A0A093HGB8_STRCA Loading...

NAD(P) transhydrogenase, mitochondrial

The transhydrogenation between NADH and NADP is coupled to respiration and ATP hydrolysis and functions as a proton pump across the membrane. May play a role in reactive oxygen species (ROS) detoxification in the adrenal gland.

AlphaFold DB , UniProt , Accession A0A093HGB8, Species STRCA (Struthio camelus australis), Gene n/a, Length 1,086 aa.

						>A0A093HGB8_STRCA|A0A093HGB8
MASLLRIAVSGCSTPIFGNVLPPKVCSAKMPRFRMFRTHQILWSQAPLKPGIPYKQLTVGVPKEIFQNEKRVALSPAGVQALVKQGFNVIVESGAGEASKFSDDHYREVGAKIQGTKEVLASDLVVKVRAPIYNPALGVHEADLFKTAATLISFIYPAQNPDLLNKLAEKKTTVLAMDQVPRVTIAQGYDALSSMANIAGYKAVVLAANHFGRFFTGQITAAGKVPPAKVLIIGGGVAGLASAGAAKSMGAVVRGFDTRAAALEQFKSLGAEPLEVDLKESGEGQGGYAKEMSKEFIEAEMKLFAKQCQDVDIIITTALIPGKKAPVLFRKDMIELMKEGSVVVDLAAEAGGNIETTKPGELYVHKGVTHIGYTDLPSRMATQASTLYSNNIIKLLKAISPDKENFYFEPKDEFDYGTLDHVIRGTVVMKDGKVIFPAPPPNNIPQGAPVKQKTVAELEAEKAATITPFRKTMTSASVYTTGLATMLGLGIAAPNAAFTQMVTTFGLAGIVGYHTVWGVTPALHSPLMSVTNAISGLTAVGGLVLMGGHYIPENAPQSLAVLSAFISSVNIAGGFLVTQRMLDMFKRPTDPPEYNYLYLLPGGVFVGGYAAALSGGYNIEQMMYLASGLCCVGALAGLSTQGTARLGNALGMIGVAGGLAATLGGLKPSPELLAQMSGAMALGGTIGLTIAKRIQISDLPQLVAAFHSLVGLAAVLTCVAEYMIEYPHFATDPAANLTKIVAYLGTYIGGVTFSGSLVAYGKLQGILNSAPLLLPGRHALNAGLLAASVGGMVPYMIDPSYTTGITCLGSVSALSAIMGVTLTAAIGGADMPVVITVLNSYSGWALCAEGFLLNNNLLTVVGALIGSSGAILSYIMCVAMNRSLANVILGGYGTTSTAGGKPMEITGTHTEINLDNAVEMIKEASNIIITPGYGLCAAKAQYPIADLVKMLREQGKNVRFGIHPVAGRMPGQLNVLLAEAGVPYDIVLEMDEINEDFPETDLVLVIGANDTVNSAAQEDPNSIIAGMPVLEVWKSKQVIVMKRSLGVGYAAVDNPIFYKPNTAMLLGDAKKTCDALQAKVRESYQS
					

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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	33.5	Very low	26.4	Very low	250 Å²	250	146.5 Å²	146.5	100%	1.232	86%	0.857	S	S	*	*				0	95.2	0	-84.5	178.3	-179	0	0	108.9
2	A	30.5	Very low	26.2	Very low	101 Å²	101	145.2 Å²	145.2	84%	0.835	86%	0.859	S	S	*	*			trans	-92.5	142	161.5	0	0	0	0	0	107.1
3	S	27.8	Very low	26.2	Very low	116 Å²	116	143.2 Å²	143.2	81%	0.811	86%	0.857	S	S	*	*			trans	84.7	96.2	-179.2	-149.9	0	0	0	0	115.4
4	L	26.4	Very low	26.2	Very low	167 Å²	167	142.5 Å²	142.5	87%	0.874	86%	0.855	S	S	*	*			trans	177.8	95.5	143.1	-98.6	155.7	0	0	0	108.4
5	L	27.1	Very low	27.4	Very low	180 Å²	180	140.2 Å²	140.2	94%	0.942	85%	0.845	S	S	*	*			trans	168	85.3	145.3	-91.7	153	0	0	0	109.8
6	R	26.3	Very low	27.5	Very low	235 Å²	235	139.8 Å²	139.8	89%	0.887	84%	0.835	S	S	*	*			trans	-139.9	132.5	156.7	-104.9	-170.5	-170.9	-161.1	3.4	108
7	I	25.8	Very low	27.5	Very low	164 Å²	164	143.5 Å²	143.5	84%	0.841	84%	0.838	S	S	*	*			trans	92.7	110	160	-54	154.7	0	0	0	115.9
