.4	0	0	109.4	S760	M650-S760 VanDerWaalsContact CG-OG 3.3Å; M650-S760 WeakPolarHBondContact CG-OG 3.31Å; M650-S760 PolarHBondContact SD-OG 2.96Å
651	V	84.6	Confident	87.4	Confident	35 Å²	35	47.5 Å²	47.5	21%	0.212	26%	0.256	C	S	.	.			trans	-82.2	123.6	-178.1	-174.7	0	0	0	0	110	Q644 L649 L655 S656	Q644-V651 HydrophobicContact CB-CB 4.48Å; Q644-V651 HydrophobicContact CB-CG2 4.22Å; L649-V651 WeakPolarHBondContact O-CG2 3.02Å; L649-V651 PolarHBondContact O-N 3.39Å; V651-L655 HydrophobicContact CG1-CB 3.82Å; V651-S656 WeakPolarHBondContact O-CB 3.01Å
652	D	83.1	Confident	87	Confident	112 Å²	112	48.6 Å²	48.6	60%	0.599	26%	0.263	S	S	*	.			trans	-97.8	151.7	162.6	-165.5	8.5	0	0	0	109.6	C641	C641-D652 PolarHBondContact SG-O 3.24Å
653	G	88.1	Confident	86.5	Confident	29 Å²	29	53 Å²	53	30%	0.299	29%	0.287	S	S	.	.	S	Bend	trans	88.4	-157.8	-180	0	0	0	0	0	115.2	L655 S656	G653-L655 VanDerWaalsContact C-N 3.26Å; G653-L655 PolarHBondContact O-N 3.41Å; G653-L655 VanDerWaalsContact O-N 3.11Å; G653-S656 WeakPolarHBondContact O-CB 3.09Å; G653-S656 PolarHBondContact O-N 2.82Å; G653-S656 VanDerWaalsContact O-N 3.12Å; G653-S656 PolarHBondContact O-OG 3.5Å
654	P	91.7	Very high	85.8	Confident	8 Å²	8	58.3 Å²	58.3	5%	0.052	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-23.4	-165	-25.9	34.9	0	0	0	115.8	A567 R568 A571 W620 V623 L627	A567-P654 HydrophobicContact CB-CB 4.38Å; A567-P654 HydrophobicContact CB-CG 4.42Å; R568-P654 HydrophobicContact CB-CG 4.22Å; R568-P654 HydrophobicContact CG-CG 4.46Å; A571-P654 HydrophobicContact CB-CB 3.82Å; A571-P654 WeakPolarHBondContact CB-O 3.03Å; W620-P654 WeakPolarHBondContact CZ3-O 3.13Å; V623-P654 HydrophobicContact CG1-CB 3.98Å; L627-P654 HydrophobicContact CD1-CB 4.24Å; L627-P654 HydrophobicContact CD2-CG 4.25Å
655	L	92.5	Very high	85	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.016	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	5.2	179.7	-67.8	172.3	0	0	0	114.5	W620 V623 L624 L627 L642 Y645 V651 G653 E657 C658	W620-L655 HydrophobicContact CE3-CD2 4.1Å; W620-L655 HydrophobicContact CZ3-CD2 4.22Å; V623-L655 HydrophobicContact CG1-CD2 3.75Å; V623-L655 HydrophobicContact CG1-CG 4.37Å; L624-L655 HydrophobicContact CD2-CD1 3.82Å; L624-L655 HydrophobicContact CD2-CD2 3.86Å; L624-L655 HydrophobicContact CG-CD2 4.1Å; L627-L655 HydrophobicContact CD1-CD1 3.5Å; L627-L655 HydrophobicContact CD1-CD2 4.18Å; L627-L655 HydrophobicContact CD1-CG 3.45Å; L627-L655 VanDerWaalsContact CD1-CG 3.45Å; L642-L655 HydrophobicContact CD2-CD1 3.82Å; Y645-L655 HydrophobicContact CD1-CD1 3.99Å; Y645-L655 HydrophobicContact CD2-CB 4.24Å; Y645-L655 HydrophobicContact CD2-CD1 4.12Å; Y645-L655 HydrophobicContact CG-CD1 3.73Å; V651-L655 HydrophobicContact CG1-CB 3.82Å; G653-L655 VanDerWaalsContact C-N 3.26Å; G653-L655 PolarHBondContact O-N 3.41Å; G653-L655 VanDerWaalsContact O-N 3.11Å; L655-E657 VanDerWaalsContact C-N 3.25Å; L655-E657 PolarHBondContact O-N 3.14Å; L655-C658 HydrophobicContact CB-CB 4.23Å; L655-C658 HydrophobicContact CD2-CB 3.92Å; L655-C658 VanDerWaalsContact O-CB 3.25Å; L655-C658 WeakPolarHBondContact O-CB 3.16Å; L655-C658 PolarHBondContact O-N 3.2Å
656	S	89.4	Confident	84.1	Confident	74 Å²	74	69.9 Å²	69.9	52%	0.517	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-32.8	-177.5	49.3	0	0	0	0	114.7	V651 G653	V651-S656 WeakPolarHBondContact O-CB 3.01Å; G653-S656 WeakPolarHBondContact O-CB 3.09Å; G653-S656 PolarHBondContact O-N 2.82Å; G653-S656 VanDerWaalsContact O-N 3.12Å; G653-S656 PolarHBondContact O-OG 3.5Å
657	E	87.6	Confident	83.6	Confident	122 Å²	122	68.9 Å²	68.9	57%	0.57	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	13.6	178	-60.3	-172.9	172.1	0	0	113.2	P615 W620 L655 P659	P615-E657 HydrophobicContact CG-CB 4.16Å; W620-E657 VanDerWaalsContact CH2-C 3.48Å; W620-E657 HydrophobicContact CH2-CB 4.17Å; W620-E657 HydrophobicContact CZ2-CB 4.39Å; W620-E657 WeakPolarHBondContact CZ2-O 3.42Å; L655-E657 VanDerWaalsContact C-N 3.25Å; L655-E657 PolarHBondContact O-N 3.14Å; E657-P659 WeakPolarHBondContact O-CD 3.29Å
658	C	88.9	Confident	83.2	Confident	22 Å²	22	74.9 Å²	74.9	15%	0.149	40%	0.399	C	S	.	.			trans	-65.7	120.4	-177.3	-172.9	0	0	0	0	110.7	W620 Y645 L655 I660	W620-C658 HydrophobicContact CD2-CB 4.16Å; W620-C658 HydrophobicContact CE3-CB 3.63Å; W620-C658 HydrophobicContact CH2-CB 4.11Å; W620-C658 HydrophobicContact CZ3-CB 3.6Å; Y645-C658 HydrophobicContact CE2-CB 4.3Å; L655-C658 HydrophobicContact CB-CB 4.23Å; L655-C658 HydrophobicContact CD2-CB 3.92Å; L655-C658 VanDerWaalsContact O-CB 3.25Å; L655-C658 WeakPolarHBondContact O-CB 3.16Å; L655-C658 PolarHBondContact O-N 3.2Å; C658-I660 VanDerWaalsContact C-N 3.3Å
659	P	85.7	Confident	83.1	Confident	87 Å²	87	75.7 Å²	75.7	57%	0.565	41%	0.413	S	S	*	.			trans	-79.6	-15.2	179	32.6	-34.6	0	0	0	112.8	E657	E657-P659 WeakPolarHBondContact O-CD 3.29Å
660	I	85	Confident	83.5	Confident	80 Å²	80	77.6 Å²	77.6	41%	0.41	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-77	127.1	179.6	-54.6	176	0	0	0	107.5	W620 Y645 C658	W620-I660 HydrophobicContact CB-CD1 3.67Å; W620-I660 HydrophobicContact CB-CG1 4.47Å; W620-I660 HydrophobicContact CG-CD1 4.46Å; Y645-I660 VanDerWaalsContact CE2-O 3.31Å; Y645-I660 WeakPolarHBondContact CE2-O 3.18Å; Y645-I660 PolarHBondContact OH-O 3.01Å; C658-I660 VanDerWaalsContact C-N 3.3Å
661	K	82.4	Confident	83.8	Confident	168 Å²	168	72.9 Å²	72.9	73%	0.73	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-95.9	139.3	171.1	-67.2	-170.2	175.9	-167.7	0	109.5
662	P	83.5	Confident	83.9	Confident	26 Å²	26	74.4 Å²	74.4	17%	0.169	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-75.1	155	-179.5	36.4	-38.4	0	0	0	110.7	Y645 Y646 P664 S667	Y645-P662 HydrophobicContact CD1-CB 4.46Å; Y645-P662 HydrophobicContact CD1-CG 4.47Å; Y645-P662 HydrophobicContact CE1-CB 3.8Å; Y645-P662 HydrophobicContact CE1-CG 4.11Å; Y646-P662 HydrophobicContact CD1-CB 3.67Å; Y646-P662 HydrophobicContact CD1-CG 4.23Å; Y646-P662 HydrophobicContact CE1-CB 3.84Å; P662-P664 WeakPolarHBondContact O-CD 3.45Å; P662-S667 WeakPolarHBondContact CB-OG 3.46Å; P662-S667 WeakPolarHBondContact CG-OG 3.47Å
663	D	81.1	Confident	84.2	Confident	95 Å²	95	71.9 Å²	71.9	51%	0.508	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-64.9	122.5	-178.4	175.7	34.4	0	0	0	110.7	L665 E666 S667	D663-L665 PolarHBondContact O-N 3.02Å; D663-E666 PolarHBondContact O-N 3.07Å; D663-S667 VanDerWaalsContact C-OG 3.28Å; D663-S667 PolarHBondContact N-OG 3.28Å; D663-S667 VanDerWaalsContact O-CB 3.22Å; D663-S667 WeakPolarHBondContact O-CB 3.38Å; D663-S667 PolarHBondContact O-N 2.89Å; D663-S667 PolarHBondContact O-OG 3.28Å
664	P	75.3	Confident	84.5	Confident	111 Å²	111	71.4 Å²	71.4	72%	0.721	39%	0.387	S	S	*	.	H	α-helix	trans	-53	-33.8	-172.6	-30.6	35.9	0	0	0	115.2	P662	P662-P664 WeakPolarHBondContact O-CD 3.45Å
665	L	72	Confident	84.4	Confident	152 Å²	152	71 Å²	71	80%	0.796	39%	0.385	S	S	*	.	H	α-helix	trans	-73.5	-45.2	-176.6	-173.9	63.9	0	0	0	112.5	D663	D663-L665 PolarHBondContact O-N 3.02Å
666	E	72.4	Confident	84.4	Confident	126 Å²	126	72.2 Å²	72.2	59%	0.589	39%	0.393	S	S	*	.	H	α-helix	trans	-76.6	-33.3	179.5	-171.6	172.8	-173.3	0	0	112	D663 R668 A669 H670	D663-E666 PolarHBondContact O-N 3.07Å; E666-R668 PolarHBondContact O-N 3.1Å; E666-A669 PolarHBondContact O-N 3.5Å; E666-H670 WeakPolarHBondContact O-CB 3.25Å; E666-H670 PolarHBondContact O-N 3Å; E666-H670 VanDerWaalsContact O-N 3.08Å
667	S	79.7	Confident	84.5	Confident	7 Å²	7	70.8 Å²	70.8	5%	0.049	39%	0.386	C	S	.	.	H	α-helix	trans	-59.2	-44.9	-171.4	-64.1	0	0	0	0	113.6	Y646 P662 D663 G671	Y646-S667 WeakPolarHBondContact O-CB 3.49Å; P662-S667 WeakPolarHBondContact CB-OG 3.46Å; P662-S667 WeakPolarHBondContact CG-OG 3.47Å; D663-S667 VanDerWaalsContact C-OG 3.28Å; D663-S667 PolarHBondContact N-OG 3.28Å; D663-S667 VanDerWaalsContact O-CB 3.22Å; D663-S667 WeakPolarHBondContact O-CB 3.38Å; D663-S667 PolarHBondContact O-N 2.89Å; D663-S667 PolarHBondContact O-OG 3.28Å; S667-G671 PolarHBondContact O-N 3.1Å
668	R	76.5	Confident	84.6	Confident	140 Å²	140	65 Å²	65	53%	0.528	36%	0.359	S	S	.	.	H	α-helix	trans	-64.8	-49.8	-175.4	-173.2	-176.1	-67.9	157.3	-2	111.9	E666 F672 E715	E666-R668 PolarHBondContact O-N 3.1Å; R668-F672 WeakPolarHBondContact O-CB 3.39Å; R668-F672 PolarHBondContact O-N 3.16Å; R668-E715 IonicContact NH1-OE2 3.56Å
669	A	82.7	Confident	84.8	Confident	73 Å²	73	63.9 Å²	63.9	60%	0.603	35%	0.352	S	S	*	.	H	α-helix	trans	-66.5	-42	-178.4	0	0	0	0	0	111.3	E666 F672 A673	E666-A669 PolarHBondContact O-N 3.5Å; A669-F672 PolarHBondContact O-N 3.21Å; A669-A673 PolarHBondContact O-N 3.25Å
670	H	88.8	Confident	85	Confident	60 Å²	60	63.9 Å²	63.9	28%	0.278	35%	0.354	S	S	.	.	H	α-helix	trans	-67.8	-46.9	179.6	-169.8	-169.7	0	0	0	111.9	Y646 E666 F672 A673 L674	Y646-H670 AromaticContact CD2-ND1 3.76Å; Y646-H670 AromaticContact CE1-ND1 3.73Å; Y646-H670 AromaticContact CE2-CE1 3.37Å; Y646-H670 WeakPolarHBondContact CE2-CE1 3.38Å; Y646-H670 AromaticContact CE2-ND1 3.27Å; Y646-H670 VanDerWaalsContact CE2-ND1 3.27Å; Y646-H670 WeakPolarHBondContact CE2-ND1 3.46Å; Y646-H670 AromaticContact CZ-CE1 3.59Å; Y646-H670 AromaticContact CZ-ND1 3.25Å; E666-H670 WeakPolarHBondContact O-CB 3.25Å; E666-H670 PolarHBondContact O-N 3Å; E666-H670 VanDerWaalsContact O-N 3.08Å; H670-F672 VanDerWaalsContact C-N 3.29Å; H670-F672 PolarHBondContact O-N 3.32Å; H670-A673 PolarHBondContact O-N 3.48Å; H670-L674 WeakPolarHBondContact O-CG 3.22Å; H670-L674 PolarHBondContact O-N 3.22Å
671	G	88.3	Confident	85	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-58.5	-40	175.4	0	0	0	0	0	112.5	S667 L674 I675	S667-G671 PolarHBondContact O-N 3.1Å; G671-L674 PolarHBondContact O-N 2.95Å; G671-I675 PolarHBondContact O-N 3.18Å
672	F	86.2	Confident	85.2	Confident	68 Å²	68	56.7 Å²	56.7	30%	0.298	34%	0.34	S	S	.	.	H	α-helix	trans	-66.6	-39.6	176.4	-171.5	-102.2	0	0	0	113.1	R668 A669 H670 I675 S676 L690 Y699	R668-F672 WeakPolarHBondContact O-CB 3.39Å; R668-F672 PolarHBondContact O-N 3.16Å; A669-F672 PolarHBondContact O-N 3.21Å; H670-F672 VanDerWaalsContact C-N 3.29Å; H670-F672 PolarHBondContact O-N 3.32Å; F672-I675 HydrophobicContact CD2-CG2 4.31Å; F672-I675 WeakPolarHBondContact O-CG2 3.24Å; F672-S676 VanDerWaalsContact O-CB 3.28Å; F672-S676 WeakPolarHBondContact O-CB 3.11Å; F672-S676 PolarHBondContact O-N 2.95Å; F672-S676 PolarHBondContact O-OG 3.01Å; F672-L690 HydrophobicContact CD2-CD2 4.17Å; F672-L690 HydrophobicContact CE2-CD2 3.42Å; F672-L690 VanDerWaalsContact CE2-CD2 3.42Å; F672-L690 HydrophobicContact CZ-CD2 3.97Å; F672-Y699 HydrophobicContact CD2-CD1 4.15Å; F672-Y699 AromaticContact CD2-CE1 3.78Å; F672-Y699 HydrophobicContact CD2-CE1 3.78Å; F672-Y699 HydrophobicContact CE2-CD1 4.11Å; F672-Y699 AromaticContact CE2-CE1 3.38Å; F672-Y699 HydrophobicContact CE2-CE1 3.38Å; F672-Y699 HydrophobicContact CZ-CE1 4.21Å
673	A	91.1	Very high	85.4	Confident	59 Å²	59	55.6 Å²	55.6	49%	0.488	33%	0.333	S	S	.	.	H	α-helix	trans	-63.5	-42.5	174.8	0	0	0	0	0	111.5	A669 H670 S676 A677	A669-A673 PolarHBondContact O-N 3.25Å; H670-A673 PolarHBondContact O-N 3.48Å; A673-S676 PolarHBondContact O-N 3.2Å; A673-A677 WeakPolarHBondContact O-CB 3.48Å; A673-A677 PolarHBondContact O-N 3.07Å
674	L	93	Very high	85.8	Confident	18 Å²	18	51.7 Å²	51.7	9%	0.094	31%	0.311	C	S	.	.	H	α-helix	trans	-65.3	-47	178.4	-72	163.2	0	0	0	112.1	I639 L642 A643 Y646 H670 G671 S676 A677 A678	I639-L674 HydrophobicContact CG2-CB 4.26Å; I639-L674 HydrophobicContact CG2-CD2 4.2Å; I639-L674 WeakPolarHBondContact CG2-O 3.15Å; L642-L674 HydrophobicContact CB-CD1 3.65Å; L642-L674 HydrophobicContact CB-CD2 4.48Å; A643-L674 HydrophobicContact CB-CB 3.85Å; Y646-L674 HydrophobicContact CD2-CD1 3.63Å; Y646-L674 HydrophobicContact CE2-CD1 4.1Å; H670-L674 WeakPolarHBondContact O-CG 3.22Å; H670-L674 PolarHBondContact O-N 3.22Å; G671-L674 PolarHBondContact O-N 2.95Å; L674-S676 VanDerWaalsContact C-N 3.31Å; L674-S676 PolarHBondContact O-N 3.03Å; L674-A677 WeakPolarHBondContact O-CB 2.93Å; L674-A677 PolarHBondContact O-N 3.31Å; L674-A677 VanDerWaalsContact O-N 3.15Å; L674-A678 PolarHBondContact O-N 3.07Å
675	I	90.8	Very high	86.2	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-66.7	-35.4	179.2	-160.9	66.8	0	0	0	111.5	A643 L647 G671 F672 A677 A678 A679 A686 Y689 L690 F762	A643-I675 HydrophobicContact CB-CB 4.08Å; A643-I675 HydrophobicContact CB-CD1 4.01Å; L647-I675 HydrophobicContact CD1-CB 4.18Å; L647-I675 HydrophobicContact CD1-CG2 4.16Å; G671-I675 PolarHBondContact O-N 3.18Å; F672-I675 HydrophobicContact CD2-CG2 4.31Å; F672-I675 WeakPolarHBondContact O-CG2 3.24Å; I675-A677 VanDerWaalsContact C-N 3.33Å; I675-A677 PolarHBondContact O-N 3.42Å; I675-A678 PolarHBondContact O-N 3.34Å; I675-A679 WeakPolarHBondContact O-CB 3.27Å; I675-A679 PolarHBondContact O-N 3.08Å; I675-A686 HydrophobicContact CD1-CB 3.46Å; I675-A686 VanDerWaalsContact CD1-CB 3.46Å; I675-A686 HydrophobicContact CG1-CB 3.84Å; I675-A686 WeakPolarHBondContact O-CB 3.41Å; I675-Y689 HydrophobicContact CG1-CD1 3.78Å; I675-Y689 HydrophobicContact CG1-CE1 4.41Å; I675-Y689 HydrophobicContact CG1-CG 4.38Å; I675-Y689 HydrophobicContact CG2-CD1 4.23Å; I675-Y689 HydrophobicContact CG2-CE1 4.26Å; I675-L690 HydrophobicContact CG2-CD2 3.87Å; I675-L690 HydrophobicContact CG2-CG 4.39Å; I675-F762 HydrophobicContact CD1-CE2 3.68Å; I675-F762 HydrophobicContact CD1-CZ 3.59Å; I675-F762 HydrophobicContact CG1-CE2 4.44Å
676	S	92.5	Very high	87.1	Confident	28 Å²	28	40 Å²	40	20%	0.196	24%	0.243	C	C	.	.	H	α-helix	trans	-62.8	-39.7	172	-60.2	0	0	0	0	112.2	F672 A673 L674 S680	F672-S676 VanDerWaalsContact O-CB 3.28Å; F672-S676 WeakPolarHBondContact O-CB 3.11Å; F672-S676 PolarHBondContact O-N 2.95Å; F672-S676 PolarHBondContact O-OG 3.01Å; A673-S676 PolarHBondContact O-N 3.2Å; L674-S676 VanDerWaalsContact C-N 3.31Å; L674-S676 PolarHBondContact O-N 3.03Å; S676-S680 WeakPolarHBondContact O-CB 3.2Å; S676-S680 PolarHBondContact O-N 3.44Å; S676-S680 PolarHBondContact O-OG 3.44Å
677	A	91.3	Very high	88	Confident	44 Å²	44	34.2 Å²	34.2	36%	0.364	22%	0.216	S	C	.	.	H	α-helix	trans	-65.9	-42.8	174.7	0	0	0	0	0	111.9	I639 A673 L674 I675 S680 A681	I639-A677 HydrophobicContact CG2-CB 4.4Å; A673-A677 WeakPolarHBondContact O-CB 3.48Å; A673-A677 PolarHBondContact O-N 3.07Å; L674-A677 WeakPolarHBondContact O-CB 2.93Å; L674-A677 PolarHBondContact O-N 3.31Å; L674-A677 VanDerWaalsContact O-N 3.15Å; I675-A677 VanDerWaalsContact C-N 3.33Å; I675-A677 PolarHBondContact O-N 3.42Å; A677-S680 PolarHBondContact O-N 2.86Å; A677-A681 WeakPolarHBondContact O-CB 3.32Å; A677-A681 PolarHBondContact O-N 2.86Å
678	A	90.3	Very high	88.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.7	-46.9	175.1	0	0	0	0	0	111.8	L636 I639 Q640 L674 I675 S680 A681 G682 D683 A686	L636-A678 HydrophobicContact CD1-CB 3.88Å; I639-A678 HydrophobicContact CG2-CB 3.82Å; Q640-A678 HydrophobicContact CG-CB 4.49Å; L674-A678 PolarHBondContact O-N 3.07Å; I675-A678 PolarHBondContact O-N 3.34Å; A678-S680 VanDerWaalsContact C-N 3.32Å; A678-S680 PolarHBondContact O-N 3.42Å; A678-A681 CarbonylContact O-C 3.46Å; A678-A681 WeakPolarHBondContact O-CA 3.41Å; A678-A681 WeakPolarHBondContact O-CB 3.37Å; A678-A681 PolarHBondContact O-N 3Å; A678-A681 VanDerWaalsContact O-N 3.07Å; A678-G682 PolarHBondContact O-N 3.28Å; A678-D683 HydrophobicContact CB-CB 4.22Å; A678-D683 WeakPolarHBondContact O-CB 3.11Å; A678-D683 PolarHBondContact O-N 3.5Å; A678-A686 HydrophobicContact CB-CB 3.59Å
679	A	92.3	Very high	89.1	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.5	-43	177.9	0	0	0	0	0	111.3	I675 A681 G682 A686 M687 L690 W728	I675-A679 WeakPolarHBondContact O-CB 3.27Å; I675-A679 PolarHBondContact O-N 3.08Å; A679-A681 PolarHBondContact O-N 2.96Å; A679-G682 PolarHBondContact O-N 3.21Å; A679-G682 VanDerWaalsContact O-N 3.07Å; A679-A686 HydrophobicContact CB-CB 3.77Å; A679-A686 VanDerWaalsContact N-CB 3.31Å; A679-M687 HydrophobicContact CB-CG 3.92Å; A679-M687 WeakPolarHBondContact O-CE 3.38Å; A679-L690 HydrophobicContact CB-CD1 3.43Å; A679-L690 VanDerWaalsContact CB-CD1 3.43Å; A679-W728 HydrophobicContact CB-CE3 4.09Å; A679-W728 HydrophobicContact CB-CH2 3.84Å; A679-W728 HydrophobicContact CB-CZ2 4.47Å; A679-W728 HydrophobicContact CB-CZ3 3.62Å
680	S	90	Very high	89.5	Confident	87 Å²	87	23.8 Å²	23.8	61%	0.608	16%	0.16	S	C	*	.	H	α-helix	trans	-64	-29.8	175.5	-56.7	0	0	0	0	112.8	S676 A677 A678 G682	S676-S680 WeakPolarHBondContact O-CB 3.2Å; S676-S680 PolarHBondContact O-N 3.44Å; S676-S680 PolarHBondContact O-OG 3.44Å; A677-S680 PolarHBondContact O-N 2.86Å; A678-S680 VanDerWaalsContact C-N 3.32Å; A678-S680 PolarHBondContact O-N 3.42Å; S680-G682 PolarHBondContact O-N 3.4Å
681	A	85.6	Confident	89.6	Confident	66 Å²	66	21 Å²	21	55%	0.545	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	6.2	175.1	0	0	0	0	0	113.8	L636 A677 A678 A679	L636-A681 HydrophobicContact CD1-CB 4.35Å; A677-A681 WeakPolarHBondContact O-CB 3.32Å; A677-A681 PolarHBondContact O-N 2.86Å; A678-A681 CarbonylContact O-C 3.46Å; A678-A681 WeakPolarHBondContact O-CA 3.41Å; A678-A681 WeakPolarHBondContact O-CB 3.37Å; A678-A681 PolarHBondContact O-N 3Å; A678-A681 VanDerWaalsContact O-N 3.07Å; A679-A681 PolarHBondContact O-N 2.96Å
682	G	86.4	Confident	89.7	Confident	30 Å²	30	21.1 Å²	21.1	31%	0.309	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.8	12.1	178.1	0	0	0	0	0	113.9	A678 A679 S680 R684	A678-G682 PolarHBondContact O-N 3.28Å; A679-G682 PolarHBondContact O-N 3.21Å; A679-G682 VanDerWaalsContact O-N 3.07Å; S680-G682 PolarHBondContact O-N 3.4Å; G682-R684 PolarHBondContact O-N 3.24Å
683	D	87.7	Confident	89.8	Confident	3 Å²	3	17.9 Å²	17.9	2%	0.016	13%	0.134	C	C	.	.			trans	-78.4	107.1	178.2	-175.7	-135.4	0	0	0	112.8	R359 L636 Q640 A678 M685 A686 M687	R359-D683 IonicContact NH1-OD2 2.66Å; R359-D683 PolarHBondContact NH1-OD2 3.24Å; L636-D683 HydrophobicContact CD1-CB 3.82Å; L636-D683 HydrophobicContact CD2-CB 4.07Å; L636-D683 HydrophobicContact CG-CB 4.49Å; Q640-D683 PolarHBondContact NE2-OD1 3.27Å; Q640-D683 PolarHBondContact NE2-OD2 2.87Å; A678-D683 HydrophobicContact CB-CB 4.22Å; A678-D683 WeakPolarHBondContact O-CB 3.11Å; A678-D683 PolarHBondContact O-N 3.5Å; D683-M685 PolarHBondContact O-N 2.8Å; D683-M685 VanDerWaalsContact OD1-CB 3.29Å; D683-M685 WeakPolarHBondContact OD1-CB 3.48Å; D683-A686 HydrophobicContact CB-CB 4.07Å; D683-A686 PolarHBondContact O-N 2.95Å; D683-A686 WeakPolarHBondContact OD1-CB 3.49Å; D683-A686 PolarHBondContact OD1-N 2.9Å; D683-M687 VanDerWaalsContact O-CG 3.29Å; D683-M687 WeakPolarHBondContact O-CG 3.48Å; D683-M687 PolarHBondContact O-N 3.25Å
684	R	89.1	Confident	89.8	Confident	14 Å²	14	15.9 Å²	15.9	5%	0.053	11%	0.114	C	C	.	.	H	α-helix	trans	-51.7	-40.1	176.9	-170.7	179	-173	-93.1	1.5	112.5	G682 M687 V688 A732 V735 S766 W768 L773	G682-R684 PolarHBondContact O-N 3.24Å; R684-M687 WeakPolarHBondContact O-CB 3.49Å; R684-M687 PolarHBondContact O-N 3.37Å; R684-V688 WeakPolarHBondContact O-CG2 3.4Å; R684-V688 PolarHBondContact O-N 2.98Å; R684-A732 HydrophobicContact CG-CB 4.15Å; R684-A732 PolarHBondContact NE-O 2.56Å; R684-V735 HydrophobicContact CB-CB 4.08Å; R684-V735 HydrophobicContact CB-CG1 4.05Å; R684-V735 HydrophobicContact CB-CG2 4.13Å; R684-V735 HydrophobicContact CG-CB 4.22Å; R684-S766 PolarHBondContact NH1-O 3.47Å; R684-W768 PolarHBondContact NH1-O 3.37Å; R684-W768 VanDerWaalsContact NH1-O 3.1Å; R684-W768 PolarHBondContact NH2-O 3.4Å; R684-L773 VanDerWaalsContact NH2-CD1 3.29Å
685	M	84.4	Confident	89.7	Confident	18 Å²	18	16.3 Å²	16.3	9%	0.089	12%	0.115	C	C	.	.	H	α-helix	trans	-61.4	-52.4	-178.5	-95.4	-94	61.4	0	0	112	D683 M687 V688 Y689 F762 L765 S766	D683-M685 PolarHBondContact O-N 2.8Å; D683-M685 VanDerWaalsContact OD1-CB 3.29Å; D683-M685 WeakPolarHBondContact OD1-CB 3.48Å; M685-M687 VanDerWaalsContact C-N 3.29Å; M685-M687 PolarHBondContact O-N 3.4Å; M685-V688 PolarHBondContact O-N 3.28Å; M685-Y689 PolarHBondContact O-N 3.25Å; M685-F762 HydrophobicContact CE-CE1 4.49Å; M685-F762 WeakPolarHBondContact CE-O 3.42Å; M685-F762 HydrophobicContact SD-CD1 4.24Å; M685-F762 HydrophobicContact SD-CE1 4.03Å; M685-L765 HydrophobicContact CE-CB 3.95Å; M685-S766 WeakPolarHBondContact CG-OG 3.48Å; M685-S766 VanDerWaalsContact SD-CA 3.58Å; M685-S766 WeakPolarHBondContact SD-CB 3.34Å; M685-S766 PolarHBondContact SD-OG 2.99Å
686	A	89.4	Confident	89.6	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.6	-37.5	174.3	0	0	0	0	0	113.1	I675 A678 A679 D683 Y689 L690	I675-A686 HydrophobicContact CD1-CB 3.46Å; I675-A686 VanDerWaalsContact CD1-CB 3.46Å; I675-A686 HydrophobicContact CG1-CB 3.84Å; I675-A686 WeakPolarHBondContact O-CB 3.41Å; A678-A686 HydrophobicContact CB-CB 3.59Å; A679-A686 HydrophobicContact CB-CB 3.77Å; A679-A686 VanDerWaalsContact N-CB 3.31Å; D683-A686 HydrophobicContact CB-CB 4.07Å; D683-A686 PolarHBondContact O-N 2.95Å; D683-A686 WeakPolarHBondContact OD1-CB 3.49Å; D683-A686 PolarHBondContact OD1-N 2.9Å; A686-Y689 PolarHBondContact O-N 3.4Å; A686-L690 WeakPolarHBondContact O-CG 3.46Å; A686-L690 PolarHBondContact O-N 2.91Å
687	M	92.2	Very high	89.1	Confident	3 Å²	3	19.3 Å²	19.3	2%	0.015	13%	0.128	C	C	.	.	H	α-helix	trans	-61.2	-49.5	174.9	-65.2	169.1	-179.9	0	0	111.6	A679 D683 R684 M685 Y689 L690 A691 W728 M731 A732 V735	A679-M687 HydrophobicContact CB-CG 3.92Å; A679-M687 WeakPolarHBondContact O-CE 3.38Å; D683-M687 VanDerWaalsContact O-CG 3.29Å; D683-M687 WeakPolarHBondContact O-CG 3.48Å; D683-M687 PolarHBondContact O-N 3.25Å; R684-M687 WeakPolarHBondContact O-CB 3.49Å; R684-M687 PolarHBondContact O-N 3.37Å; M685-M687 VanDerWaalsContact C-N 3.29Å; M685-M687 PolarHBondContact O-N 3.4Å; M687-Y689 VanDerWaalsContact C-N 3.32Å; M687-Y689 PolarHBondContact O-N 3.1Å; M687-L690 PolarHBondContact O-N 3.01Å; M687-A691 WeakPolarHBondContact O-CB 3.08Å; M687-A691 PolarHBondContact O-N 3.08Å; M687-W728 HydrophobicContact CB-CE3 4.26Å; M687-W728 HydrophobicContact CG-CE3 3.87Å; M687-W728 HydrophobicContact CG-CZ3 4.19Å; M687-W728 WeakPolarHBondContact O-CB 3.42Å; M687-M731 HydrophobicContact CE-CB 4.07Å; M687-M731 HydrophobicContact CE-CE 3.93Å; M687-M731 HydrophobicContact CG-CB 4.41Å; M687-M731 VanDerWaalsContact SD-C 3.57Å; M687-M731 HydrophobicContact SD-CB 3.67Å; M687-A732 HydrophobicContact CB-CB 3.84Å; M687-A732 HydrophobicContact SD-CB 4.39Å; M687-V735 HydrophobicContact CE-CG2 4.36Å; M687-V735 HydrophobicContact SD-CG2 3.99Å
688	V	90.1	Very high	88.3	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64	-39.8	179.7	-178.8	0	0	0	0	111	R684 M685 L690 A691 E692 A732 L765 L773	R684-V688 WeakPolarHBondContact O-CG2 3.4Å; R684-V688 PolarHBondContact O-N 2.98Å; M685-V688 PolarHBondContact O-N 3.28Å; V688-L690 PolarHBondContact O-N 3.27Å; V688-A691 WeakPolarHBondContact O-CB 3.4Å; V688-A691 PolarHBondContact O-N 2.98Å; V688-E692 PolarHBondContact O-N 2.69Å; V688-A732 HydrophobicContact CG2-CB 3.68Å; V688-L765 HydrophobicContact CB-CB 4.46Å; V688-L765 HydrophobicContact CG1-CB 3.8Å; V688-L765 HydrophobicContact CG1-CD2 4.25Å; V688-L765 HydrophobicContact CG1-CG 4.41Å; V688-L773 HydrophobicContact CG1-CD2 4.22Å; V688-L773 HydrophobicContact CG2-CD1 4.47Å; V688-L773 HydrophobicContact CG2-CD2 3.94Å
689	Y	88.6	Confident	87.1	Confident	1 Å²	1	25.4 Å²	25.4	0%	0.004	15%	0.146	C	C	.	.	H	α-helix	trans	-59.3	-48.1	175.2	178.7	-91.6	0	0	0	112.3	L647 L649 I675 M685 A686 M687 A691 E692 A693 Y700 F762 L765	L647-Y689 HydrophobicContact CD1-CE1 3.85Å; L649-Y689 HydrophobicContact CD1-CE2 3.94Å; L649-Y689 HydrophobicContact CD2-CE2 4.42Å; I675-Y689 HydrophobicContact CG1-CD1 3.78Å; I675-Y689 HydrophobicContact CG1-CE1 4.41Å; I675-Y689 HydrophobicContact CG1-CG 4.38Å; I675-Y689 HydrophobicContact CG2-CD1 4.23Å; I675-Y689 HydrophobicContact CG2-CE1 4.26Å; M685-Y689 PolarHBondContact O-N 3.25Å; A686-Y689 PolarHBondContact O-N 3.4Å; M687-Y689 VanDerWaalsContact C-N 3.32Å; M687-Y689 PolarHBondContact O-N 3.1Å; Y689-A691 VanDerWaalsContact C-N 3.31Å; Y689-A691 PolarHBondContact O-N 3.39Å; Y689-E692 PolarHBondContact O-N 3.24Å; Y689-A693 WeakPolarHBondContact O-CB 3.29Å; Y689-A693 PolarHBondContact O-N 3.44Å; Y689-Y700 HydrophobicContact CE2-CD2 4.41Å; Y689-Y700 PolarHBondContact OH-O 3.18Å; Y689-F762 AromaticContact CD2-CD2 3.47Å; Y689-F762 HydrophobicContact CD2-CD2 3.47Å; Y689-F762 VanDerWaalsContact CD2-CD2 3.47Å; Y689-F762 AromaticContact CD2-CE2 3.75Å; Y689-F762 HydrophobicContact CD2-CE2 3.75Å; Y689-F762 HydrophobicContact CE2-CD2 4.09Å; Y689-F762 AromaticContact CG-CD2 3.95Å; Y689-F762 HydrophobicContact CG-CD2 3.95Å; Y689-F762 AromaticContact CG-CE2 3.72Å; Y689-F762 HydrophobicContact CG-CE2 3.72Å; Y689-L765 HydrophobicContact CD2-CD1 4.32Å
690	L	90.6	Very high	85.3	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-64.5	-38	176.5	-71.5	173.4	0	0	0	111.5	F672 I675 A679 A686 M687 V688 A693 N694 W728	F672-L690 HydrophobicContact CD2-CD2 4.17Å; F672-L690 HydrophobicContact CE2-CD2 3.42Å; F672-L690 VanDerWaalsContact CE2-CD2 3.42Å; F672-L690 HydrophobicContact CZ-CD2 3.97Å; I675-L690 HydrophobicContact CG2-CD2 3.87Å; I675-L690 HydrophobicContact CG2-CG 4.39Å; A679-L690 HydrophobicContact CB-CD1 3.43Å; A679-L690 VanDerWaalsContact CB-CD1 3.43Å; A686-L690 WeakPolarHBondContact O-CG 3.46Å; A686-L690 PolarHBondContact O-N 2.91Å; M687-L690 PolarHBondContact O-N 3.01Å; V688-L690 PolarHBondContact O-N 3.27Å; L690-A693 PolarHBondContact O-N 3.47Å; L690-N694 WeakPolarHBondContact O-CB 3.44Å; L690-N694 PolarHBondContact O-N 3.2Å; L690-N694 PolarHBondContact O-ND2 3.35Å; L690-W728 HydrophobicContact CB-CD2 4.27Å; L690-W728 HydrophobicContact CB-CG 3.93Å; L690-W728 HydrophobicContact CD1-CD2 4.18Å; L690-W728 HydrophobicContact CD1-CH2 4.37Å; L690-W728 HydrophobicContact CD1-CZ2 3.84Å
691	A	92.5	Very high	83.5	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.5	-49.3	177.7	0	0	0	0	0	111.5	M687 V688 Y689 N694 Y695 A725 W728 Y729	M687-A691 WeakPolarHBondContact O-CB 3.08Å; M687-A691 PolarHBondContact O-N 3.08Å; V688-A691 WeakPolarHBondContact O-CB 3.4Å; V688-A691 PolarHBondContact O-N 2.98Å; Y689-A691 VanDerWaalsContact C-N 3.31Å; Y689-A691 PolarHBondContact O-N 3.39Å; A691-N694 PolarHBondContact O-N 2.91Å; A691-Y695 VanDerWaalsContact O-CB 3.29Å; A691-Y695 WeakPolarHBondContact O-CB 3.45Å; A691-Y695 PolarHBondContact O-N 3.33Å; A691-A725 WeakPolarHBondContact O-CB 3.36Å; A691-W728 HydrophobicContact CB-CB 3.72Å; A691-Y729 HydrophobicContact CB-CD1 3.58Å; A691-Y729 HydrophobicContact CB-CD2 3.71Å; A691-Y729 HydrophobicContact CB-CE1 3.54Å; A691-Y729 HydrophobicContact CB-CE2 3.67Å; A691-Y729 HydrophobicContact CB-CG 3.63Å