8	A	22.7	Very low	27.4	Very low	83 Å²	83	139.2 Å²	139.2	69%	0.686	83%	0.83	S	S	*	*				165.8	154	95.8	0	0	0	0	0	114.5
9	V	23.9	Very low	27.4	Very low	130 Å²	130	140.5 Å²	140.5	79%	0.788	83%	0.832	S	S	*	*			trans	82.9	99.9	156.6	-164.1	0	0	0	0	116.1
10	S	23.8	Very low	27.5	Very low	113 Å²	113	140.2 Å²	140.2	79%	0.79	83%	0.831	S	S	*	*				86.5	128.3	55.5	78.9	0	0	0	0	115.4
11	G	22.6	Very low	27.4	Very low	72 Å²	72	140.7 Å²	140.7	74%	0.742	83%	0.829	S	S	*	*			trans	153.7	102.6	153.3	0	0	0	0	0	117.9
12	C	23.7	Very low	28.2	Very low	131 Å²	131	133.9 Å²	133.9	89%	0.885	80%	0.803	S	S	*	*			trans	67.5	133.5	153.1	-61.2	0	0	0	0	118.8
13	S	26.5	Very low	28.7	Very low	119 Å²	119	134.6 Å²	134.6	83%	0.832	80%	0.799	S	S	*	*			cis	-162.3	151.2	31.5	-35.4	0	0	0	0	111.7
14	T	26	Very low	28.9	Very low	134 Å²	134	138.5 Å²	138.5	82%	0.822	80%	0.802	S	S	*	*			trans	-85.7	-169.8	174.3	46.1	0	0	0	0	112.4
15	P	45	Very low	29	Very low	108 Å²	108	137.6 Å²	137.6	70%	0.701	80%	0.803	S	S	*	*			cis	-130.8	179.1	-8	22.8	4.7	0	0	0	113
16	I	28	Very low	29.1	Very low	134 Å²	134	134.6 Å²	134.6	69%	0.687	80%	0.796	S	S	*	*				173.7	122.8	84.7	-87.2	-177.7	0	0	0	109.5
17	F	28.5	Very low	29.2	Very low	202 Å²	202	129 Å²	129	89%	0.886	79%	0.793	S	S	*	*			trans	57.8	132.6	153.5	-64.7	-108.7	0	0	0	120.2
18	G	25.5	Very low	29.4	Very low	67 Å²	67	126 Å²	126	69%	0.691	79%	0.792	S	S	*	*			cis	172.9	134.3	-0.5	0	0	0	0	0	109.9
19	N	27	Very low	29.6	Very low	163 Å²	163	131.4 Å²	131.4	87%	0.872	80%	0.8	S	S	*	*				38.3	125.4	129.4	-85.3	7.1	0	0	0	118.1
20	V	28.6	Very low	29.7	Very low	134 Å²	134	133.6 Å²	133.6	81%	0.812	80%	0.804	S	S	*	*			cis	-172.1	141.8	44.6	168.1	0	0	0	0	110.2
21	L	27	Very low	30.5	Very low	152 Å²	152	133.3 Å²	133.3	80%	0.796	80%	0.799	S	S	*	*			trans	-88.4	-175.7	164.1	-89.4	151	0	0	0	110.4
22	P	50	Low	30.8	Very low	106 Å²	106	142 Å²	142	69%	0.688	81%	0.81	S	S	*	*			cis	-130.2	-145.6	-45.9	38	-16	0	0	0	108.2
23	P	40.6	Very low	31	Very low	116 Å²	116	144.3 Å²	144.3	75%	0.753	81%	0.805	S	S	*	*			cis	-141	175.8	0.7	32.7	-6.6	0	0	0	119.7
24	K	32.1	Very low	31.2	Very low	198 Å²	198	147.6 Å²	147.6	86%	0.861	80%	0.8	S	S	*	*			trans	-28.7	146.6	165.8	-64.9	169.6	170.9	176.8	0	118.1
25	V	29.4	Very low	31.2	Very low	148 Å²	148	150.4 Å²	150.4	90%	0.897	81%	0.806	S	S	*	*			trans	-156.4	143.4	132.1	178.5	0	0	0	0	111.4
26	C	27.2	Very low	30.5	Very low	118 Å²	118	153 Å²	153	80%	0.797	81%	0.806	S	S	*	*			trans	-77.6	158	175.6	-75.9	0	0	0	0	115.8