692	E	89.8	Confident	81.5	Confident	4 Å²	4	27.6 Å²	27.6	2%	0.019	14%	0.142	C	C	.	.	H	α-helix	trans	-64.3	-42.6	177.6	-84.5	-79.3	116.6	0	0	112.6	V688 Y689 N694 Y695 H696 Y700 Y729 L765 W768 R776	V688-E692 PolarHBondContact O-N 2.69Å; Y689-E692 PolarHBondContact O-N 3.24Å; E692-N694 PolarHBondContact O-N 3.2Å; E692-Y695 PolarHBondContact O-N 3.26Å; E692-H696 PolarHBondContact O-CD2 3.21Å; E692-H696 PolarHBondContact O-N 3.42Å; E692-H696 IonicContact OE2-CD2 2.7Å; E692-H696 IonicContact OE2-NE2 3.92Å; E692-Y700 HydrophobicContact CB-CE2 4.19Å; E692-Y700 PolarHBondContact OE2-OH 3.45Å; E692-Y729 WeakPolarHBondContact CG-OH 3.28Å; E692-Y729 PolarHBondContact OE1-OH 3.45Å; E692-L765 HydrophobicContact CB-CD1 4.33Å; E692-L765 HydrophobicContact CG-CD1 4.28Å; E692-L765 HydrophobicContact CG-CD2 3.8Å; E692-W768 HydrophobicContact CG-CH2 4.27Å; E692-W768 WeakPolarHBondContact OE1-CH2 3.34Å; E692-R776 IonicContact OE1-CZ 3.6Å; E692-R776 IonicContact OE1-NH1 3.14Å; E692-R776 PolarHBondContact OE1-NH1 3.21Å; E692-R776 IonicContact OE1-NH2 2.67Å
693	A	87.5	Confident	79.7	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.4	-42.5	177.6	0	0	0	0	0	112.3	Y689 L690 G697 Y699	Y689-A693 WeakPolarHBondContact O-CB 3.29Å; Y689-A693 PolarHBondContact O-N 3.44Å; L690-A693 PolarHBondContact O-N 3.47Å; A693-G697 PolarHBondContact O-N 2.97Å; A693-Y699 HydrophobicContact CB-CD1 3.52Å; A693-Y699 HydrophobicContact CB-CE1 3.9Å; A693-Y699 HydrophobicContact CB-CG 4.39Å
694	N	91.1	Very high	77.8	Confident	16 Å²	16	34.8 Å²	34.8	9%	0.086	18%	0.177	C	C	.	.	H	α-helix	trans	-71.8	-30.7	176.4	-76.3	-74.5	0	0	0	112.3	L690 A691 E692 P720 D721 A724 A725	L690-N694 WeakPolarHBondContact O-CB 3.44Å; L690-N694 PolarHBondContact O-N 3.2Å; L690-N694 PolarHBondContact O-ND2 3.35Å; A691-N694 PolarHBondContact O-N 2.91Å; E692-N694 PolarHBondContact O-N 3.2Å; N694-P720 WeakPolarHBondContact O-CA 3.35Å; N694-D721 PolarHBondContact O-N 2.95Å; N694-A724 HydrophobicContact CB-CB 4.25Å; N694-A725 HydrophobicContact CB-CB 3.72Å
695	Y	91.9	Very high	75.6	Confident	27 Å²	27	38.6 Å²	38.6	11%	0.106	21%	0.206	C	C	.	.	H	α-helix	trans	-68.1	-41.3	177.5	174.5	-93.4	0	0	0	112.3	A691 E692 P720 W722 R776 E779 M780	A691-Y695 VanDerWaalsContact O-CB 3.29Å; A691-Y695 WeakPolarHBondContact O-CB 3.45Å; A691-Y695 PolarHBondContact O-N 3.33Å; E692-Y695 PolarHBondContact O-N 3.26Å; Y695-P720 WeakPolarHBondContact O-CB 3.48Å; Y695-W722 AromaticContact CD2-NE1 3.89Å; Y695-W722 HydrophobicContact CE2-CZ2 4.41Å; Y695-W722 PolarHBondContact O-NE1 2.97Å; Y695-R776 VanDerWaalsContact CD1-NH1 3.25Å; Y695-R776 HydrophobicContact CD2-CG 4.44Å; Y695-R776 HydrophobicContact CE2-CG 4.41Å; Y695-E779 PolarHBondContact OH-OE1 3.34Å; Y695-E779 VanDerWaalsContact OH-OE1 3.05Å; Y695-E779 PolarHBondContact OH-OE2 3.2Å; Y695-M780 HydrophobicContact CD2-CE 4.43Å; Y695-M780 HydrophobicContact CD2-CG 3.76Å; Y695-M780 HydrophobicContact CD2-SD 3.68Å; Y695-M780 HydrophobicContact CE2-CG 3.68Å; Y695-M780 HydrophobicContact CE2-SD 4.18Å
696	H	87.6	Confident	73.6	Confident	86 Å²	86	44.1 Å²	44.1	40%	0.398	24%	0.236	S	C	.	.	H	α-helix	trans	-86.6	-19.5	179.4	-73.6	-64.4	0	0	0	113.8	E692 E698	E692-H696 PolarHBondContact O-CD2 3.21Å; E692-H696 PolarHBondContact O-N 3.42Å; E692-H696 IonicContact OE2-CD2 2.7Å; E692-H696 IonicContact OE2-NE2 3.92Å; H696-E698 PolarHBondContact O-N 3.35Å
697	G	83.2	Confident	71.4	Confident	6 Å²	6	49.2 Å²	49.2	6%	0.062	26%	0.263	C	S	.	.	S	Bend	trans	69.4	6.2	-169.2	0	0	0	0	0	113.1	A693 Q718	A693-G697 PolarHBondContact O-N 2.97Å; G697-Q718 CarbonylContact C-O 3.5Å; G697-Q718 WeakPolarHBondContact CA-O 3.35Å
698	E	73.3	Confident	69	Low	107 Å²	107	55.6 Å²	55.6	50%	0.5	30%	0.295	S	S	.	.	S	Bend	trans	-126.3	123.6	179.8	-64.4	-171	164.6	0	0	108	H696 K717	H696-E698 PolarHBondContact O-N 3.35Å; E698-K717 IonicContact OE1-NZ 2.85Å; E698-K717 PolarHBondContact OE1-NZ 3.34Å
699	Y	65.8	Low	66.7	Low	64 Å²	64	62.7 Å²	62.7	25%	0.251	33%	0.334	S	S	.	.			trans	-77.9	133.3	171.5	-54.8	-83.4	0	0	0	108.7	F672 A693 S701 Q718	F672-Y699 HydrophobicContact CD2-CD1 4.15Å; F672-Y699 AromaticContact CD2-CE1 3.78Å; F672-Y699 HydrophobicContact CD2-CE1 3.78Å; F672-Y699 HydrophobicContact CE2-CD1 4.11Å; F672-Y699 AromaticContact CE2-CE1 3.38Å; F672-Y699 HydrophobicContact CE2-CE1 3.38Å; F672-Y699 HydrophobicContact CZ-CE1 4.21Å; A693-Y699 HydrophobicContact CB-CD1 3.52Å; A693-Y699 HydrophobicContact CB-CE1 3.9Å; A693-Y699 HydrophobicContact CB-CG 4.39Å; Y699-S701 PolarHBondContact O-N 3.04Å; Y699-Q718 PolarHBondContact OH-NE2 3.1Å; Y699-Q718 PolarHBondContact OH-OE1 2.92Å
700	Y	55.6	Low	64.5	Low	95 Å²	95	66.1 Å²	66.1	37%	0.373	35%	0.352	S	S	.	.			trans	-60.6	107	172.8	-71.9	-78	0	0	0	109.7	Y689 E692	Y689-Y700 HydrophobicContact CE2-CD2 4.41Å; Y689-Y700 PolarHBondContact OH-O 3.18Å; E692-Y700 HydrophobicContact CB-CE2 4.19Å; E692-Y700 PolarHBondContact OE2-OH 3.45Å
701	S	50.3	Low	62.1	Low	40 Å²	40	72.6 Å²	72.6	28%	0.28	39%	0.387	S	S	.	.			trans	-120.7	112.9	161.9	173.4	0	0	0	0	107.3	Y699 D703 T704	Y699-S701 PolarHBondContact O-N 3.04Å; S701-D703 PolarHBondContact O-N 2.99Å; S701-D703 VanDerWaalsContact O-N 3.1Å; S701-T704 WeakPolarHBondContact CB-OG1 3.38Å; S701-T704 PolarHBondContact O-N 2.93Å; S701-T704 PolarHBondContact O-OG1 3.31Å
702	P	45	Very low	59.8	Low	65 Å²	65	79.3 Å²	79.3	42%	0.422	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-58.5	-26.9	-173.3	13.3	-22.1	0	0	0	113.6	N648 T704 S705	N648-P702 WeakPolarHBondContact O-CD 3.49Å; N648-P702 WeakPolarHBondContact O-CG 3.25Å; P702-T704 VanDerWaalsContact C-N 3.26Å; P702-T704 PolarHBondContact O-N 2.89Å; P702-S705 PolarHBondContact O-OG 2.96Å
703	D	47.7	Very low	57.5	Low	94 Å²	94	83.2 Å²	83.2	50%	0.503	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-73.4	-15.1	-179.5	-70.6	-21.7	0	0	0	113.7	N648 S701 S705 N706	N648-D703 PolarHBondContact ND2-OD2 2.94Å; S701-D703 PolarHBondContact O-N 2.99Å; S701-D703 VanDerWaalsContact O-N 3.1Å; D703-S705 PolarHBondContact O-N 3.48Å; D703-N706 PolarHBondContact O-N 3.15Å
704	T	47.5	Very low	55.5	Low	90 Å²	90	90.8 Å²	90.8	55%	0.552	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-73	-13	-177.6	-29.7	0	0	0	0	112.6	S701 P702	S701-T704 WeakPolarHBondContact CB-OG1 3.38Å; S701-T704 PolarHBondContact O-N 2.93Å; S701-T704 PolarHBondContact O-OG1 3.31Å; P702-T704 VanDerWaalsContact C-N 3.26Å; P702-T704 PolarHBondContact O-N 2.89Å
705	S	44.4	Very low	53.5	Low	94 Å²	94	95.6 Å²	95.6	66%	0.657	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-76.5	-20.1	176.3	68.3	0	0	0	0	114	P702 D703	P702-S705 PolarHBondContact O-OG 2.96Å; D703-S705 PolarHBondContact O-N 3.48Å
706	N	42.3	Very low	51.5	Low	134 Å²	134	105.8 Å²	105.8	72%	0.717	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-12.9	-175.9	-81.7	-26.6	0	0	0	114.9	D703 I708	D703-N706 PolarHBondContact O-N 3.15Å; N706-I708 PolarHBondContact O-N 3.43Å
707	D	42.2	Very low	50.1	Low	106 Å²	106	109.5 Å²	109.5	57%	0.567	56%	0.559	S	S	*	*			trans	-82	68.2	171.5	-82.6	-16.6	0	0	0	111.2	N709 N710	D707-N709 PolarHBondContact O-N 2.75Å; D707-N710 HydrophobicContact CB-CB 4.15Å; D707-N710 PolarHBondContact O-N 3.37Å
708	I	41.6	Very low	49.4	Very low	137 Å²	137	113.9 Å²	113.9	70%	0.703	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-18.3	168.5	-59.8	171	0	0	0	111	N706 N711	N706-I708 PolarHBondContact O-N 3.43Å; I708-N711 PolarHBondContact O-ND2 3.47Å
709	N	41.6	Very low	49.9	Very low	150 Å²	150	116.4 Å²	116.4	80%	0.802	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-0.8	179	-99.6	-12	0	0	0	115.6	D707 N711	D707-N709 PolarHBondContact O-N 2.75Å; N709-N711 PolarHBondContact O-N 3.02Å; N709-N711 VanDerWaalsContact O-N 3.11Å
710	N	42.2	Very low	51.1	Low	73 Å²	73	115 Å²	115	39%	0.39	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.4	39.5	174.4	-157.3	9.4	0	0	0	113	D707 N713	D707-N710 HydrophobicContact CB-CB 4.15Å; D707-N710 PolarHBondContact O-N 3.37Å; N710-N713 WeakPolarHBondContact OD1-CB 3.43Å; N710-N713 VanDerWaalsContact OD1-CG 3.32Å
711	N	41.6	Very low	52.9	Low	137 Å²	137	113.4 Å²	113.4	73%	0.733	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-4	169.5	-76.2	-32.2	0	0	0	112.8	I708 N709	I708-N711 PolarHBondContact O-ND2 3.47Å; N709-N711 PolarHBondContact O-N 3.02Å; N709-N711 VanDerWaalsContact O-N 3.11Å
712	N	42.9	Very low	55.1	Low	141 Å²	141	112.7 Å²	112.7	75%	0.754	58%	0.577	S	S	*	*	S	Bend	trans	-100.4	-10.8	-175.1	-71.7	-21.5	0	0	0	114.2	N714	N712-N714 PolarHBondContact O-N 2.94Å
713	N	43.2	Very low	57.5	Low	85 Å²	85	114.6 Å²	114.6	46%	0.455	58%	0.584	S	S	.	*			trans	-89.8	94.4	168	-68.2	6.1	0	0	0	107.6	N710 E715	N710-N713 WeakPolarHBondContact OD1-CB 3.43Å; N710-N713 VanDerWaalsContact OD1-CG 3.32Å; N713-E715 HydrophobicContact CB-CB 4.16Å; N713-E715 HydrophobicContact CB-CG 3.95Å; N713-E715 PolarHBondContact ND2-OE1 3Å; N713-E715 PolarHBondContact O-N 3.37Å
714	N	44	Very low	59.7	Low	160 Å²	160	111.2 Å²	111.2	86%	0.856	57%	0.569	S	S	*	*			trans	-60	30.8	153.8	-71.4	-39.8	0	0	0	111.7	N712 R716	N712-N714 PolarHBondContact O-N 2.94Å; N714-R716 VanDerWaalsContact C-N 3.34Å; N714-R716 PolarHBondContact O-N 2.77Å
715	E	50	Low	62	Low	117 Å²	117	106.9 Å²	106.9	55%	0.547	54%	0.542	S	S	.	.			trans	-59.5	104.4	163.6	-82.5	174.4	-144.6	0	0	105.1	R668 N713 K717	R668-E715 IonicContact NH1-OE2 3.56Å; N713-E715 HydrophobicContact CB-CB 4.16Å; N713-E715 HydrophobicContact CB-CG 3.95Å; N713-E715 PolarHBondContact ND2-OE1 3Å; N713-E715 PolarHBondContact O-N 3.37Å; E715-K717 PolarHBondContact O-N 2.95Å
716	R	49.5	Very low	64.5	Low	240 Å²	240	102.5 Å²	102.5	91%	0.906	51%	0.512	S	S	*	.			trans	-31.8	106.9	-178.4	-65.8	174.1	-176.7	-175.4	-0.8	109.6	N714 Q718	N714-R716 VanDerWaalsContact C-N 3.34Å; N714-R716 PolarHBondContact O-N 2.77Å; R716-Q718 PolarHBondContact O-N 3.06Å
717	K	58.6	Low	67.1	Low	165 Å²	165	100.6 Å²	100.6	72%	0.717	50%	0.498	S	S	*	.			trans	-50.4	115.2	162.2	-83.3	-167.7	171	-132.4	0	105.2	E698 E715 E719	E698-K717 IonicContact OE1-NZ 2.85Å; E698-K717 PolarHBondContact OE1-NZ 3.34Å; E715-K717 PolarHBondContact O-N 2.95Å; K717-E719 PolarHBondContact O-N 3.03Å
718	Q	69	Low	69.6	Low	98 Å²	98	97.3 Å²	97.3	46%	0.458	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-65.6	127	-176.4	-174.4	165.8	-3.9	0	0	106.6	G697 Y699 R716	G697-Q718 CarbonylContact C-O 3.5Å; G697-Q718 WeakPolarHBondContact CA-O 3.35Å; Y699-Q718 PolarHBondContact OH-NE2 3.1Å; Y699-Q718 PolarHBondContact OH-OE1 2.92Å; R716-Q718 PolarHBondContact O-N 3.06Å
719	E	82.3	Confident	72.2	Confident	160 Å²	160	90.8 Å²	90.8	75%	0.748	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-66.1	144.2	175.3	-68.4	-176.7	174.2	0	0	108.6	K717	K717-E719 PolarHBondContact O-N 3.03Å
720	P	90.6	Very high	74.8	Confident	33 Å²	33	86.1 Å²	86.1	21%	0.214	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-53.7	143.8	173.2	-22.8	30	0	0	0	111.6	N694 Y695 H786	N694-P720 WeakPolarHBondContact O-CA 3.35Å; Y695-P720 WeakPolarHBondContact O-CB 3.48Å; P720-H786 HydrophobicContact CB-CB 4.37Å; P720-H786 VanDerWaalsContact O-CB 3.32Å; P720-H786 WeakPolarHBondContact O-CB 3.45Å; P720-H786 PolarHBondContact O-ND1 3.19Å; P720-H786 VanDerWaalsContact O-ND1 3.16Å
721	D	93.6	Very high	77.3	Confident	63 Å²	63	85.8 Å²	85.8	34%	0.337	42%	0.415	S	S	.	.			trans	-121.1	91.3	174.3	-175.9	-17.7	0	0	0	108.4	N694 L723 A724 A725	N694-D721 PolarHBondContact O-N 2.95Å; D721-L723 VanDerWaalsContact C-N 3.26Å; D721-L723 PolarHBondContact O-N 3.36Å; D721-L723 WeakPolarHBondContact OD1-CB 3.4Å; D721-L723 PolarHBondContact OD1-N 3.46Å; D721-L723 VanDerWaalsContact OD1-N 3.15Å; D721-A724 HydrophobicContact CB-CB 4.14Å; D721-A724 PolarHBondContact O-N 2.83Å; D721-A724 PolarHBondContact OD1-N 3.08Å; D721-A725 WeakPolarHBondContact O-CB 3.33Å; D721-A725 PolarHBondContact O-N 3.25Å
722	W	96.3	Very high	79.7	Confident	24 Å²	24	79.3 Å²	79.3	9%	0.091	38%	0.38	C	S	.	.	H	α-helix	trans	-74.2	-20.7	-176.6	-73.7	6.3	0	0	0	112.7	Y695 A726 M780 K783 G784 H786 L788	Y695-W722 AromaticContact CD2-NE1 3.89Å; Y695-W722 HydrophobicContact CE2-CZ2 4.41Å; Y695-W722 PolarHBondContact O-NE1 2.97Å; W722-A726 WeakPolarHBondContact O-CB 3.22Å; W722-A726 PolarHBondContact O-N 3.31Å; W722-M780 HydrophobicContact CB-CE 3.7Å; W722-M780 HydrophobicContact CD2-CG 4.39Å; W722-M780 HydrophobicContact CE3-CB 4.35Å; W722-M780 HydrophobicContact CG-CE 3.98Å; W722-M780 WeakPolarHBondContact O-CE 3.41Å; W722-K783 HydrophobicContact CH2-CB 4.05Å; W722-K783 HydrophobicContact CH2-CD 4.02Å; W722-K783 HydrophobicContact CZ3-CB 3.75Å; W722-G784 WeakPolarHBondContact CZ3-O 3.28Å; W722-H786 HydrophobicContact CB-CB 3.79Å; W722-H786 HydrophobicContact CD2-CB 3.9Å; W722-H786 AromaticContact CD2-CD2 3.77Å; W722-H786 AromaticContact CE2-CD2 3.51Å; W722-H786 HydrophobicContact CE3-CB 4.49Å; W722-H786 HydrophobicContact CG-CB 3.55Å; W722-H786 AromaticContact CZ2-CD2 3.74Å; W722-H786 PolarHBondContact N-O 3.06Å; W722-H786 AromaticContact NE1-CD2 3.83Å; W722-L788 HydrophobicContact CB-CB 3.75Å; W722-L788 HydrophobicContact CB-CD2 4.22Å
723	L	96.2	Very high	82	Confident	105 Å²	105	73.7 Å²	73.7	55%	0.55	35%	0.354	S	S	.	.	H	α-helix	trans	-67.4	-47.8	173.1	-179.3	63.2	0	0	0	110.3	D721 H727 L788	D721-L723 VanDerWaalsContact C-N 3.26Å; D721-L723 PolarHBondContact O-N 3.36Å; D721-L723 WeakPolarHBondContact OD1-CB 3.4Å; D721-L723 PolarHBondContact OD1-N 3.46Å; D721-L723 VanDerWaalsContact OD1-N 3.15Å; L723-H727 PolarHBondContact O-N 3.35Å; L723-L788 HydrophobicContact CD1-CD1 4.21Å
724	A	94.5	Very high	84.2	Confident	23 Å²	23	76.9 Å²	76.9	19%	0.19	36%	0.363	C	S	.	.	H	α-helix	trans	-65.8	-42.3	175.3	0	0	0	0	0	112.1	N694 D721 H727 W728	N694-A724 HydrophobicContact CB-CB 4.25Å; D721-A724 HydrophobicContact CB-CB 4.14Å; D721-A724 PolarHBondContact O-N 2.83Å; D721-A724 PolarHBondContact OD1-N 3.08Å; A724-H727 PolarHBondContact O-N 2.96Å; A724-W728 PolarHBondContact O-N 3.04Å
725	A	95.5	Very high	86.2	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-61.3	-45.1	177.4	0	0	0	0	0	112.1	A691 N694 D721 H727 W728 Y729 M780	A691-A725 WeakPolarHBondContact O-CB 3.36Å; N694-A725 HydrophobicContact CB-CB 3.72Å; D721-A725 WeakPolarHBondContact O-CB 3.33Å; D721-A725 PolarHBondContact O-N 3.25Å; A725-H727 VanDerWaalsContact C-N 3.35Å; A725-H727 PolarHBondContact O-N 3.49Å; A725-W728 PolarHBondContact O-N 3.24Å; A725-Y729 HydrophobicContact CB-CD2 4.49Å; A725-Y729 HydrophobicContact CB-CE2 4.36Å; A725-Y729 WeakPolarHBondContact O-CD2 3.42Å; A725-Y729 PolarHBondContact O-N 3.14Å; A725-M780 HydrophobicContact CB-CE 3.61Å
726	A	97.2	Very high	87.3	Confident	2 Å²	2	70.2 Å²	70.2	2%	0.017	34%	0.336	C	S	.	.	H	α-helix	trans	-62.2	-43.9	-179.7	0	0	0	0	0	111.1	W722 W728 Y729 E730 L777 M780 Y781 L788	W722-A726 WeakPolarHBondContact O-CB 3.22Å; W722-A726 PolarHBondContact O-N 3.31Å; A726-W728 VanDerWaalsContact C-N 3.34Å; A726-W728 PolarHBondContact O-N 3.2Å; A726-Y729 PolarHBondContact O-N 3.33Å; A726-E730 WeakPolarHBondContact O-CB 3.33Å; A726-E730 WeakPolarHBondContact O-CG 3.46Å; A726-E730 PolarHBondContact O-N 2.97Å; A726-L777 HydrophobicContact CB-CD2 3.88Å; A726-M780 HydrophobicContact CB-CE 3.87Å; A726-Y781 HydrophobicContact CB-CE2 4.49Å; A726-L788 HydrophobicContact CB-CD1 4.16Å; A726-L788 HydrophobicContact CB-CD2 4.39Å
727	H	96.5	Very high	87.9	Confident	94 Å²	94	61.8 Å²	61.8	44%	0.435	31%	0.311	S	S	.	.	H	α-helix	trans	-54	-49.4	174.9	170.3	-94.1	0	0	0	112	L723 A724 A725 E730 M731	L723-H727 PolarHBondContact O-N 3.35Å; A724-H727 PolarHBondContact O-N 2.96Å; A725-H727 VanDerWaalsContact C-N 3.35Å; A725-H727 PolarHBondContact O-N 3.49Å; H727-E730 PolarHBondContact O-N 3.1Å; H727-M731 PolarHBondContact CE1-SD 2.89Å; H727-M731 WeakPolarHBondContact O-CG 3.32Å; H727-M731 PolarHBondContact O-N 3.36Å
728	W	95.7	Very high	87.8	Confident	37 Å²	37	63.3 Å²	63.3	14%	0.14	31%	0.314	C	S	.	.	H	α-helix	trans	-70.2	-37.8	-178.7	-70.4	123	0	0	0	113.6	A679 M687 L690 A691 A724 A725 A726 M731 A732	A679-W728 HydrophobicContact CB-CE3 4.09Å; A679-W728 HydrophobicContact CB-CH2 3.84Å; A679-W728 HydrophobicContact CB-CZ2 4.47Å; A679-W728 HydrophobicContact CB-CZ3 3.62Å; M687-W728 HydrophobicContact CB-CE3 4.26Å; M687-W728 HydrophobicContact CG-CE3 3.87Å; M687-W728 HydrophobicContact CG-CZ3 4.19Å; M687-W728 WeakPolarHBondContact O-CB 3.42Å; L690-W728 HydrophobicContact CB-CD2 4.27Å; L690-W728 HydrophobicContact CB-CG 3.93Å; L690-W728 HydrophobicContact CD1-CD2 4.18Å; L690-W728 HydrophobicContact CD1-CH2 4.37Å; L690-W728 HydrophobicContact CD1-CZ2 3.84Å; A691-W728 HydrophobicContact CB-CB 3.72Å; A724-W728 PolarHBondContact O-N 3.04Å; A725-W728 PolarHBondContact O-N 3.24Å; A726-W728 VanDerWaalsContact C-N 3.34Å; A726-W728 PolarHBondContact O-N 3.2Å; W728-M731 HydrophobicContact CE3-SD 4.13Å; W728-M731 HydrophobicContact CZ3-SD 3.9Å; W728-M731 PolarHBondContact O-N 3.32Å; W728-A732 WeakPolarHBondContact O-CB 3.3Å; W728-A732 PolarHBondContact O-N 3.06Å
729	Y	95.7	Very high	86.8	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-60.4	-45	172.6	-81.3	-55	0	0	0	112	A691 E692 A725 A726 M731 A732 A733 W768 L773 R776 L777 M780	A691-Y729 HydrophobicContact CB-CD1 3.58Å; A691-Y729 HydrophobicContact CB-CD2 3.71Å; A691-Y729 HydrophobicContact CB-CE1 3.54Å; A691-Y729 HydrophobicContact CB-CE2 3.67Å; A691-Y729 HydrophobicContact CB-CG 3.63Å; E692-Y729 WeakPolarHBondContact CG-OH 3.28Å; E692-Y729 PolarHBondContact OE1-OH 3.45Å; A725-Y729 HydrophobicContact CB-CD2 4.49Å; A725-Y729 HydrophobicContact CB-CE2 4.36Å; A725-Y729 WeakPolarHBondContact O-CD2 3.42Å; A725-Y729 PolarHBondContact O-N 3.14Å; A726-Y729 PolarHBondContact O-N 3.33Å; Y729-M731 VanDerWaalsContact C-N 3.35Å; Y729-M731 PolarHBondContact O-N 2.92Å; Y729-A732 PolarHBondContact O-N 3.18Å; Y729-A733 WeakPolarHBondContact O-CB 3.17Å; Y729-A733 PolarHBondContact O-N 3.09Å; Y729-W768 HydrophobicContact CE1-CZ3 4.32Å; Y729-L773 HydrophobicContact CD1-CB 4.34Å; Y729-L773 HydrophobicContact CD1-CD2 3.65Å; Y729-L773 HydrophobicContact CE1-CD2 3.87Å; Y729-R776 HydrophobicContact CD2-CG 4.34Å; Y729-R776 HydrophobicContact CE1-CG 4.27Å; Y729-R776 HydrophobicContact CE2-CB 4.49Å; Y729-R776 HydrophobicContact CE2-CG 3.63Å; Y729-L777 HydrophobicContact CD2-CD2 4.44Å; Y729-L777 HydrophobicContact CG-CD2 4.44Å; Y729-L777 HydrophobicContact CG-CG 4.31Å; Y729-M780 HydrophobicContact CD2-SD 3.88Å; Y729-M780 HydrophobicContact CE2-SD 3.88Å
730	E	95.2	Very high	84.8	Confident	51 Å²	51	64.6 Å²	64.6	24%	0.238	33%	0.329	C	S	.	.	H	α-helix	trans	-63.2	-41.3	177.1	-74.2	-176.7	178	0	0	111.9	A726 H727 A733 K734 L777 Y781 K794	A726-E730 WeakPolarHBondContact O-CB 3.33Å; A726-E730 WeakPolarHBondContact O-CG 3.46Å; A726-E730 PolarHBondContact O-N 2.97Å; H727-E730 PolarHBondContact O-N 3.1Å; E730-A733 PolarHBondContact O-N 3.01Å; E730-K734 WeakPolarHBondContact O-CD 3.48Å; E730-K734 VanDerWaalsContact O-CG 3.27Å; E730-K734 WeakPolarHBondContact O-CG 3.45Å; E730-K734 PolarHBondContact O-N 3.06Å; E730-L777 HydrophobicContact CG-CD1 3.87Å; E730-L777 HydrophobicContact CG-CD2 4.06Å; E730-Y781 PolarHBondContact OE1-OH 2.84Å; E730-K794 IonicContact OE1-NZ 2.79Å; E730-K794 PolarHBondContact OE1-NZ 3.04Å
731	M	94.8	Very high	82.2	Confident	67 Å²	67	66.9 Å²	66.9	33%	0.33	35%	0.351	S	S	.	.	H	α-helix	trans	-62.9	-44.3	174.4	-71.6	-156	75.7	0	0	111.6	M687 H727 W728 Y729 A733 K734 V735	M687-M731 HydrophobicContact CE-CB 4.07Å; M687-M731 HydrophobicContact CE-CE 3.93Å; M687-M731 HydrophobicContact CG-CB 4.41Å; M687-M731 VanDerWaalsContact SD-C 3.57Å; M687-M731 HydrophobicContact SD-CB 3.67Å; H727-M731 PolarHBondContact CE1-SD 2.89Å; H727-M731 WeakPolarHBondContact O-CG 3.32Å; H727-M731 PolarHBondContact O-N 3.36Å; W728-M731 HydrophobicContact CE3-SD 4.13Å; W728-M731 HydrophobicContact CZ3-SD 3.9Å; W728-M731 PolarHBondContact O-N 3.32Å; Y729-M731 VanDerWaalsContact C-N 3.35Å; Y729-M731 PolarHBondContact O-N 2.92Å; M731-A733 VanDerWaalsContact C-N 3.33Å; M731-A733 PolarHBondContact O-N 3.21Å; M731-K734 PolarHBondContact O-N 3.19Å; M731-V735 PolarHBondContact O-N 3.01Å
732	A	92.7	Very high	79.6	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-63.8	-36.9	178.5	0	0	0	0	0	112.9	R684 M687 V688 W728 Y729 K734 V735 L773	R684-A732 HydrophobicContact CG-CB 4.15Å; R684-A732 PolarHBondContact NE-O 2.56Å; M687-A732 HydrophobicContact CB-CB 3.84Å; M687-A732 HydrophobicContact SD-CB 4.39Å; V688-A732 HydrophobicContact CG2-CB 3.68Å; W728-A732 WeakPolarHBondContact O-CB 3.3Å; W728-A732 PolarHBondContact O-N 3.06Å; Y729-A732 PolarHBondContact O-N 3.18Å; A732-K734 VanDerWaalsContact C-N 3.31Å; A732-V735 PolarHBondContact O-N 2.86Å; A732-L773 HydrophobicContact CB-CD1 3.92Å
733	A	91	Very high	76.9	Confident	24 Å²	24	75.5 Å²	75.5	20%	0.198	40%	0.396	C	S	.	.	H	α-helix	trans	-69.9	-26.9	176.7	0	0	0	0	0	112.8	Y729 E730 M731 I770 L773	Y729-A733 WeakPolarHBondContact O-CB 3.17Å; Y729-A733 PolarHBondContact O-N 3.09Å; E730-A733 PolarHBondContact O-N 3.01Å; M731-A733 VanDerWaalsContact C-N 3.33Å; M731-A733 PolarHBondContact O-N 3.21Å; A733-I770 HydrophobicContact CB-CG2 4.43Å; A733-L773 HydrophobicContact CB-CD1 4.27Å
734	K	90.4	Very high	74.2	Confident	152 Å²	152	77.2 Å²	77.2	66%	0.661	41%	0.406	S	S	*	.	H	α-helix	trans	-78.6	-17.3	176.2	-71.9	166.7	-173.1	167.9	0	113.6	E730 M731 A732 V736	E730-K734 WeakPolarHBondContact O-CD 3.48Å; E730-K734 VanDerWaalsContact O-CG 3.27Å; E730-K734 WeakPolarHBondContact O-CG 3.45Å; E730-K734 PolarHBondContact O-N 3.06Å; M731-K734 PolarHBondContact O-N 3.19Å; A732-K734 VanDerWaalsContact C-N 3.31Å; K734-V736 PolarHBondContact O-N 3.45Å; K734-V736 VanDerWaalsContact O-N 3.16Å
735	V	85.9	Confident	71.5	Confident	30 Å²	30	81.8 Å²	81.8	18%	0.182	43%	0.427	C	S	.	.	S	Bend	trans	-72.5	109.7	176.7	-178.9	0	0	0	0	108.4	R684 M687 M731 A732 T737	R684-V735 HydrophobicContact CB-CB 4.08Å; R684-V735 HydrophobicContact CB-CG1 4.05Å; R684-V735 HydrophobicContact CB-CG2 4.13Å; R684-V735 HydrophobicContact CG-CB 4.22Å; M687-V735 HydrophobicContact CE-CG2 4.36Å; M687-V735 HydrophobicContact SD-CG2 3.99Å; M731-V735 PolarHBondContact O-N 3.01Å; A732-V735 PolarHBondContact O-N 2.86Å; V735-T737 PolarHBondContact O-N 3.08Å; V735-T737 VanDerWaalsContact O-N 3.1Å
736	V	71.5	Confident	68.6	Low	106 Å²	106	89.6 Å²	89.6	64%	0.642	46%	0.463	S	S	*	.			trans	-61.3	112.8	171.7	-179.5	0	0	0	0	108.2	K734	K734-V736 PolarHBondContact O-N 3.45Å; K734-V736 VanDerWaalsContact O-N 3.16Å
737	T	63.5	Low	65.7	Low	64 Å²	64	98.1 Å²	98.1	39%	0.393	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-83.8	122	165.2	50.7	0	0	0	0	107	V735 D739	V735-T737 PolarHBondContact O-N 3.08Å; V735-T737 VanDerWaalsContact O-N 3.1Å; T737-D739 PolarHBondContact O-N 2.95Å
738	Y	54.9	Low	62.6	Low	197 Å²	197	100.4 Å²	100.4	77%	0.773	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-75.3	118.1	161.1	-64.1	-82.8	0	0	0	105.2	D740	Y738-D740 PolarHBondContact O-N 3.11Å
739	D	49.9	Very low	59.7	Low	139 Å²	139	107 Å²	107	74%	0.743	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-62.5	118.7	163.9	-67.9	-35	0	0	0	105.6	T737 A741	T737-D739 PolarHBondContact O-N 2.95Å; D739-A741 HydrophobicContact CB-CB 4.35Å; D739-A741 PolarHBondContact O-N 2.94Å
740	D	39.8	Very low	56.5	Low	145 Å²	145	110.3 Å²	110.3	78%	0.775	59%	0.587	S	S	*	*			trans	-66.7	34.3	170.6	-79.2	-26.7	0	0	0	110.8	Y738 T742	Y738-D740 PolarHBondContact O-N 3.11Å; D740-T742 PolarHBondContact O-N 3.32Å
741	A	36.1	Very low	53.3	Low	81 Å²	81	113 Å²	113	67%	0.669	60%	0.603	S	S	*	*			trans	-72.4	68.4	168.7	0	0	0	0	0	108.3	D739 E743	D739-A741 HydrophobicContact CB-CB 4.35Å; D739-A741 PolarHBondContact O-N 2.94Å; A741-E743 PolarHBondContact O-N 2.88Å
742	T	38.7	Very low	50	Low	84 Å²	84	115.9 Å²	115.9	52%	0.515	63%	0.626	S	S	.	*			trans	-59.4	121.6	147.6	47.1	0	0	0	0	106.2	D740 D744 D745	D740-T742 PolarHBondContact O-N 3.32Å; T742-D744 PolarHBondContact O-N 3.01Å; T742-D745 PolarHBondContact O-N 3.27Å
743	E	39.6	Very low	47	Very low	184 Å²	184	119.7 Å²	119.7	86%	0.86	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-55	-8.5	178.2	-66.6	179.2	164	0	0	113.3	A741 D745	A741-E743 PolarHBondContact O-N 2.88Å; E743-D745 PolarHBondContact O-N 3.49Å
744	D	39.3	Very low	43.9	Very low	142 Å²	142	126.2 Å²	126.2	76%	0.759	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-78.5	-9.3	-179	-65.1	-33.2	0	0	0	115.1	T742 E746	T742-D744 PolarHBondContact O-N 3.01Å; D744-E746 VanDerWaalsContact C-N 3.27Å; D744-E746 PolarHBondContact O-N 3.35Å
745	D	36.8	Very low	40.8	Very low	118 Å²	118	123.7 Å²	123.7	63%	0.631	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-77.1	-5.7	-179.2	-87.4	-16.5	0	0	0	114.4	T742 E743 M747 N748	T742-D745 PolarHBondContact O-N 3.27Å; E743-D745 PolarHBondContact O-N 3.49Å; D745-M747 PolarHBondContact O-N 2.94Å; D745-M747 VanDerWaalsContact O-N 3.08Å; D745-N748 PolarHBondContact O-N 3.41Å
746	E	36.5	Very low	37.9	Very low	164 Å²	164	131.8 Å²	131.8	77%	0.766	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-63.1	-16.5	178.6	-76.2	-162.6	158.9	0	0	114	D744 N748	D744-E746 VanDerWaalsContact C-N 3.27Å; D744-E746 PolarHBondContact O-N 3.35Å; E746-N748 PolarHBondContact O-N 3.43Å
747	M	36.2	Very low	35.7	Very low	182 Å²	182	136.7 Å²	136.7	90%	0.897	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-86.6	-2.2	-175.7	-147.1	176.6	64.8	0	0	115	D745	D745-M747 PolarHBondContact O-N 2.94Å; D745-M747 VanDerWaalsContact O-N 3.08Å
748	N	31.4	Very low	34	Very low	141 Å²	141	139.4 Å²	139.4	75%	0.754	74%	0.736	S	S	*	*			trans	-105.6	32.4	-173.4	-130.4	-9.9	0	0	0	115.3	D745 E746 G750	D745-N748 PolarHBondContact O-N 3.41Å; E746-N748 PolarHBondContact O-N 3.43Å; N748-G750 PolarHBondContact O-N 2.74Å
749	Q	33.4	Very low	33.1	Very low	177 Å²	177	135 Å²	135	83%	0.827	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	8.3	175.5	-64.7	-172.5	23	0	0	114.7
750	G	28.9	Very low	32.5	Very low	69 Å²	69	131.7 Å²	131.7	71%	0.711	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-6.6	-169.8	0	0	0	0	0	117	N748	N748-G750 PolarHBondContact O-N 2.74Å
751	N	27.3	Very low	32.9	Very low	106 Å²	106	126.3 Å²	126.3	57%	0.567	68%	0.684	S	S	*	*			trans	-139.6	85.7	-175.2	-156.3	-4.6	0	0	0	114.6	S753 F754	N751-S753 PolarHBondContact O-N 2.71Å; N751-S753 WeakPolarHBondContact OD1-CB 3.4Å; N751-S753 PolarHBondContact OD1-N 2.95Å; N751-S753 PolarHBondContact OD1-OG 2.85Å; N751-F754 PolarHBondContact O-N 3.29Å
752	P	27.1	Very low	33.7	Very low	128 Å²	128	122.6 Å²	122.6	83%	0.831	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	2.6	176.2	30.6	-33.4	0	0	0	113.1
753	S	28.2	Very low	34.2	Very low	81 Å²	81	122.1 Å²	122.1	57%	0.566	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	6	177.9	76.5	0	0	0	0	114.6	N751 V755	N751-S753 PolarHBondContact O-N 2.71Å; N751-S753 WeakPolarHBondContact OD1-CB 3.4Å; N751-S753 PolarHBondContact OD1-N 2.95Å; N751-S753 PolarHBondContact OD1-OG 2.85Å; S753-V755 PolarHBondContact O-N 3.34Å
754	F	26.1	Very low	34.8	Very low	160 Å²	160	115.5 Å²	115.5	70%	0.702	62%	0.622	S	S	*	*	S	Bend	trans	-72.6	64.3	155	-160.2	-98.5	0	0	0	108.6	N751 K756	N751-F754 PolarHBondContact O-N 3.29Å; F754-K756 PolarHBondContact O-N 3.43Å
755	V	24.9	Very low	35.7	Very low	99 Å²	99	109.1 Å²	109.1	60%	0.6	59%	0.587	S	S	*	*			trans	-49.8	118.4	171.7	173.6	0	0	0	0	105.6	S753 R757	S753-V755 PolarHBondContact O-N 3.34Å; V755-R757 PolarHBondContact O-N 3.27Å