27	S	29.9	Very low	30.7	Very low	118 Å²	118	157.9 Å²	157.9	83%	0.825	82%	0.816	S	S	*	*			trans	63.5	118.3	142	168.9	0	0	0	0	121
28	A	28.6	Very low	30.8	Very low	100 Å²	100	154.2 Å²	154.2	83%	0.826	81%	0.81	S	S	*	*				177.9	150.4	119.1	0	0	0	0	0	113.1
29	K	27.9	Very low	31.3	Very low	197 Å²	197	159.2 Å²	159.2	86%	0.857	82%	0.815	S	S	*	*			trans	-81.5	139.1	-176.6	-76.9	174.1	171.3	175.6	0	114
30	M	25.6	Very low	31.6	Very low	175 Å²	175	160.6 Å²	160.6	86%	0.862	82%	0.817	S	S	*	*			trans	57	166.8	140.2	-71.7	-163.2	-176.2	0	0	121.1
31	P	40.4	Very low	31.9	Very low	107 Å²	107	161.4 Å²	161.4	70%	0.695	82%	0.815	S	S	*	*			cis	-131.5	163.6	-48	36.6	-21.1	0	0	0	111.4
32	R	29.3	Very low	32.3	Very low	254 Å²	254	162.2 Å²	162.2	96%	0.958	82%	0.819	S	S	*	*			trans	-155.5	148.9	155.2	-114.2	174.4	-170.5	-168.9	2.4	113.2
33	F	28.4	Very low	31.7	Very low	181 Å²	181	167.3 Å²	167.3	79%	0.794	83%	0.825	S	S	*	*			trans	-78.8	146.3	-152.6	-100.7	-114.1	0	0	0	116.4
34	R	29.5	Very low	31.4	Very low	188 Å²	188	167.5 Å²	167.5	71%	0.709	83%	0.828	S	S	*	*			trans	22.9	123	139.2	-72.8	-179.5	172.7	-177	-4.2	119.3	F36	R34-F36 HydrophobicContact CG-CD2 4.35Å; R34-F36 HydrophobicContact CG-CE2 4.28Å
35	M	27.4	Very low	31.7	Very low	193 Å²	193	165.2 Å²	165.2	95%	0.951	82%	0.821	S	S	*	*				-133.2	122.3	123.4	-93.8	-162.7	-163.9	0	0	110.1
36	F	29.3	Very low	32.3	Very low	161 Å²	161	161.8 Å²	161.8	71%	0.706	81%	0.808	S	S	*	*			trans	-77.7	125.1	169.8	-90.6	-99.4	0	0	0	109.2	R34	R34-F36 HydrophobicContact CG-CD2 4.35Å; R34-F36 HydrophobicContact CG-CE2 4.28Å
37	R	31.9	Very low	33.1	Very low	238 Å²	238	162 Å²	162	90%	0.898	81%	0.808	S	S	*	*			trans	-123.8	107.5	148	-96.4	-172.7	176	-170.4	-0.3	107.6	H39	R37-H39 PolarHBondContact O-N 2.69Å
38	T	31.7	Very low	34.5	Very low	125 Å²	125	163.6 Å²	163.6	77%	0.767	81%	0.806	S	S	*	*			trans	-58.4	117.8	170	39.2	0	0	0	0	109.9
39	H	34.8	Very low	36.3	Very low	171 Å²	171	164.5 Å²	164.5	79%	0.792	79%	0.792	S	S	*	*			trans	-111.3	128	154.1	-86.8	34.8	0	0	0	107.3	R37 I41	R37-H39 PolarHBondContact O-N 2.69Å; H39-I41 PolarHBondContact O-N 3.08Å
40	Q	33.7	Very low	38.7	Very low	193 Å²	193	159 Å²	159	90%	0.902	78%	0.777	S	S	*	*			trans	-51.9	132.3	-178.5	-78.5	162.3	-49.5	0	0	110.8	L42	Q40-L42 PolarHBondContact O-N 2.86Å
41	I	34.6	Very low	41.3	Very low	151 Å²	151	152.3 Å²	152.3	77%	0.774	75%	0.752	S	S	*	*			trans	-63.9	97.1	168.9	-61.1	165.8	0	0	0	106.8	H39 W43	H39-I41 PolarHBondContact O-N 3.08Å; I41-W43 PolarHBondContact O-N 3.03Å