756	K	25.6	Very low	36.8	Very low	201 Å²	201	105.1 Å²	105.1	87%	0.874	57%	0.569	S	S	*	*			trans	-48.8	77.6	159.4	-71.5	179.3	174.7	-176.5	0	107.6	F754 S758	F754-K756 PolarHBondContact O-N 3.43Å; K756-S758 PolarHBondContact O-N 3.49Å; K756-S758 VanDerWaalsContact O-N 3.09Å
757	R	24.8	Very low	38.5	Very low	209 Å²	209	103.5 Å²	103.5	79%	0.789	56%	0.561	S	S	*	*			trans	-56.8	122.1	168.2	-77.7	-174.9	-172.4	176.2	3.3	103	V755 R759	V755-R757 PolarHBondContact O-N 3.27Å; R757-R759 WeakPolarHBondContact O-CG 3.48Å; R757-R759 PolarHBondContact O-N 2.96Å
758	S	28.6	Very low	40.7	Very low	121 Å²	121	96.1 Å²	96.1	85%	0.846	52%	0.523	S	S	*	.			trans	-47.2	91.8	171.4	-170.7	0	0	0	0	108	K756 S760	K756-S758 PolarHBondContact O-N 3.49Å; K756-S758 VanDerWaalsContact O-N 3.09Å; S758-S760 PolarHBondContact O-N 3.48Å; S758-S760 VanDerWaalsContact O-N 3.08Å
759	R	36	Very low	43.5	Very low	103 Å²	103	91.8 Å²	91.8	39%	0.389	50%	0.503	S	S	.	.			trans	-81	91.4	-173.2	-88	166.4	170.9	-162.6	-0.8	104.8	R757 G761 H763 A764	R757-R759 WeakPolarHBondContact O-CG 3.48Å; R757-R759 PolarHBondContact O-N 2.96Å; R759-G761 PolarHBondContact O-N 3.46Å; R759-H763 PolarHBondContact NH1-CD2 2.92Å; R759-H763 PolarHBondContact NH1-NE2 3.5Å; R759-A764 WeakPolarHBondContact O-CB 3.37Å
760	S	38.1	Very low	46.2	Very low	70 Å²	70	86.5 Å²	86.5	49%	0.49	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	128.4	-166.5	54.8	0	0	0	0	112.8	M650 S758 F762	M650-S760 VanDerWaalsContact CG-OG 3.3Å; M650-S760 WeakPolarHBondContact CG-OG 3.31Å; M650-S760 PolarHBondContact SD-OG 2.96Å; S758-S760 PolarHBondContact O-N 3.48Å; S758-S760 VanDerWaalsContact O-N 3.08Å; S760-F762 PolarHBondContact O-N 3.24Å
761	G	47.9	Very low	49.3	Very low	32 Å²	32	84.3 Å²	84.3	33%	0.33	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	-86.1	161.6	0	0	0	0	0	114.8	R759 L765	R759-G761 PolarHBondContact O-N 3.46Å; G761-L765 WeakPolarHBondContact O-CG 3.2Å; G761-L765 PolarHBondContact O-N 2.98Å
762	F	51.5	Low	52.4	Low	4 Å²	4	83.8 Å²	83.8	2%	0.018	44%	0.44	C	S	.	.	H	α-helix	trans	-70.1	-51.2	-164.2	-165	-103	0	0	0	112.8	Q644 L649 I675 M685 Y689 S760 A764 L765	Q644-F762 HydrophobicContact CG-CD1 3.95Å; Q644-F762 HydrophobicContact CG-CE1 3.93Å; Q644-F762 HydrophobicContact CG-CZ 4.48Å; Q644-F762 VanDerWaalsContact NE2-CE1 3.3Å; L649-F762 HydrophobicContact CB-CB 4.21Å; L649-F762 HydrophobicContact CD1-CB 4Å; L649-F762 HydrophobicContact CD1-CD2 3.44Å; L649-F762 VanDerWaalsContact CD1-CD2 3.44Å; L649-F762 HydrophobicContact CD1-CE2 4.07Å; L649-F762 HydrophobicContact CD1-CG 3.86Å; L649-F762 HydrophobicContact CD2-CB 4.46Å; L649-F762 HydrophobicContact CG-CB 4.46Å; I675-F762 HydrophobicContact CD1-CE2 3.68Å; I675-F762 HydrophobicContact CD1-CZ 3.59Å; I675-F762 HydrophobicContact CG1-CE2 4.44Å; M685-F762 HydrophobicContact CE-CE1 4.49Å; M685-F762 WeakPolarHBondContact CE-O 3.42Å; M685-F762 HydrophobicContact SD-CD1 4.24Å; M685-F762 HydrophobicContact SD-CE1 4.03Å; Y689-F762 AromaticContact CD2-CD2 3.47Å; Y689-F762 HydrophobicContact CD2-CD2 3.47Å; Y689-F762 VanDerWaalsContact CD2-CD2 3.47Å; Y689-F762 AromaticContact CD2-CE2 3.75Å; Y689-F762 HydrophobicContact CD2-CE2 3.75Å; Y689-F762 HydrophobicContact CE2-CD2 4.09Å; Y689-F762 AromaticContact CG-CD2 3.95Å; Y689-F762 HydrophobicContact CG-CD2 3.95Å; Y689-F762 AromaticContact CG-CE2 3.72Å; Y689-F762 HydrophobicContact CG-CE2 3.72Å; S760-F762 PolarHBondContact O-N 3.24Å; F762-A764 VanDerWaalsContact C-N 3.34Å; F762-A764 PolarHBondContact O-N 2.74Å; F762-L765 WeakPolarHBondContact O-CB 3.27Å; F762-L765 PolarHBondContact O-N 2.93Å
763	H	50.2	Low	55.6	Low	74 Å²	74	77.7 Å²	77.7	34%	0.343	40%	0.401	S	S	.	.	H	α-helix	trans	-72.7	-27.6	-177.8	-157	27.3	0	0	0	112.8	R759 L765 S766	R759-H763 PolarHBondContact NH1-CD2 2.92Å; R759-H763 PolarHBondContact NH1-NE2 3.5Å; H763-L765 PolarHBondContact O-N 2.94Å; H763-S766 WeakPolarHBondContact O-CB 3.45Å; H763-S766 PolarHBondContact O-N 3.04Å
764	A	53.1	Low	58.8	Low	44 Å²	44	75.5 Å²	75.5	36%	0.364	38%	0.382	S	S	.	.	H	α-helix	trans	-62	-26.3	173.2	0	0	0	0	0	113	R759 F762 W768	R759-A764 WeakPolarHBondContact O-CB 3.37Å; F762-A764 VanDerWaalsContact C-N 3.34Å; F762-A764 PolarHBondContact O-N 2.74Å; A764-W768 VanDerWaalsContact O-CD1 3.27Å
765	L	57.7	Low	62.1	Low	8 Å²	8	68.1 Å²	68.1	4%	0.042	35%	0.35	C	S	.	.	H	α-helix	trans	-76.6	-24.8	174.4	-66.3	177.7	0	0	0	112.7	M685 V688 Y689 E692 G761 F762 H763 E767 W768	M685-L765 HydrophobicContact CE-CB 3.95Å; V688-L765 HydrophobicContact CB-CB 4.46Å; V688-L765 HydrophobicContact CG1-CB 3.8Å; V688-L765 HydrophobicContact CG1-CD2 4.25Å; V688-L765 HydrophobicContact CG1-CG 4.41Å; Y689-L765 HydrophobicContact CD2-CD1 4.32Å; E692-L765 HydrophobicContact CB-CD1 4.33Å; E692-L765 HydrophobicContact CG-CD1 4.28Å; E692-L765 HydrophobicContact CG-CD2 3.8Å; G761-L765 WeakPolarHBondContact O-CG 3.2Å; G761-L765 PolarHBondContact O-N 2.98Å; F762-L765 WeakPolarHBondContact O-CB 3.27Å; F762-L765 PolarHBondContact O-N 2.93Å; H763-L765 PolarHBondContact O-N 2.94Å; L765-E767 PolarHBondContact O-N 2.98Å; L765-W768 HydrophobicContact CD2-CZ2 3.85Å; L765-W768 WeakPolarHBondContact O-CB 3.48Å; L765-W768 PolarHBondContact O-N 3.48Å
766	S	59.8	Low	65.4	Low	35 Å²	35	65.3 Å²	65.3	25%	0.245	33%	0.329	C	S	.	.	H	α-helix	trans	-59.8	-38.1	-179.7	-149.6	0	0	0	0	112.2	R684 M685 H763 W768	R684-S766 PolarHBondContact NH1-O 3.47Å; M685-S766 WeakPolarHBondContact CG-OG 3.48Å; M685-S766 VanDerWaalsContact SD-CA 3.58Å; M685-S766 WeakPolarHBondContact SD-CB 3.34Å; M685-S766 PolarHBondContact SD-OG 2.99Å; H763-S766 WeakPolarHBondContact O-CB 3.45Å; H763-S766 PolarHBondContact O-N 3.04Å; S766-W768 VanDerWaalsContact C-N 3.26Å; S766-W768 PolarHBondContact O-N 3.44Å
767	E	70.9	Confident	68.8	Low	129 Å²	129	55.9 Å²	55.9	60%	0.603	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	1.9	-172.9	-64.5	176.7	-174.9	0	0	112.1	L765 P769	L765-E767 PolarHBondContact O-N 2.98Å; E767-P769 WeakPolarHBondContact O-CD 3.34Å; E767-P769 VanDerWaalsContact O-N 3.07Å
768	W	83.8	Confident	72.3	Confident	27 Å²	27	46 Å²	46	10%	0.102	25%	0.251	C	S	.	.			trans	-63	114.8	177.9	-82.6	37.6	0	0	0	109.3	R684 E692 Y729 A764 L765 S766 R772 L773 R776	R684-W768 PolarHBondContact NH1-O 3.37Å; R684-W768 VanDerWaalsContact NH1-O 3.1Å; R684-W768 PolarHBondContact NH2-O 3.4Å; E692-W768 HydrophobicContact CG-CH2 4.27Å; E692-W768 WeakPolarHBondContact OE1-CH2 3.34Å; Y729-W768 HydrophobicContact CE1-CZ3 4.32Å; A764-W768 VanDerWaalsContact O-CD1 3.27Å; L765-W768 HydrophobicContact CD2-CZ2 3.85Å; L765-W768 WeakPolarHBondContact O-CB 3.48Å; L765-W768 PolarHBondContact O-N 3.48Å; S766-W768 VanDerWaalsContact C-N 3.26Å; S766-W768 PolarHBondContact O-N 3.44Å; W768-R772 HydrophobicContact CD2-CG 4.04Å; W768-R772 HydrophobicContact CE3-CB 4.32Å; W768-R772 HydrophobicContact CE3-CG 3.7Å; W768-R772 HydrophobicContact CZ3-CG 4.15Å; W768-L773 HydrophobicContact CB-CD2 4.04Å; W768-L773 HydrophobicContact CD2-CD2 4.49Å; W768-L773 HydrophobicContact CE3-CD2 3.76Å; W768-R776 VanDerWaalsContact CH2-NH2 3.3Å
769	P	88.6	Confident	75.5	Confident	50 Å²	50	42.5 Å²	42.5	33%	0.325	22%	0.221	S	C	.	.			trans	-68.1	161.8	177.7	-21.5	37.7	0	0	0	110.4	E767 Y771 R772 L773	E767-P769 WeakPolarHBondContact O-CD 3.34Å; E767-P769 VanDerWaalsContact O-N 3.07Å; P769-Y771 HydrophobicContact CB-CD1 3.54Å; P769-Y771 HydrophobicContact CB-CE1 3.25Å; P769-Y771 HydrophobicContact CB-CG 4.3Å; P769-Y771 HydrophobicContact CG-CD1 4.36Å; P769-Y771 HydrophobicContact CG-CE1 3.58Å; P769-Y771 PolarHBondContact O-N 2.98Å; P769-R772 WeakPolarHBondContact O-CB 3.39Å; P769-R772 PolarHBondContact O-N 3.12Å; P769-L773 PolarHBondContact O-N 3.36Å
770	I	91.1	Very high	78.4	Confident	66 Å²	66	37.6 Å²	37.6	34%	0.338	20%	0.203	S	C	.	.	H	α-helix	trans	-54.6	-43.4	-177.9	-64.5	174.7	0	0	0	111.1	A733 R772 L773 Q774	A733-I770 HydrophobicContact CB-CG2 4.43Å; I770-R772 PolarHBondContact O-N 2.97Å; I770-L773 WeakPolarHBondContact O-CB 3.42Å; I770-L773 PolarHBondContact O-N 3.45Å; I770-L773 VanDerWaalsContact O-N 3.08Å; I770-Q774 HydrophobicContact CG2-CG 4.23Å; I770-Q774 WeakPolarHBondContact O-CG 3.34Å; I770-Q774 PolarHBondContact O-N 3.23Å
771	Y	93.1	Very high	81.3	Confident	23 Å²	23	35.5 Å²	35.5	9%	0.09	18%	0.184	C	C	.	.	H	α-helix	trans	-58.1	-33.7	179.4	68.7	-105.2	0	0	0	113.2	P769 Q774 G775 A802 A806 A809 I814 Y818	P769-Y771 HydrophobicContact CB-CD1 3.54Å; P769-Y771 HydrophobicContact CB-CE1 3.25Å; P769-Y771 HydrophobicContact CB-CG 4.3Å; P769-Y771 HydrophobicContact CG-CD1 4.36Å; P769-Y771 HydrophobicContact CG-CE1 3.58Å; P769-Y771 PolarHBondContact O-N 2.98Å; Y771-Q774 PolarHBondContact O-N 3.03Å; Y771-G775 PolarHBondContact O-N 2.94Å; Y771-A802 WeakPolarHBondContact CB-O 3.47Å; Y771-A802 VanDerWaalsContact O-CB 3.3Å; Y771-A802 WeakPolarHBondContact O-CB 3.49Å; Y771-A806 HydrophobicContact CD1-CB 4.5Å; Y771-A806 HydrophobicContact CD2-CB 3.89Å; Y771-A806 HydrophobicContact CE2-CB 4.21Å; Y771-A806 HydrophobicContact CG-CB 4.08Å; Y771-A809 HydrophobicContact CD1-CB 4.15Å; Y771-A809 HydrophobicContact CE1-CB 3.54Å; Y771-I814 HydrophobicContact CE2-CG2 4.32Å; Y771-Y818 HydrophobicContact CD2-CE2 4.2Å
772	R	93.1	Very high	83.6	Confident	96 Å²	96	35 Å²	35	36%	0.362	18%	0.176	S	C	.	.	H	α-helix	trans	-73.4	-36.4	179.6	-168.7	177.7	179.3	98.2	1	111.4	W768 P769 I770 R776	W768-R772 HydrophobicContact CD2-CG 4.04Å; W768-R772 HydrophobicContact CE3-CB 4.32Å; W768-R772 HydrophobicContact CE3-CG 3.7Å; W768-R772 HydrophobicContact CZ3-CG 4.15Å; P769-R772 WeakPolarHBondContact O-CB 3.39Å; P769-R772 PolarHBondContact O-N 3.12Å; I770-R772 PolarHBondContact O-N 2.97Å; R772-R776 PolarHBondContact O-N 3.03Å; R772-R776 VanDerWaalsContact O-N 3.11Å
773	L	94.1	Very high	85.6	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.9	-43	173.2	-56.7	176.5	0	0	0	110.6	R684 V688 Y729 A732 A733 W768 P769 I770 R776 L777	R684-L773 VanDerWaalsContact NH2-CD1 3.29Å; V688-L773 HydrophobicContact CG1-CD2 4.22Å; V688-L773 HydrophobicContact CG2-CD1 4.47Å; V688-L773 HydrophobicContact CG2-CD2 3.94Å; Y729-L773 HydrophobicContact CD1-CB 4.34Å; Y729-L773 HydrophobicContact CD1-CD2 3.65Å; Y729-L773 HydrophobicContact CE1-CD2 3.87Å; A732-L773 HydrophobicContact CB-CD1 3.92Å; A733-L773 HydrophobicContact CB-CD1 4.27Å; W768-L773 HydrophobicContact CB-CD2 4.04Å; W768-L773 HydrophobicContact CD2-CD2 4.49Å; W768-L773 HydrophobicContact CE3-CD2 3.76Å; P769-L773 PolarHBondContact O-N 3.36Å; I770-L773 WeakPolarHBondContact O-CB 3.42Å; I770-L773 PolarHBondContact O-N 3.45Å; I770-L773 VanDerWaalsContact O-N 3.08Å; L773-R776 PolarHBondContact O-N 3.29Å; L773-L777 WeakPolarHBondContact O-CG 3.32Å; L773-L777 PolarHBondContact O-N 3.35Å
774	Q	95.5	Very high	87.7	Confident	35 Å²	35	37.6 Å²	37.6	16%	0.164	19%	0.19	C	C	.	.	H	α-helix	trans	-63.7	-43.4	176.2	-70.7	173.7	-48.6	0	0	112	I770 Y771 R776 L777 G778 L798 S801 A802	I770-Q774 HydrophobicContact CG2-CG 4.23Å; I770-Q774 WeakPolarHBondContact O-CG 3.34Å; I770-Q774 PolarHBondContact O-N 3.23Å; Y771-Q774 PolarHBondContact O-N 3.03Å; Q774-R776 VanDerWaalsContact C-N 3.31Å; Q774-R776 PolarHBondContact O-N 3.11Å; Q774-L777 CarbonylContact O-C 3.57Å; Q774-L777 WeakPolarHBondContact O-CB 3.48Å; Q774-L777 PolarHBondContact O-N 2.79Å; Q774-G778 PolarHBondContact O-N 3.38Å; Q774-L798 HydrophobicContact CB-CD2 4.36Å; Q774-L798 HydrophobicContact CG-CD2 4.35Å; Q774-S801 PolarHBondContact NE2-OG 2.91Å; Q774-A802 HydrophobicContact CB-CB 3.87Å
775	G	95.9	Very high	89.6	Confident	4 Å²	4	37.2 Å²	37.2	4%	0.041	19%	0.191	C	C	.	.	H	α-helix	trans	-60.3	-39.7	175.1	0	0	0	0	0	112.7	Y771 G778 E779 F799	Y771-G775 PolarHBondContact O-N 2.94Å; G775-G778 PolarHBondContact O-N 3.38Å; G775-E779 PolarHBondContact O-N 3.17Å; G775-F799 WeakPolarHBondContact O-CE1 3.35Å
776	R	94.8	Very high	91.1	Very high	40 Å²	40	40.9 Å²	40.9	15%	0.151	21%	0.208	C	C	.	.	H	α-helix	trans	-66.3	-41.9	174.2	-171.2	62.5	63.4	102.3	6.5	111.9	E692 Y695 Y729 W768 R772 L773 Q774 E779 M780	E692-R776 IonicContact OE1-CZ 3.6Å; E692-R776 IonicContact OE1-NH1 3.14Å; E692-R776 PolarHBondContact OE1-NH1 3.21Å; E692-R776 IonicContact OE1-NH2 2.67Å; Y695-R776 VanDerWaalsContact CD1-NH1 3.25Å; Y695-R776 HydrophobicContact CD2-CG 4.44Å; Y695-R776 HydrophobicContact CE2-CG 4.41Å; Y729-R776 HydrophobicContact CD2-CG 4.34Å; Y729-R776 HydrophobicContact CE1-CG 4.27Å; Y729-R776 HydrophobicContact CE2-CB 4.49Å; Y729-R776 HydrophobicContact CE2-CG 3.63Å; W768-R776 VanDerWaalsContact CH2-NH2 3.3Å; R772-R776 PolarHBondContact O-N 3.03Å; R772-R776 VanDerWaalsContact O-N 3.11Å; L773-R776 PolarHBondContact O-N 3.29Å; Q774-R776 VanDerWaalsContact C-N 3.31Å; Q774-R776 PolarHBondContact O-N 3.11Å; R776-E779 PolarHBondContact O-N 2.66Å; R776-M780 HydrophobicContact CG-SD 4.31Å; R776-M780 VanDerWaalsContact O-CG 3.25Å; R776-M780 WeakPolarHBondContact O-CG 3.48Å; R776-M780 PolarHBondContact O-N 3.36Å; R776-M780 VanDerWaalsContact O-N 3.14Å
777	L	97.1	Very high	92.6	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-60.7	-43.6	173	-78	166.8	0	0	0	111.8	A726 Y729 E730 L773 Q774 E779 M780 Y781 L798	A726-L777 HydrophobicContact CB-CD2 3.88Å; Y729-L777 HydrophobicContact CD2-CD2 4.44Å; Y729-L777 HydrophobicContact CG-CD2 4.44Å; Y729-L777 HydrophobicContact CG-CG 4.31Å; E730-L777 HydrophobicContact CG-CD1 3.87Å; E730-L777 HydrophobicContact CG-CD2 4.06Å; L773-L777 WeakPolarHBondContact O-CG 3.32Å; L773-L777 PolarHBondContact O-N 3.35Å; Q774-L777 CarbonylContact O-C 3.57Å; Q774-L777 WeakPolarHBondContact O-CB 3.48Å; Q774-L777 PolarHBondContact O-N 2.79Å; L777-E779 PolarHBondContact O-N 3.06Å; L777-M780 PolarHBondContact O-N 3.24Å; L777-Y781 HydrophobicContact CD2-CE2 4.2Å; L777-Y781 VanDerWaalsContact O-CD2 3.28Å; L777-Y781 WeakPolarHBondContact O-CD2 3.44Å; L777-Y781 PolarHBondContact O-N 3.45Å; L777-L798 HydrophobicContact CB-CD1 3.73Å; L777-L798 HydrophobicContact CB-CD2 4.17Å; L777-L798 HydrophobicContact CD1-CD2 4.35Å
778	G	97.4	Very high	93.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.9	-46.4	177.9	0	0	0	0	0	111.6	Q774 G775 M780 Y781 A782 A795 F799	Q774-G778 PolarHBondContact O-N 3.38Å; G775-G778 PolarHBondContact O-N 3.38Å; G778-M780 VanDerWaalsContact C-N 3.33Å; G778-M780 PolarHBondContact O-N 3.19Å; G778-Y781 PolarHBondContact O-N 3.14Å; G778-A782 VanDerWaalsContact O-CB 3.23Å; G778-A782 WeakPolarHBondContact O-CB 3.35Å; G778-A782 PolarHBondContact O-N 3.43Å; G778-A795 WeakPolarHBondContact O-CB 3.19Å; G778-F799 VanDerWaalsContact C-CE2 3.48Å
779	E	96.6	Very high	94.4	Very high	49 Å²	49	40.9 Å²	40.9	23%	0.229	23%	0.23	C	C	.	.	H	α-helix	trans	-58.1	-44.9	175.7	-169.8	-161.9	159.5	0	0	112.2	Y695 G775 R776 L777 K783 F799	Y695-E779 PolarHBondContact OH-OE1 3.34Å; Y695-E779 VanDerWaalsContact OH-OE1 3.05Å; Y695-E779 PolarHBondContact OH-OE2 3.2Å; G775-E779 PolarHBondContact O-N 3.17Å; R776-E779 PolarHBondContact O-N 2.66Å; L777-E779 PolarHBondContact O-N 3.06Å; E779-K783 HydrophobicContact CG-CD 4.26Å; E779-K783 WeakPolarHBondContact O-CG 3.37Å; E779-K783 PolarHBondContact O-N 3.38Å; E779-K783 VanDerWaalsContact O-N 3.15Å; E779-K783 IonicContact OE1-NZ 3.6Å; E779-K783 PolarHBondContact OE1-NZ 3.43Å; E779-F799 HydrophobicContact CB-CZ 4.28Å
780	M	97.2	Very high	94.7	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.3	-45.5	-179.8	-67.7	166.6	63.9	0	0	111.9	Y695 W722 A725 A726 Y729 R776 L777 G778 G784 L788	Y695-M780 HydrophobicContact CD2-CE 4.43Å; Y695-M780 HydrophobicContact CD2-CG 3.76Å; Y695-M780 HydrophobicContact CD2-SD 3.68Å; Y695-M780 HydrophobicContact CE2-CG 3.68Å; Y695-M780 HydrophobicContact CE2-SD 4.18Å; W722-M780 HydrophobicContact CB-CE 3.7Å; W722-M780 HydrophobicContact CD2-CG 4.39Å; W722-M780 HydrophobicContact CE3-CB 4.35Å; W722-M780 HydrophobicContact CG-CE 3.98Å; W722-M780 WeakPolarHBondContact O-CE 3.41Å; A725-M780 HydrophobicContact CB-CE 3.61Å; A726-M780 HydrophobicContact CB-CE 3.87Å; Y729-M780 HydrophobicContact CD2-SD 3.88Å; Y729-M780 HydrophobicContact CE2-SD 3.88Å; R776-M780 HydrophobicContact CG-SD 4.31Å; R776-M780 VanDerWaalsContact O-CG 3.25Å; R776-M780 WeakPolarHBondContact O-CG 3.48Å; R776-M780 PolarHBondContact O-N 3.36Å; R776-M780 VanDerWaalsContact O-N 3.14Å; L777-M780 PolarHBondContact O-N 3.24Å; G778-M780 VanDerWaalsContact C-N 3.33Å; G778-M780 PolarHBondContact O-N 3.19Å; M780-G784 PolarHBondContact O-N 3.19Å; M780-L788 HydrophobicContact CB-CD2 3.82Å; M780-L788 HydrophobicContact CE-CD2 4.33Å
781	Y	97.8	Very high	94.9	Very high	26 Å²	26	44.8 Å²	44.8	10%	0.102	24%	0.239	C	C	.	.	H	α-helix	trans	-70	-33.4	178.5	-81.5	-65.5	0	0	0	112.9	A726 E730 L777 G778 L788 R790 D791 K794 L798	A726-Y781 HydrophobicContact CB-CE2 4.49Å; E730-Y781 PolarHBondContact OE1-OH 2.84Å; L777-Y781 HydrophobicContact CD2-CE2 4.2Å; L777-Y781 VanDerWaalsContact O-CD2 3.28Å; L777-Y781 WeakPolarHBondContact O-CD2 3.44Å; L777-Y781 PolarHBondContact O-N 3.45Å; G778-Y781 PolarHBondContact O-N 3.14Å; Y781-L788 HydrophobicContact CD1-CD1 4.36Å; Y781-L788 HydrophobicContact CD1-CD2 4.03Å; Y781-L788 HydrophobicContact CD1-CG 4.26Å; Y781-L788 HydrophobicContact CE1-CD1 3.68Å; Y781-L788 HydrophobicContact CE1-CD2 4.08Å; Y781-L788 HydrophobicContact CE1-CG 4.07Å; Y781-L788 HydrophobicContact CG-CD2 4.36Å; Y781-R790 WeakPolarHBondContact O-CA 3.36Å; Y781-R790 WeakPolarHBondContact O-CG 3.43Å; Y781-D791 HydrophobicContact CD1-CB 3.98Å; Y781-D791 PolarHBondContact O-N 3.03Å; Y781-K794 HydrophobicContact CD1-CD 4.17Å; Y781-K794 HydrophobicContact CD2-CD 4.01Å; Y781-K794 HydrophobicContact CD2-CG 4.27Å; Y781-K794 HydrophobicContact CE1-CD 3.94Å; Y781-K794 HydrophobicContact CE2-CD 3.77Å; Y781-K794 VanDerWaalsContact CE2-CE 3.44Å; Y781-K794 HydrophobicContact CE2-CG 4.46Å; Y781-K794 HydrophobicContact CG-CD 4.22Å; Y781-K794 HydrophobicContact CG-CG 4.43Å; Y781-K794 PolarHBondContact OH-NZ 3.35Å; Y781-L798 HydrophobicContact CD2-CD1 3.57Å; Y781-L798 HydrophobicContact CE2-CD1 4.15Å
782	A	95.8	Very high	94.9	Very high	20 Å²	20	46.5 Å²	46.5	17%	0.165	25%	0.245	C	C	.	.	H	α-helix	trans	-64.9	-43.4	176.7	0	0	0	0	0	111.9	G778 R790 A795 F799 L825	G778-A782 VanDerWaalsContact O-CB 3.23Å; G778-A782 WeakPolarHBondContact O-CB 3.35Å; G778-A782 PolarHBondContact O-N 3.43Å; A782-R790 VanDerWaalsContact O-CD 3.32Å; A782-R790 WeakPolarHBondContact O-CD 3.44Å; A782-R790 WeakPolarHBondContact O-CG 3.28Å; A782-A795 HydrophobicContact CB-CB 3.83Å; A782-F799 HydrophobicContact CB-CE2 4.24Å; A782-L825 HydrophobicContact CB-CD1 4.35Å; A782-L825 HydrophobicContact CB-CD2 3.98Å
783	K	94.4	Very high	94.9	Very high	120 Å²	120	45 Å²	45	52%	0.522	25%	0.253	S	S	.	.	H	α-helix	trans	-79.2	-47.5	-179.8	-70.2	175.8	-177.8	174.9	0	111.9	W722 E779	W722-K783 HydrophobicContact CH2-CB 4.05Å; W722-K783 HydrophobicContact CH2-CD 4.02Å; W722-K783 HydrophobicContact CZ3-CB 3.75Å; E779-K783 HydrophobicContact CG-CD 4.26Å; E779-K783 WeakPolarHBondContact O-CG 3.37Å; E779-K783 PolarHBondContact O-N 3.38Å; E779-K783 VanDerWaalsContact O-N 3.15Å; E779-K783 IonicContact OE1-NZ 3.6Å; E779-K783 PolarHBondContact OE1-NZ 3.43Å
784	G	93	Very high	95	Very high	13 Å²	13	47.7 Å²	47.7	13%	0.134	27%	0.265	C	S	.	.			trans	61.3	177.9	-165.4	0	0	0	0	0	113.2	W722 M780	W722-G784 WeakPolarHBondContact CZ3-O 3.28Å; M780-G784 PolarHBondContact O-N 3.19Å
785	G	92.8	Very high	95.1	Very high	37 Å²	37	46 Å²	46	38%	0.381	26%	0.257	S	S	.	.	B	Isolated β-bridge	trans	105.3	179.2	-173.6	0	0	0	0	0	112.1	G787 L788	G785-G787 PolarHBondContact O-N 2.97Å; G785-G787 VanDerWaalsContact O-N 3.15Å; G785-L788 PolarHBondContact N-O 2.93Å; G785-L788 WeakPolarHBondContact O-CB 3.25Å; G785-L788 PolarHBondContact O-N 3.24Å
786	H	91.1	Very high	95.1	Very high	84 Å²	84	49.3 Å²	49.3	39%	0.389	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	39.9	-179.6	-63.7	-72.4	0	0	0	113.5	P720 W722 L788	P720-H786 HydrophobicContact CB-CB 4.37Å; P720-H786 VanDerWaalsContact O-CB 3.32Å; P720-H786 WeakPolarHBondContact O-CB 3.45Å; P720-H786 PolarHBondContact O-ND1 3.19Å; P720-H786 VanDerWaalsContact O-ND1 3.16Å; W722-H786 HydrophobicContact CB-CB 3.79Å; W722-H786 HydrophobicContact CD2-CB 3.9Å; W722-H786 AromaticContact CD2-CD2 3.77Å; W722-H786 AromaticContact CE2-CD2 3.51Å; W722-H786 HydrophobicContact CE3-CB 4.49Å; W722-H786 HydrophobicContact CG-CB 3.55Å; W722-H786 AromaticContact CZ2-CD2 3.74Å; W722-H786 PolarHBondContact N-O 3.06Å; W722-H786 AromaticContact NE1-CD2 3.83Å; H786-L788 VanDerWaalsContact C-N 3.27Å; H786-L788 PolarHBondContact O-N 3.42Å
787	G	91.2	Very high	95.2	Very high	61 Å²	61	53.9 Å²	53.9	63%	0.629	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	-13.5	-176.6	0	0	0	0	0	115.4	G785	G785-G787 PolarHBondContact O-N 2.97Å; G785-G787 VanDerWaalsContact O-N 3.15Å
788	L	96.4	Very high	95.2	Very high	11 Å²	11	54.8 Å²	54.8	6%	0.058	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-88.2	129.6	177.5	-168.7	68.5	0	0	0	111.3	W722 L723 A726 M780 Y781 G785 H786	W722-L788 HydrophobicContact CB-CB 3.75Å; W722-L788 HydrophobicContact CB-CD2 4.22Å; L723-L788 HydrophobicContact CD1-CD1 4.21Å; A726-L788 HydrophobicContact CB-CD1 4.16Å; A726-L788 HydrophobicContact CB-CD2 4.39Å; M780-L788 HydrophobicContact CB-CD2 3.82Å; M780-L788 HydrophobicContact CE-CD2 4.33Å; Y781-L788 HydrophobicContact CD1-CD1 4.36Å; Y781-L788 HydrophobicContact CD1-CD2 4.03Å; Y781-L788 HydrophobicContact CD1-CG 4.26Å; Y781-L788 HydrophobicContact CE1-CD1 3.68Å; Y781-L788 HydrophobicContact CE1-CD2 4.08Å; Y781-L788 HydrophobicContact CE1-CG 4.07Å; Y781-L788 HydrophobicContact CG-CD2 4.36Å; G785-L788 PolarHBondContact N-O 2.93Å; G785-L788 WeakPolarHBondContact O-CB 3.25Å; G785-L788 PolarHBondContact O-N 3.24Å; H786-L788 VanDerWaalsContact C-N 3.27Å; H786-L788 PolarHBondContact O-N 3.42Å
789	V	95.8	Very high	95.3	Very high	120 Å²	120	55 Å²	55	73%	0.727	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-74	131.4	174	-179.5	0	0	0	0	109.1	D791	V789-D791 PolarHBondContact O-N 3.24Å
790	R	95.1	Very high	95.3	Very high	130 Å²	130	55 Å²	55	49%	0.491	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-63.9	125.7	175.1	-170.2	176.7	66.6	-176.3	1.9	109.9	Y781 A782 R792	Y781-R790 WeakPolarHBondContact O-CA 3.36Å; Y781-R790 WeakPolarHBondContact O-CG 3.43Å; A782-R790 VanDerWaalsContact O-CD 3.32Å; A782-R790 WeakPolarHBondContact O-CD 3.44Å; A782-R790 WeakPolarHBondContact O-CG 3.28Å; R790-R792 VanDerWaalsContact CZ-CZ 3.43Å
791	D	94.7	Very high	95.3	Very high	68 Å²	68	57.1 Å²	57.1	36%	0.364	31%	0.312	S	S	.	.			trans	-136.8	97.4	179	-173	-18.8	0	0	0	109.2	Y781 V789 A793 K794 A795	Y781-D791 HydrophobicContact CD1-CB 3.98Å; Y781-D791 PolarHBondContact O-N 3.03Å; V789-D791 PolarHBondContact O-N 3.24Å; D791-A793 PolarHBondContact OD1-N 3.13Å; D791-K794 HydrophobicContact CB-CB 4.02Å; D791-K794 VanDerWaalsContact CG-CB 3.4Å; D791-K794 PolarHBondContact OD1-N 3.01Å; D791-K794 WeakPolarHBondContact OD2-CB 3.48Å; D791-A795 WeakPolarHBondContact O-CB 3.18Å; D791-A795 PolarHBondContact O-N 2.79Å
792	R	93.1	Very high	95.2	Very high	58 Å²	58	55.9 Å²	55.9	22%	0.219	31%	0.307	C	S	.	.	H	α-helix	trans	-72	-33	-175.4	-63.4	-171.8	-177	109.2	-20.8	112.7	R790 A795 Y796 L825 E832	R790-R792 VanDerWaalsContact CZ-CZ 3.43Å; R792-A795 PolarHBondContact O-N 2.89Å; R792-Y796 WeakPolarHBondContact O-CB 3.32Å; R792-Y796 PolarHBondContact O-N 2.79Å; R792-L825 HydrophobicContact CB-CD2 4.27Å; R792-L825 HydrophobicContact CG-CD2 4.2Å; R792-E832 IonicContact CZ-OE1 3.34Å; R792-E832 IonicContact CZ-OE2 2.76Å; R792-E832 IonicContact NH1-OE1 2.83Å; R792-E832 PolarHBondContact NH1-OE1 2.92Å; R792-E832 IonicContact NH1-OE2 3.65Å; R792-E832 PolarHBondContact NH1-OE2 3.47Å; R792-E832 IonicContact NH2-OE1 3.92Å; R792-E832 PolarHBondContact NH2-OE1 3.42Å; R792-E832 IonicContact NH2-OE2 3.24Å
793	A	93.7	Very high	95.3	Very high	64 Å²	64	54.9 Å²	54.9	53%	0.529	30%	0.3	S	S	.	.	H	α-helix	trans	-66.8	-48.2	178.4	0	0	0	0	0	109.9	D791 A795 Y796 E797	D791-A793 PolarHBondContact OD1-N 3.13Å; A793-A795 VanDerWaalsContact C-N 3.33Å; A793-A795 PolarHBondContact O-N 3.26Å; A793-Y796 WeakPolarHBondContact O-CB 3.43Å; A793-Y796 PolarHBondContact O-N 3.11Å; A793-E797 PolarHBondContact O-N 2.84Å; A793-E797 VanDerWaalsContact O-N 3.12Å
794	K	95.4	Very high	95.4	Very high	58 Å²	58	54.1 Å²	54.1	25%	0.252	30%	0.298	S	S	.	.	H	α-helix	trans	-62.5	-39.8	175.1	-172.6	174	-179.3	-178.6	0	112.3	E730 Y781 D791 E797 L798	E730-K794 IonicContact OE1-NZ 2.79Å; E730-K794 PolarHBondContact OE1-NZ 3.04Å; Y781-K794 HydrophobicContact CD1-CD 4.17Å; Y781-K794 HydrophobicContact CD2-CD 4.01Å; Y781-K794 HydrophobicContact CD2-CG 4.27Å; Y781-K794 HydrophobicContact CE1-CD 3.94Å; Y781-K794 HydrophobicContact CE2-CD 3.77Å; Y781-K794 VanDerWaalsContact CE2-CE 3.44Å; Y781-K794 HydrophobicContact CE2-CG 4.46Å; Y781-K794 HydrophobicContact CG-CD 4.22Å; Y781-K794 HydrophobicContact CG-CG 4.43Å; Y781-K794 PolarHBondContact OH-NZ 3.35Å; D791-K794 HydrophobicContact CB-CB 4.02Å; D791-K794 VanDerWaalsContact CG-CB 3.4Å; D791-K794 PolarHBondContact OD1-N 3.01Å; D791-K794 WeakPolarHBondContact OD2-CB 3.48Å; K794-E797 PolarHBondContact O-N 2.63Å; K794-L798 HydrophobicContact CG-CD1 3.99Å; K794-L798 WeakPolarHBondContact O-CB 3.38Å; K794-L798 WeakPolarHBondContact O-CD1 3.44Å; K794-L798 VanDerWaalsContact O-CG 3.28Å; K794-L798 WeakPolarHBondContact O-CG 3.36Å; K794-L798 PolarHBondContact O-N 3.03Å
795	A	96.8	Very high	95.4	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62.1	-42.3	176.8	0	0	0	0	0	112.6	G778 A782 D791 R792 A793 L798 F799 L825	G778-A795 WeakPolarHBondContact O-CB 3.19Å; A782-A795 HydrophobicContact CB-CB 3.83Å; D791-A795 WeakPolarHBondContact O-CB 3.18Å; D791-A795 PolarHBondContact O-N 2.79Å; R792-A795 PolarHBondContact O-N 2.89Å; A793-A795 VanDerWaalsContact C-N 3.33Å; A793-A795 PolarHBondContact O-N 3.26Å; A795-L798 PolarHBondContact O-N 3.38Å; A795-F799 WeakPolarHBondContact O-CD2 3.07Å; A795-F799 PolarHBondContact O-N 3.45Å; A795-L825 HydrophobicContact CB-CD1 3.67Å
796	Y	96.9	Very high	95.4	Very high	72 Å²	72	52.7 Å²	52.7	28%	0.282	28%	0.283	S	S	.	.	H	α-helix	trans	-59.3	-51.3	175.6	174.2	-89.5	0	0	0	111.3	R792 A793 L798 F799 E800 A822 E826	R792-Y796 WeakPolarHBondContact O-CB 3.32Å; R792-Y796 PolarHBondContact O-N 2.79Å; A793-Y796 WeakPolarHBondContact O-CB 3.43Å; A793-Y796 PolarHBondContact O-N 3.11Å; Y796-L798 VanDerWaalsContact C-N 3.27Å; Y796-L798 PolarHBondContact O-N 3.49Å; Y796-F799 PolarHBondContact O-N 3.41Å; Y796-F799 VanDerWaalsContact O-N 3.12Å; Y796-E800 HydrophobicContact CD1-CG 4.23Å; Y796-E800 HydrophobicContact CE1-CG 3.77Å; Y796-E800 HydrophobicContact CE2-CG 4.27Å; Y796-E800 PolarHBondContact O-N 2.9Å; Y796-A822 HydrophobicContact CD2-CB 3.89Å; Y796-A822 WeakPolarHBondContact CD2-O 3.29Å; Y796-A822 HydrophobicContact CE2-CB 3.97Å; Y796-E826 HydrophobicContact CD2-CG 3.89Å; Y796-E826 HydrophobicContact CE2-CG 3.44Å; Y796-E826 VanDerWaalsContact CE2-CG 3.44Å; Y796-E826 WeakPolarHBondContact CE2-OE1 3.44Å; Y796-E826 PolarHBondContact OH-OE1 3.45Å