42	L	34.9	Very low	43.5	Very low	169 Å²	169	151.4 Å²	151.4	89%	0.885	74%	0.74	S	S	*	*			trans	-69.1	110.6	158.5	-88.7	157.5	0	0	0	106.4	Q40 S44	Q40-L42 PolarHBondContact O-N 2.86Å; L42-S44 PolarHBondContact O-N 3.38Å
43	W	38.2	Very low	46.4	Very low	213 Å²	213	141.5 Å²	141.5	81%	0.807	71%	0.709	S	S	*	*			trans	-48.9	120.2	172.6	-76.3	8.2	0	0	0	110	I41 Q45	I41-W43 PolarHBondContact O-N 3.03Å; W43-Q45 PolarHBondContact O-N 2.84Å
44	S	34.4	Very low	49.4	Very low	119 Å²	119	133.1 Å²	133.1	83%	0.832	67%	0.672	S	S	*	*			trans	-64.7	88.1	156.8	59.8	0	0	0	0	107.3	L42 A46	L42-S44 PolarHBondContact O-N 3.38Å; S44-A46 VanDerWaalsContact C-N 3.26Å; S44-A46 PolarHBondContact O-N 3.28Å
45	Q	39.2	Very low	52.2	Low	150 Å²	150	132.2 Å²	132.2	70%	0.701	67%	0.673	S	S	*	*			trans	-65.2	99.8	156.6	-74	-168.8	-6.4	0	0	105.8	W43	W43-Q45 PolarHBondContact O-N 2.84Å
46	A	40.3	Very low	55.3	Low	77 Å²	77	129.3 Å²	129.3	64%	0.636	66%	0.657	S	S	*	*			trans	-47.6	136.1	151.7	0	0	0	0	0	106.6	S44 L48	S44-A46 VanDerWaalsContact C-N 3.26Å; S44-A46 PolarHBondContact O-N 3.28Å; A46-L48 PolarHBondContact O-N 3.46Å
47	P	44.5	Very low	58.4	Low	122 Å²	122	122.2 Å²	122.2	79%	0.792	63%	0.626	S	S	*	*			trans	-52	119.1	180	20.2	-30.3	0	0	0	107.8	K49	P47-K49 PolarHBondContact O-N 2.83Å
48	L	59.6	Low	61.4	Low	151 Å²	151	112.5 Å²	112.5	79%	0.791	59%	0.594	S	S	*	*			trans	-51.9	114.3	174.4	-81.4	157.7	0	0	0	106.4	A46	A46-L48 PolarHBondContact O-N 3.46Å
49	K	66.3	Low	64.6	Low	120 Å²	120	106.6 Å²	106.6	52%	0.522	56%	0.557	S	S	.	*			trans	-56.6	129.5	175.1	-75.7	-175.9	171.7	-172.9	0	107.5	P47 G51 D402	P47-K49 PolarHBondContact O-N 2.83Å; K49-G51 PolarHBondContact O-N 3.01Å; K49-D402 IonicContact NZ-OD2 2.75Å; K49-D402 PolarHBondContact NZ-OD2 3.24Å
50	P	77.6	Confident	67.5	Low	82 Å²	82	98.4 Å²	98.4	53%	0.532	52%	0.52	S	S	.	.	S	Bend	trans	-62.8	132	177.1	26.5	-33	0	0	0	109.4	Y407	P50-Y407 HydrophobicContact CB-CD1 4.44Å; P50-Y407 HydrophobicContact CB-CD2 4.2Å; P50-Y407 HydrophobicContact CB-CE1 4.25Å; P50-Y407 HydrophobicContact CB-CE2 4.02Å; P50-Y407 HydrophobicContact CB-CG 4.4Å; P50-Y407 HydrophobicContact CG-CD1 4.31Å; P50-Y407 HydrophobicContact CG-CE1 4.14Å; P50-Y407 WeakPolarHBondContact O-CB 3.29Å
51	G	81.2	Confident	70.6	Confident	33 Å²	33	89.2 Å²	89.2	34%	0.34	48%	0.477	S	S	.	.	S	Bend	trans	136.6	163.6	178.6	0	0	0	0	0	114.3	K49 F406	K49-G51 PolarHBondContact O-N 3.01Å; G51-F406 WeakPolarHBondContact CA-O 3.37Å