797	E	97.1	Very high	95.6	Very high	136 Å²	136	52.9 Å²	52.9	64%	0.636	29%	0.286	S	S	*	.	H	α-helix	trans	-58.4	-39.6	178.1	-69.2	-179.5	178.9	0	0	112.4	A793 K794 S801	A793-E797 PolarHBondContact O-N 2.84Å; A793-E797 VanDerWaalsContact O-N 3.12Å; K794-E797 PolarHBondContact O-N 2.63Å; E797-S801 WeakPolarHBondContact O-CB 3.44Å; E797-S801 PolarHBondContact O-N 3.33Å
798	L	97.5	Very high	95.7	Very high	24 Å²	24	57.4 Å²	57.4	13%	0.126	29%	0.29	C	S	.	.	H	α-helix	trans	-67.2	-38.4	177.1	-75.8	165	0	0	0	112.6	Q774 L777 Y781 K794 A795 Y796 A802	Q774-L798 HydrophobicContact CB-CD2 4.36Å; Q774-L798 HydrophobicContact CG-CD2 4.35Å; L777-L798 HydrophobicContact CB-CD1 3.73Å; L777-L798 HydrophobicContact CB-CD2 4.17Å; L777-L798 HydrophobicContact CD1-CD2 4.35Å; Y781-L798 HydrophobicContact CD2-CD1 3.57Å; Y781-L798 HydrophobicContact CE2-CD1 4.15Å; K794-L798 HydrophobicContact CG-CD1 3.99Å; K794-L798 WeakPolarHBondContact O-CB 3.38Å; K794-L798 WeakPolarHBondContact O-CD1 3.44Å; K794-L798 VanDerWaalsContact O-CG 3.28Å; K794-L798 WeakPolarHBondContact O-CG 3.36Å; K794-L798 PolarHBondContact O-N 3.03Å; A795-L798 PolarHBondContact O-N 3.38Å; Y796-L798 VanDerWaalsContact C-N 3.27Å; Y796-L798 PolarHBondContact O-N 3.49Å; L798-A802 WeakPolarHBondContact O-CB 3.44Å; L798-A802 PolarHBondContact O-N 3.18Å
799	F	98.3	Very high	95.3	Very high	5 Å²	5	59.2 Å²	59.2	2%	0.022	31%	0.307	C	S	.	.	H	α-helix	trans	-71.2	-41.6	177.1	-77.8	-53.9	0	0	0	112.4	G775 G778 E779 A782 A795 Y796 A802 A803 Y818 Q821 A822 L825	G775-F799 WeakPolarHBondContact O-CE1 3.35Å; G778-F799 VanDerWaalsContact C-CE2 3.48Å; E779-F799 HydrophobicContact CB-CZ 4.28Å; A782-F799 HydrophobicContact CB-CE2 4.24Å; A795-F799 WeakPolarHBondContact O-CD2 3.07Å; A795-F799 PolarHBondContact O-N 3.45Å; Y796-F799 PolarHBondContact O-N 3.41Å; Y796-F799 VanDerWaalsContact O-N 3.12Å; F799-A802 PolarHBondContact O-N 2.96Å; F799-A803 WeakPolarHBondContact O-CB 3.12Å; F799-A803 PolarHBondContact O-N 3.12Å; F799-Y818 AromaticContact CD1-CD1 3.7Å; F799-Y818 HydrophobicContact CD1-CD1 3.7Å; F799-Y818 HydrophobicContact CD1-CE1 4.47Å; F799-Y818 HydrophobicContact CD1-CG 4.27Å; F799-Y818 AromaticContact CE1-CD1 3.95Å; F799-Y818 HydrophobicContact CE1-CD1 3.95Å; F799-Y818 HydrophobicContact CE1-CE1 4.41Å; F799-Q821 HydrophobicContact CD1-CB 4.02Å; F799-Q821 HydrophobicContact CD2-CB 3.86Å; F799-Q821 HydrophobicContact CE1-CB 3.92Å; F799-Q821 HydrophobicContact CE1-CG 4.17Å; F799-Q821 HydrophobicContact CE2-CB 3.75Å; F799-Q821 HydrophobicContact CG-CB 3.99Å; F799-Q821 HydrophobicContact CZ-CB 3.76Å; F799-Q821 HydrophobicContact CZ-CG 4.09Å; F799-A822 HydrophobicContact CB-CB 4Å; F799-L825 HydrophobicContact CD2-CD1 3.76Å; F799-L825 HydrophobicContact CE2-CD1 3.99Å
800	E	97.2	Very high	95.2	Very high	48 Å²	48	62 Å²	62	22%	0.224	31%	0.312	C	S	.	.	H	α-helix	trans	-58.1	-51	173.1	-75.8	-66.8	128.2	0	0	110.7	Y796 A802 A803 E804 Y819 A822	Y796-E800 HydrophobicContact CD1-CG 4.23Å; Y796-E800 HydrophobicContact CE1-CG 3.77Å; Y796-E800 HydrophobicContact CE2-CG 4.27Å; Y796-E800 PolarHBondContact O-N 2.9Å; E800-A802 VanDerWaalsContact C-N 3.32Å; E800-A802 PolarHBondContact O-N 3.28Å; E800-A803 WeakPolarHBondContact O-CB 3.4Å; E800-A803 PolarHBondContact O-N 3.45Å; E800-A803 VanDerWaalsContact O-N 3.1Å; E800-E804 WeakPolarHBondContact O-CG 3.32Å; E800-E804 PolarHBondContact O-N 3.42Å; E800-Y819 WeakPolarHBondContact OE1-CD1 3.44Å; E800-Y819 WeakPolarHBondContact OE2-CE1 3.33Å; E800-A822 HydrophobicContact CG-CB 4.33Å; E800-A822 WeakPolarHBondContact OE1-CB 3.44Å
801	S	96.2	Very high	95.1	Very high	44 Å²	44	60 Å²	60	31%	0.308	31%	0.308	S	S	.	.	H	α-helix	trans	-63.5	-36.9	178.5	-173.2	0	0	0	0	112.7	Q774 E797 G805	Q774-S801 PolarHBondContact NE2-OG 2.91Å; E797-S801 WeakPolarHBondContact O-CB 3.44Å; E797-S801 PolarHBondContact O-N 3.33Å; S801-G805 PolarHBondContact O-N 3.01Å
802	A	96.5	Very high	95	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66.5	-37.2	173.8	0	0	0	0	0	112.3	Y771 Q774 L798 F799 E800 A806 Y818	Y771-A802 WeakPolarHBondContact CB-O 3.47Å; Y771-A802 VanDerWaalsContact O-CB 3.3Å; Y771-A802 WeakPolarHBondContact O-CB 3.49Å; Q774-A802 HydrophobicContact CB-CB 3.87Å; L798-A802 WeakPolarHBondContact O-CB 3.44Å; L798-A802 PolarHBondContact O-N 3.18Å; F799-A802 PolarHBondContact O-N 2.96Å; E800-A802 VanDerWaalsContact C-N 3.32Å; E800-A802 PolarHBondContact O-N 3.28Å; A802-A806 VanDerWaalsContact O-CB 3.28Å; A802-A806 WeakPolarHBondContact O-CB 3.45Å; A802-A806 PolarHBondContact O-N 2.88Å; A802-Y818 HydrophobicContact CB-CD2 3.55Å; A802-Y818 HydrophobicContact CB-CE2 3.76Å; A802-Y818 HydrophobicContact CB-CG 4.02Å
803	A	97.9	Very high	95.1	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-68	-45.2	178.4	0	0	0	0	0	111.5	F799 E800 A806 I807 A815 Y819	F799-A803 WeakPolarHBondContact O-CB 3.12Å; F799-A803 PolarHBondContact O-N 3.12Å; E800-A803 WeakPolarHBondContact O-CB 3.4Å; E800-A803 PolarHBondContact O-N 3.45Å; E800-A803 VanDerWaalsContact O-N 3.1Å; A803-A806 PolarHBondContact O-N 3.39Å; A803-I807 PolarHBondContact O-N 3.15Å; A803-A815 WeakPolarHBondContact O-CB 3.44Å; A803-Y819 HydrophobicContact CB-CD1 3.76Å; A803-Y819 HydrophobicContact CB-CD2 3.7Å; A803-Y819 HydrophobicContact CB-CE1 3.59Å; A803-Y819 HydrophobicContact CB-CE2 3.54Å; A803-Y819 HydrophobicContact CB-CG 3.8Å; A803-Y819 VanDerWaalsContact CB-CZ 3.47Å
804	E	96.1	Very high	95.1	Very high	104 Å²	104	63.8 Å²	63.8	49%	0.486	32%	0.32	S	S	.	.	H	α-helix	trans	-57.1	-52.5	174	-70.2	177.1	165.5	0	0	111	E800 A806 I807 E808	E800-E804 WeakPolarHBondContact O-CG 3.32Å; E800-E804 PolarHBondContact O-N 3.42Å; E804-A806 VanDerWaalsContact C-N 3.26Å; E804-A806 PolarHBondContact O-N 3.23Å; E804-I807 WeakPolarHBondContact O-CB 3.23Å; E804-I807 PolarHBondContact O-N 3.48Å; E804-I807 VanDerWaalsContact O-N 3.08Å; E804-E808 PolarHBondContact O-N 2.88Å
805	G	92.7	Very high	95.1	Very high	19 Å²	19	61.1 Å²	61.1	20%	0.196	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-30.7	179	0	0	0	0	0	113.6	S801 A809	S801-G805 PolarHBondContact O-N 3.01Å; G805-A809 WeakPolarHBondContact O-CB 3.28Å; G805-A809 PolarHBondContact O-N 2.95Å; G805-A809 VanDerWaalsContact O-N 3.1Å
806	A	94.8	Very high	95.1	Very high	0 Å²	0	67 Å²	67	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-73	-34.9	173.8	0	0	0	0	0	112.6	Y771 A802 A803 E804 A809 H810 E811 I814 A815	Y771-A806 HydrophobicContact CD1-CB 4.5Å; Y771-A806 HydrophobicContact CD2-CB 3.89Å; Y771-A806 HydrophobicContact CE2-CB 4.21Å; Y771-A806 HydrophobicContact CG-CB 4.08Å; A802-A806 VanDerWaalsContact O-CB 3.28Å; A802-A806 WeakPolarHBondContact O-CB 3.45Å; A802-A806 PolarHBondContact O-N 2.88Å; A803-A806 PolarHBondContact O-N 3.39Å; E804-A806 VanDerWaalsContact C-N 3.26Å; E804-A806 PolarHBondContact O-N 3.23Å; A806-A809 CarbonylContact O-C 3.6Å; A806-A809 PolarHBondContact O-N 2.66Å; A806-H810 PolarHBondContact O-N 3.43Å; A806-E811 HydrophobicContact CB-CB 4.43Å; A806-E811 WeakPolarHBondContact O-CA 3.47Å; A806-E811 PolarHBondContact O-N 3.43Å; A806-I814 HydrophobicContact CB-CG2 4.4Å; A806-A815 HydrophobicContact CB-CB 3.87Å
807	I	94.9	Very high	95.2	Very high	88 Å²	88	68.2 Å²	68.2	45%	0.451	35%	0.347	S	S	.	.	H	α-helix	trans	-63.8	-46.1	172.4	-73.1	168.2	0	0	0	110.5	A803 E804 A809 H810 A815 Y819	A803-I807 PolarHBondContact O-N 3.15Å; E804-I807 WeakPolarHBondContact O-CB 3.23Å; E804-I807 PolarHBondContact O-N 3.48Å; E804-I807 VanDerWaalsContact O-N 3.08Å; I807-A809 PolarHBondContact O-N 3.05Å; I807-H810 WeakPolarHBondContact O-CA 3.1Å; I807-H810 PolarHBondContact O-N 3.15Å; I807-A815 HydrophobicContact CD1-CB 4.31Å; I807-A815 HydrophobicContact CG1-CB 3.6Å; I807-Y819 HydrophobicContact CD1-CE2 3.72Å
808	E	91.7	Very high	95.2	Very high	156 Å²	156	63.1 Å²	63.1	73%	0.729	32%	0.322	S	S	*	.	H	α-helix	trans	-59.2	-38.6	177.5	-70.8	-178.9	173.7	0	0	111.3	E804 H810	E804-E808 PolarHBondContact O-N 2.88Å; E808-H810 PolarHBondContact O-N 3.37Å
809	A	89.9	Confident	95.2	Very high	50 Å²	50	66 Å²	66	41%	0.413	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	6.2	173.4	0	0	0	0	0	114.5	Y771 G805 A806 I807 E811	Y771-A809 HydrophobicContact CD1-CB 4.15Å; Y771-A809 HydrophobicContact CE1-CB 3.54Å; G805-A809 WeakPolarHBondContact O-CB 3.28Å; G805-A809 PolarHBondContact O-N 2.95Å; G805-A809 VanDerWaalsContact O-N 3.1Å; A806-A809 CarbonylContact O-C 3.6Å; A806-A809 PolarHBondContact O-N 2.66Å; I807-A809 PolarHBondContact O-N 3.05Å; A809-E811 PolarHBondContact O-N 2.95Å
810	H	92.9	Very high	95.2	Very high	177 Å²	177	71.5 Å²	71.5	82%	0.819	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	23.8	-177.2	-54.5	-51.2	0	0	0	115.4	A806 I807 E808 G812	A806-H810 PolarHBondContact O-N 3.43Å; I807-H810 WeakPolarHBondContact O-CA 3.1Å; I807-H810 PolarHBondContact O-N 3.15Å; E808-H810 PolarHBondContact O-N 3.37Å; H810-G812 PolarHBondContact O-N 3.48Å
811	E	93.2	Very high	95.1	Very high	89 Å²	89	73.3 Å²	73.3	42%	0.416	37%	0.366	S	S	.	.			trans	-97.4	56.8	177.5	-72.9	-72.8	-176.6	0	0	111.3	A806 A809 R813 I814 A815	A806-E811 HydrophobicContact CB-CB 4.43Å; A806-E811 WeakPolarHBondContact O-CA 3.47Å; A806-E811 PolarHBondContact O-N 3.43Å; A809-E811 PolarHBondContact O-N 2.95Å; E811-R813 PolarHBondContact O-N 3.16Å; E811-I814 HydrophobicContact CB-CB 4.38Å; E811-I814 HydrophobicContact CB-CD1 4.25Å; E811-I814 HydrophobicContact CG-CD1 4.49Å; E811-I814 PolarHBondContact O-N 3.25Å; E811-A815 PolarHBondContact O-N 2.95Å
812	G	92	Very high	95.1	Very high	47 Å²	47	71.2 Å²	71.2	49%	0.485	35%	0.351	S	S	.	.	H	α-helix	trans	-59.2	-24.5	-171.2	0	0	0	0	0	115.5	H810 M816	H810-G812 PolarHBondContact O-N 3.48Å; G812-M816 PolarHBondContact O-N 3.26Å; G812-M816 VanDerWaalsContact O-N 3.14Å
813	R	95.3	Very high	95	Very high	192 Å²	192	72.9 Å²	72.9	73%	0.725	37%	0.368	S	S	*	.	H	α-helix	trans	-68.5	-45.6	174.1	-173.2	-175.5	-59.7	171.4	4.1	111.4	E811 A815 M816 E817	E811-R813 PolarHBondContact O-N 3.16Å; R813-A815 VanDerWaalsContact C-N 3.33Å; R813-M816 PolarHBondContact O-N 3.21Å; R813-E817 PolarHBondContact O-N 2.92Å
814	I	93.2	Very high	94.8	Very high	30 Å²	30	76 Å²	76	15%	0.154	38%	0.384	C	S	.	.	H	α-helix	trans	-67.8	-39.4	179.3	-61.4	177.6	0	0	0	109.6	Y771 A806 E811 M816 E817 Y818	Y771-I814 HydrophobicContact CE2-CG2 4.32Å; A806-I814 HydrophobicContact CB-CG2 4.4Å; E811-I814 HydrophobicContact CB-CB 4.38Å; E811-I814 HydrophobicContact CB-CD1 4.25Å; E811-I814 HydrophobicContact CG-CD1 4.49Å; E811-I814 PolarHBondContact O-N 3.25Å; I814-M816 VanDerWaalsContact C-N 3.32Å; I814-M816 PolarHBondContact O-N 3.42Å; I814-E817 WeakPolarHBondContact O-CB 3.46Å; I814-E817 PolarHBondContact O-N 2.94Å; I814-Y818 HydrophobicContact CG2-CD2 3.94Å; I814-Y818 HydrophobicContact CG2-CE2 3.36Å; I814-Y818 PolarHBondContact O-N 2.91Å; I814-Y818 VanDerWaalsContact O-N 3.09Å
815	A	96.4	Very high	94.6	Very high	3 Å²	3	71.8 Å²	71.8	3%	0.025	37%	0.365	C	S	.	.	H	α-helix	trans	-57.7	-44.3	174.8	0	0	0	0	0	112.5	A803 A806 I807 E811 R813 E817 Y818 Y819	A803-A815 WeakPolarHBondContact O-CB 3.44Å; A806-A815 HydrophobicContact CB-CB 3.87Å; I807-A815 HydrophobicContact CD1-CB 4.31Å; I807-A815 HydrophobicContact CG1-CB 3.6Å; E811-A815 PolarHBondContact O-N 2.95Å; R813-A815 VanDerWaalsContact C-N 3.33Å; A815-E817 VanDerWaalsContact C-N 3.33Å; A815-E817 PolarHBondContact O-N 2.77Å; A815-Y818 PolarHBondContact O-N 3.28Å; A815-Y819 VanDerWaalsContact O-CD2 3.32Å; A815-Y819 WeakPolarHBondContact O-CD2 3.32Å; A815-Y819 PolarHBondContact O-N 3.28Å
816	M	97.3	Very high	94.3	Very high	123 Å²	123	75.8 Å²	75.8	61%	0.606	38%	0.379	S	S	*	.	H	α-helix	trans	-62.3	-39.5	177	-172.9	177.5	68.1	0	0	112.2	G812 R813 I814 Y818 Y819 E820	G812-M816 PolarHBondContact O-N 3.26Å; G812-M816 VanDerWaalsContact O-N 3.14Å; R813-M816 PolarHBondContact O-N 3.21Å; I814-M816 VanDerWaalsContact C-N 3.32Å; I814-M816 PolarHBondContact O-N 3.42Å; M816-Y818 VanDerWaalsContact C-N 3.34Å; M816-Y818 PolarHBondContact O-N 3.1Å; M816-Y819 PolarHBondContact O-N 3.26Å; M816-E820 WeakPolarHBondContact O-CB 3.32Å; M816-E820 PolarHBondContact O-N 3.12Å
817	E	97.3	Very high	93.9	Very high	98 Å²	98	81.7 Å²	81.7	46%	0.458	41%	0.407	S	S	.	.	H	α-helix	trans	-61.6	-40.7	175.2	-69.5	172.3	-172.3	0	0	111.6	R813 I814 A815 E820 Q821	R813-E817 PolarHBondContact O-N 2.92Å; I814-E817 WeakPolarHBondContact O-CB 3.46Å; I814-E817 PolarHBondContact O-N 2.94Å; A815-E817 VanDerWaalsContact C-N 3.33Å; A815-E817 PolarHBondContact O-N 2.77Å; E817-E820 PolarHBondContact O-N 3.15Å; E817-Q821 WeakPolarHBondContact O-CG 3.01Å; E817-Q821 PolarHBondContact O-N 3.36Å; E817-Q821 VanDerWaalsContact O-N 3.11Å
818	Y	98.1	Very high	93.2	Very high	29 Å²	29	84 Å²	84	11%	0.114	41%	0.411	C	S	.	.	H	α-helix	trans	-70.5	-41.2	177.2	-65.8	-36.5	0	0	0	113.2	Y771 F799 A802 I814 A815 M816 E820 Q821 A822	Y771-Y818 HydrophobicContact CD2-CE2 4.2Å; F799-Y818 AromaticContact CD1-CD1 3.7Å; F799-Y818 HydrophobicContact CD1-CD1 3.7Å; F799-Y818 HydrophobicContact CD1-CE1 4.47Å; F799-Y818 HydrophobicContact CD1-CG 4.27Å; F799-Y818 AromaticContact CE1-CD1 3.95Å; F799-Y818 HydrophobicContact CE1-CD1 3.95Å; F799-Y818 HydrophobicContact CE1-CE1 4.41Å; A802-Y818 HydrophobicContact CB-CD2 3.55Å; A802-Y818 HydrophobicContact CB-CE2 3.76Å; A802-Y818 HydrophobicContact CB-CG 4.02Å; I814-Y818 HydrophobicContact CG2-CD2 3.94Å; I814-Y818 HydrophobicContact CG2-CE2 3.36Å; I814-Y818 PolarHBondContact O-N 2.91Å; I814-Y818 VanDerWaalsContact O-N 3.09Å; A815-Y818 PolarHBondContact O-N 3.28Å; M816-Y818 VanDerWaalsContact C-N 3.34Å; M816-Y818 PolarHBondContact O-N 3.1Å; Y818-E820 VanDerWaalsContact C-N 3.29Å; Y818-E820 PolarHBondContact O-N 3.01Å; Y818-Q821 PolarHBondContact O-N 3.4Å; Y818-A822 PolarHBondContact O-N 3.37Å
819	Y	98	Very high	92.4	Very high	83 Å²	83	78.9 Å²	78.9	33%	0.325	40%	0.395	S	S	.	.	H	α-helix	trans	-62	-36.4	172.8	-77	-53.1	0	0	0	112.5	E800 A803 I807 A815 M816 A822 G823	E800-Y819 WeakPolarHBondContact OE1-CD1 3.44Å; E800-Y819 WeakPolarHBondContact OE2-CE1 3.33Å; A803-Y819 HydrophobicContact CB-CD1 3.76Å; A803-Y819 HydrophobicContact CB-CD2 3.7Å; A803-Y819 HydrophobicContact CB-CE1 3.59Å; A803-Y819 HydrophobicContact CB-CE2 3.54Å; A803-Y819 HydrophobicContact CB-CG 3.8Å; A803-Y819 VanDerWaalsContact CB-CZ 3.47Å; I807-Y819 HydrophobicContact CD1-CE2 3.72Å; A815-Y819 VanDerWaalsContact O-CD2 3.32Å; A815-Y819 WeakPolarHBondContact O-CD2 3.32Å; A815-Y819 PolarHBondContact O-N 3.28Å; M816-Y819 PolarHBondContact O-N 3.26Å; Y819-A822 PolarHBondContact O-N 2.87Å; Y819-G823 PolarHBondContact O-N 3.15Å
820	E	97.5	Very high	91.5	Very high	122 Å²	122	79.2 Å²	79.2	57%	0.57	40%	0.397	S	S	*	.	H	α-helix	trans	-63.3	-43.1	174.1	-173.4	177.8	-174.1	0	0	111.1	M816 E817 Y818 A822 G823 L824	M816-E820 WeakPolarHBondContact O-CB 3.32Å; M816-E820 PolarHBondContact O-N 3.12Å; E817-E820 PolarHBondContact O-N 3.15Å; Y818-E820 VanDerWaalsContact C-N 3.29Å; Y818-E820 PolarHBondContact O-N 3.01Å; E820-A822 PolarHBondContact O-N 3.25Å; E820-G823 PolarHBondContact O-N 3.44Å; E820-L824 WeakPolarHBondContact O-CG 3.49Å; E820-L824 PolarHBondContact O-N 2.95Å
821	Q	96.1	Very high	90.3	Very high	86 Å²	86	75.5 Å²	75.5	40%	0.402	38%	0.382	S	S	.	.	H	α-helix	trans	-64	-38.6	174.5	-65.7	-55.3	-58.9	0	0	112.7	F799 E817 Y818 L825	F799-Q821 HydrophobicContact CD1-CB 4.02Å; F799-Q821 HydrophobicContact CD2-CB 3.86Å; F799-Q821 HydrophobicContact CE1-CB 3.92Å; F799-Q821 HydrophobicContact CE1-CG 4.17Å; F799-Q821 HydrophobicContact CE2-CB 3.75Å; F799-Q821 HydrophobicContact CG-CB 3.99Å; F799-Q821 HydrophobicContact CZ-CB 3.76Å; F799-Q821 HydrophobicContact CZ-CG 4.09Å; E817-Q821 WeakPolarHBondContact O-CG 3.01Å; E817-Q821 PolarHBondContact O-N 3.36Å; E817-Q821 VanDerWaalsContact O-N 3.11Å; Y818-Q821 PolarHBondContact O-N 3.4Å; Q821-L825 WeakPolarHBondContact O-CG 3.47Å; Q821-L825 PolarHBondContact O-N 3.43Å
822	A	95	Very high	88.7	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-62.7	-47	174.7	0	0	0	0	0	111.5	Y796 F799 E800 Y818 Y819 E820 L824 L825 E826	Y796-A822 HydrophobicContact CD2-CB 3.89Å; Y796-A822 WeakPolarHBondContact CD2-O 3.29Å; Y796-A822 HydrophobicContact CE2-CB 3.97Å; F799-A822 HydrophobicContact CB-CB 4Å; E800-A822 HydrophobicContact CG-CB 4.33Å; E800-A822 WeakPolarHBondContact OE1-CB 3.44Å; Y818-A822 PolarHBondContact O-N 3.37Å; Y819-A822 PolarHBondContact O-N 2.87Å; E820-A822 PolarHBondContact O-N 3.25Å; A822-L824 VanDerWaalsContact C-N 3.35Å; A822-L824 PolarHBondContact O-N 2.9Å; A822-L825 WeakPolarHBondContact O-CB 3.18Å; A822-L825 PolarHBondContact O-N 3.43Å; A822-L825 VanDerWaalsContact O-N 3.1Å; A822-E826 PolarHBondContact O-N 3.28Å
823	G	94.6	Very high	87	Confident	35 Å²	35	80.1 Å²	80.1	36%	0.361	39%	0.389	S	S	.	.	H	α-helix	trans	-61.6	-38.3	177.8	0	0	0	0	0	113.6	Y819 E820 L825 E826 E827	Y819-G823 PolarHBondContact O-N 3.15Å; E820-G823 PolarHBondContact O-N 3.44Å; G823-L825 VanDerWaalsContact C-N 3.31Å; G823-L825 PolarHBondContact O-N 3.16Å; G823-E826 PolarHBondContact O-N 3.45Å; G823-E827 PolarHBondContact O-N 2.85Å; G823-E827 VanDerWaalsContact O-N 3.15Å
824	L	93.9	Very high	85.1	Confident	64 Å²	64	76.8 Å²	76.8	34%	0.335	39%	0.386	S	S	.	.	H	α-helix	trans	-61.8	-38.7	174	-71.2	173.6	0	0	0	111.9	E820 A822 E826 E827 Y828	E820-L824 WeakPolarHBondContact O-CG 3.49Å; E820-L824 PolarHBondContact O-N 2.95Å; A822-L824 VanDerWaalsContact C-N 3.35Å; A822-L824 PolarHBondContact O-N 2.9Å; L824-E826 VanDerWaalsContact C-N 3.34Å; L824-E827 PolarHBondContact O-N 3.35Å; L824-Y828 WeakPolarHBondContact O-CD2 3.4Å; L824-Y828 PolarHBondContact O-N 3.37Å; L824-Y828 VanDerWaalsContact O-N 3.12Å
825	L	91.8	Very high	83.3	Confident	16 Å²	16	77.4 Å²	77.4	8%	0.084	40%	0.4	C	S	.	.	H	α-helix	trans	-66.5	-34.6	178	-70.4	170.5	0	0	0	112.6	A782 R792 A795 F799 Q821 A822 G823 A829	A782-L825 HydrophobicContact CB-CD1 4.35Å; A782-L825 HydrophobicContact CB-CD2 3.98Å; R792-L825 HydrophobicContact CB-CD2 4.27Å; R792-L825 HydrophobicContact CG-CD2 4.2Å; A795-L825 HydrophobicContact CB-CD1 3.67Å; F799-L825 HydrophobicContact CD2-CD1 3.76Å; F799-L825 HydrophobicContact CE2-CD1 3.99Å; Q821-L825 WeakPolarHBondContact O-CG 3.47Å; Q821-L825 PolarHBondContact O-N 3.43Å; A822-L825 WeakPolarHBondContact O-CB 3.18Å; A822-L825 PolarHBondContact O-N 3.43Å; A822-L825 VanDerWaalsContact O-N 3.1Å; G823-L825 VanDerWaalsContact C-N 3.31Å; G823-L825 PolarHBondContact O-N 3.16Å; L825-A829 PolarHBondContact O-N 3.39Å; L825-A829 VanDerWaalsContact O-N 3.12Å
826	E	87.2	Confident	81	Confident	103 Å²	103	83.7 Å²	83.7	48%	0.481	43%	0.429	S	S	.	.	H	α-helix	trans	-65.1	-44.5	172.9	-68.9	-174.8	166.5	0	0	112	Y796 A822 G823 L824 Y828 A829 A830	Y796-E826 HydrophobicContact CD2-CG 3.89Å; Y796-E826 HydrophobicContact CE2-CG 3.44Å; Y796-E826 VanDerWaalsContact CE2-CG 3.44Å; Y796-E826 WeakPolarHBondContact CE2-OE1 3.44Å; Y796-E826 PolarHBondContact OH-OE1 3.45Å; A822-E826 PolarHBondContact O-N 3.28Å; G823-E826 PolarHBondContact O-N 3.45Å; L824-E826 VanDerWaalsContact C-N 3.34Å; E826-Y828 VanDerWaalsContact C-N 3.33Å; E826-Y828 PolarHBondContact O-N 2.85Å; E826-A829 WeakPolarHBondContact O-CB 3.38Å; E826-A829 PolarHBondContact O-N 3.04Å; E826-A829 VanDerWaalsContact O-N 3.15Å; E826-A830 PolarHBondContact O-N 3.15Å
827	E	85.7	Confident	78.7	Confident	125 Å²	125	82.3 Å²	82.3	58%	0.584	42%	0.423	S	S	*	.	H	α-helix	trans	-61.8	-42.1	179.1	-170.5	178	-175.5	0	0	111.3	G823 L824 A829 A830 I831	G823-E827 PolarHBondContact O-N 2.85Å; G823-E827 VanDerWaalsContact O-N 3.15Å; L824-E827 PolarHBondContact O-N 3.35Å; E827-A829 VanDerWaalsContact C-N 3.33Å; E827-A829 PolarHBondContact O-N 3.12Å; E827-A830 PolarHBondContact O-N 2.7Å; E827-I831 HydrophobicContact CG-CD1 4.33Å; E827-I831 WeakPolarHBondContact O-CG1 3.49Å; E827-I831 PolarHBondContact O-N 2.79Å; E827-I831 VanDerWaalsContact O-N 3.16Å
828	Y	79.8	Confident	76.3	Confident	137 Å²	137	79.4 Å²	79.4	54%	0.537	42%	0.419	S	S	.	.	H	α-helix	trans	-64.6	-35.6	174.8	-76.2	-61.4	0	0	0	113.2	L824 E826 A830 I831 E832	L824-Y828 WeakPolarHBondContact O-CD2 3.4Å; L824-Y828 PolarHBondContact O-N 3.37Å; L824-Y828 VanDerWaalsContact O-N 3.12Å; E826-Y828 VanDerWaalsContact C-N 3.33Å; E826-Y828 PolarHBondContact O-N 2.85Å; Y828-A830 VanDerWaalsContact C-N 3.33Å; Y828-I831 PolarHBondContact O-N 3.46Å; Y828-E832 PolarHBondContact O-N 3.48Å
829	A	76	Confident	73.7	Confident	48 Å²	48	85.2 Å²	85.2	40%	0.397	45%	0.447	S	S	.	.	H	α-helix	trans	-67.2	-35.6	176.4	0	0	0	0	0	111.9	L825 E826 E827 F833	L825-A829 PolarHBondContact O-N 3.39Å; L825-A829 VanDerWaalsContact O-N 3.12Å; E826-A829 WeakPolarHBondContact O-CB 3.38Å; E826-A829 PolarHBondContact O-N 3.04Å; E826-A829 VanDerWaalsContact O-N 3.15Å; E827-A829 VanDerWaalsContact C-N 3.33Å; E827-A829 PolarHBondContact O-N 3.12Å; A829-F833 PolarHBondContact O-N 3.18Å
830	A	70.2	Confident	71.1	Confident	56 Å²	56	88.9 Å²	88.9	46%	0.463	47%	0.465	S	S	.	.	H	α-helix	trans	-66.2	-41.9	175.2	0	0	0	0	0	112.3	E826 E827 Y828 F833 D834	E826-A830 PolarHBondContact O-N 3.15Å; E827-A830 PolarHBondContact O-N 2.7Å; Y828-A830 VanDerWaalsContact C-N 3.33Å; A830-F833 PolarHBondContact O-N 3.17Å; A830-D834 PolarHBondContact O-N 3.3Å
831	I	68	Low	68.6	Low	99 Å²	99	86.6 Å²	86.6	51%	0.508	46%	0.459	S	S	.	.	H	α-helix	trans	-66.6	-39.6	179.7	-63.5	164.7	0	0	0	111.7	E827 Y828 F833 D834 G835	E827-I831 HydrophobicContact CG-CD1 4.33Å; E827-I831 WeakPolarHBondContact O-CG1 3.49Å; E827-I831 PolarHBondContact O-N 2.79Å; E827-I831 VanDerWaalsContact O-N 3.16Å; Y828-I831 PolarHBondContact O-N 3.46Å; I831-F833 VanDerWaalsContact C-N 3.31Å; I831-F833 PolarHBondContact O-N 3.16Å; I831-D834 PolarHBondContact O-N 3.47Å; I831-G835 PolarHBondContact O-N 3.28Å; I831-G835 VanDerWaalsContact O-N 3.11Å
832	E	60.3	Low	66.2	Low	94 Å²	94	89.8 Å²	89.8	44%	0.439	47%	0.474	S	S	.	.	H	α-helix	trans	-65.5	-35.1	176.3	-80.6	-178.6	175.2	0	0	111.8	R792 Y828 G835 E836	R792-E832 IonicContact CZ-OE1 3.34Å; R792-E832 IonicContact CZ-OE2 2.76Å; R792-E832 IonicContact NH1-OE1 2.83Å; R792-E832 PolarHBondContact NH1-OE1 2.92Å; R792-E832 IonicContact NH1-OE2 3.65Å; R792-E832 PolarHBondContact NH1-OE2 3.47Å; R792-E832 IonicContact NH2-OE1 3.92Å; R792-E832 PolarHBondContact NH2-OE1 3.42Å; R792-E832 IonicContact NH2-OE2 3.24Å; Y828-E832 PolarHBondContact O-N 3.48Å; E832-G835 PolarHBondContact O-N 3.11Å; E832-E836 PolarHBondContact O-N 3.08Å; E832-E836 VanDerWaalsContact O-N 3.08Å
833	F	56.2	Low	63.9	Low	139 Å²	139	98.2 Å²	98.2	61%	0.61	51%	0.514	S	S	*	.	H	α-helix	trans	-66.6	-41	176.7	-127.7	-87.3	0	0	0	112.6	A829 A830 I831 G835 E836 I837	A829-F833 PolarHBondContact O-N 3.18Å; A830-F833 PolarHBondContact O-N 3.17Å; I831-F833 VanDerWaalsContact C-N 3.31Å; I831-F833 PolarHBondContact O-N 3.16Å; F833-G835 VanDerWaalsContact C-N 3.29Å; F833-G835 PolarHBondContact O-N 2.99Å; F833-E836 PolarHBondContact O-N 3.44Å; F833-I837 HydrophobicContact CD1-CD1 4.14Å; F833-I837 WeakPolarHBondContact O-CG1 3.44Å; F833-I837 PolarHBondContact O-N 3.16Å; F833-I837 VanDerWaalsContact O-N 3.16Å
834	D	54.9	Low	61.4	Low	122 Å²	122	104 Å²	104	65%	0.652	54%	0.536	S	S	*	.	H	α-helix	trans	-66.8	-32.1	174.8	-78.8	-17.5	0	0	0	111.9	A830 I831 G838	A830-D834 PolarHBondContact O-N 3.3Å; I831-D834 PolarHBondContact O-N 3.47Å; D834-G838 PolarHBondContact O-N 3.47Å
835	G	54.5	Low	58.8	Low	43 Å²	43	111.8 Å²	111.8	44%	0.443	57%	0.567	S	S	.	*	H	α-helix	trans	-65.8	-45.3	174.3	0	0	0	0	0	113.7	I831 E832 F833 G838 E839	I831-G835 PolarHBondContact O-N 3.28Å; I831-G835 VanDerWaalsContact O-N 3.11Å; E832-G835 PolarHBondContact O-N 3.11Å; F833-G835 VanDerWaalsContact C-N 3.29Å; F833-G835 PolarHBondContact O-N 2.99Å; G835-G838 WeakPolarHBondContact O-CA 3.43Å; G835-G838 PolarHBondContact O-N 3.18Å; G835-G838 VanDerWaalsContact O-N 3.16Å; G835-E839 PolarHBondContact O-N 3.04Å
836	E	49.7	Very low	57.1	Low	135 Å²	135	116.6 Å²	116.6	63%	0.631	59%	0.592	S	S	*	*	H	α-helix	trans	-69.6	-33.4	177.6	-84.9	-166.3	164.9	0	0	112.9	E832 F833 G838 K840	E832-E836 PolarHBondContact O-N 3.08Å; E832-E836 VanDerWaalsContact O-N 3.08Å; F833-E836 PolarHBondContact O-N 3.44Å; E836-G838 VanDerWaalsContact C-N 3.28Å; E836-K840 PolarHBondContact O-N 3.29Å
837	I	48.1	Very low	55.5	Low	95 Å²	95	117.3 Å²	117.3	49%	0.487	60%	0.597	S	S	.	*	H	α-helix	trans	-67.4	-35.4	171.3	-63.8	168.4	0	0	0	109.9	F833 T841	F833-I837 HydrophobicContact CD1-CD1 4.14Å; F833-I837 WeakPolarHBondContact O-CG1 3.44Å; F833-I837 PolarHBondContact O-N 3.16Å; F833-I837 VanDerWaalsContact O-N 3.16Å; I837-T841 WeakPolarHBondContact O-CG2 3.34Å; I837-T841 PolarHBondContact O-N 3.29Å; I837-T841 PolarHBondContact O-OG1 3.3Å
838	G	46.8	Very low	53.8	Low	37 Å²	37	116.8 Å²	116.8	38%	0.381	60%	0.598	S	S	.	*	H	α-helix	trans	-56.7	-53	172.1	0	0	0	0	0	112.7	D834 G835 E836 T841 E842	D834-G838 PolarHBondContact O-N 3.47Å; G835-G838 WeakPolarHBondContact O-CA 3.43Å; G835-G838 PolarHBondContact O-N 3.18Å; G835-G838 VanDerWaalsContact O-N 3.16Å; E836-G838 VanDerWaalsContact C-N 3.28Å; G838-T841 PolarHBondContact O-N 3.47Å; G838-T841 PolarHBondContact O-OG1 2.93Å; G838-E842 PolarHBondContact O-N 3.27Å
839	E	44.3	Very low	52.3	Low	150 Å²	150	115.6 Å²	115.6	70%	0.701	60%	0.602	S	S	*	*	H	α-helix	trans	-68.3	-37.8	-177.2	-87.2	-172.3	161.2	0	0	113.4	G835 T841 E842 E843	G835-E839 PolarHBondContact O-N 3.04Å; E839-T841 PolarHBondContact O-N 3.14Å; E839-E842 PolarHBondContact O-N 3.27Å; E839-E842 VanDerWaalsContact O-N 3.14Å; E839-E843 PolarHBondContact O-N 3.47Å
840	K	43.3	Very low	50.8	Low	160 Å²	160	119.9 Å²	119.9	70%	0.696	62%	0.615	S	S	*	*	H	α-helix	trans	-66.4	-24.9	175.9	-88.8	179.8	179.4	162.8	0	113.7	E836 E842	E836-K840 PolarHBondContact O-N 3.29Å; K840-E842 VanDerWaalsContact C-N 3.35Å
841	T	44.6	Very low	49.6	Very low	74 Å²	74	124.1 Å²	124.1	45%	0.454	63%	0.625	S	S	.	*	H	α-helix	trans	-82.8	-10.3	175.7	59.7	0	0	0	0	114.2	I837 G838 E839	I837-T841 WeakPolarHBondContact O-CG2 3.34Å; I837-T841 PolarHBondContact O-N 3.29Å; I837-T841 PolarHBondContact O-OG1 3.3Å; G838-T841 PolarHBondContact O-N 3.47Å; G838-T841 PolarHBondContact O-OG1 2.93Å; E839-T841 PolarHBondContact O-N 3.14Å
842	E	44.6	Very low	48.2	Very low	154 Å²	154	125.9 Å²	125.9	72%	0.72	63%	0.633	S	S	*	*	H	α-helix	trans	-88.9	-27.7	172.4	-108.3	-169.4	176.2	0	0	113.4	G838 E839 K840	G838-E842 PolarHBondContact O-N 3.27Å; E839-E842 PolarHBondContact O-N 3.27Å; E839-E842 VanDerWaalsContact O-N 3.14Å; K840-E842 VanDerWaalsContact C-N 3.35Å
843	E	46.5	Very low	47.3	Very low	177 Å²	177	128.4 Å²	128.4	83%	0.827	65%	0.648	S	S	*	*	H	α-helix	trans	-75.4	-21.9	172.9	-83	-169.2	152.8	0	0	113.8	E839	E839-E843 PolarHBondContact O-N 3.47Å
844	D	43.3	Very low	46.6	Very low	156 Å²	156	127.5 Å²	127.5	83%	0.834	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	6.3	175.8	-89.2	-18	0	0	0	113.9
845	K	38.2	Very low	45.8	Very low	227 Å²	227	128 Å²	128	99%	0.987	65%	0.651	S	S	*	*			trans	-108.7	0	173.1	-81.9	179.7	-178.7	165.5	0	111.8

Retrieved 845 of 845 residues in 144.4 ms (Link to these results)

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