52	I	87.5	Confident	73.5	Confident	89 Å²	89	82.1 Å²	82.1	46%	0.456	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	133.1	174.6	-60	171.8	0	0	0	107.8	Y54 Q56 L57 F406	I52-Y54 PolarHBondContact O-N 2.93Å; I52-Q56 HydrophobicContact CG2-CB 4.03Å; I52-L57 HydrophobicContact CB-CD1 4.31Å; I52-L57 HydrophobicContact CB-CD2 4.38Å; I52-L57 HydrophobicContact CB-CG 4.4Å; I52-L57 HydrophobicContact CD1-CD2 4.4Å; I52-L57 HydrophobicContact CG2-CD1 4.32Å; I52-L57 HydrophobicContact CG2-CD2 3.97Å; I52-L57 HydrophobicContact CG2-CG 3.91Å; I52-F406 PolarHBondContact N-O 3.17Å; I52-F406 PolarHBondContact O-N 3.44Å
53	P	90.3	Very high	76.4	Confident	46 Å²	46	78.2 Å²	78.2	30%	0.299	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	137.9	177.1	-26	34.4	0	0	0	112.4	K55 Q56 E404	P53-K55 PolarHBondContact O-N 3.43Å; P53-K55 VanDerWaalsContact O-N 3.09Å; P53-Q56 HydrophobicContact CB-CG 4.38Å; P53-Q56 WeakPolarHBondContact O-CB 3.46Å; P53-Q56 PolarHBondContact O-N 2.94Å; P53-E404 WeakPolarHBondContact CA-O 3.48Å
54	Y	89.9	Confident	79.1	Confident	4 Å²	4	69 Å²	69	2%	0.016	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-52.9	-38	-178.1	-71.2	-66.1	0	0	0	113.5	I52 Q56 L57 Q85 G86 F87 S400 D402 E404 N405 F406	I52-Y54 PolarHBondContact O-N 2.93Å; Y54-Q56 PolarHBondContact O-N 3.15Å; Y54-Q56 VanDerWaalsContact O-N 3.14Å; Y54-L57 PolarHBondContact O-N 2.93Å; Y54-Q85 HydrophobicContact CE1-CG 4.3Å; Y54-Q85 HydrophobicContact CE2-CG 4.35Å; Y54-Q85 PolarHBondContact OH-NE2 2.78Å; Y54-G86 CarbonylContact C-O 3.59Å; Y54-G86 VanDerWaalsContact C-O 3.23Å; Y54-F87 HydrophobicContact CD1-CD1 4.2Å; Y54-F87 AromaticContact CD1-CD2 3.85Å; Y54-F87 HydrophobicContact CD1-CD2 3.85Å; Y54-F87 AromaticContact CD1-CE1 3.73Å; Y54-F87 HydrophobicContact CD1-CE1 3.73Å; Y54-F87 AromaticContact CD1-CE2 3.33Å; Y54-F87 HydrophobicContact CD1-CE2 3.33Å; Y54-F87 HydrophobicContact CD1-CG 4.27Å; Y54-F87 AromaticContact CD1-CZ 3.29Å; Y54-F87 HydrophobicContact CD1-CZ 3.29Å; Y54-F87 HydrophobicContact CE1-CD2 4.33Å; Y54-F87 HydrophobicContact CE1-CE1 4.25Å; Y54-F87 AromaticContact CE1-CE2 3.43Å; Y54-F87 HydrophobicContact CE1-CE2 3.43Å; Y54-F87 VanDerWaalsContact CE1-CE2 3.43Å; Y54-F87 AromaticContact CE1-CZ 3.39Å; Y54-F87 HydrophobicContact CE1-CZ 3.39Å; Y54-F87 HydrophobicContact CG-CE2 4.45Å; Y54-S400 PolarHBondContact OH-O 2.86Å; Y54-S400 VanDerWaalsContact OH-O 3.1Å; Y54-S400 PolarHBondContact OH-OG 3.31Å; Y54-D402 WeakPolarHBondContact CE2-O 3.28Å; Y54-D402 PolarHBondContact OH-O 3.33Å; Y54-E404 VanDerWaalsContact CD2-C 3.43Å; Y54-E404 VanDerWaalsContact CD2-O 3.25Å; Y54-E404 WeakPolarHBondContact CD2-O 3.4Å; Y54-E404 PolarHBondContact N-O 3.02Å; Y54-N405 PolarHBondContact OH-O 3.37Å; Y54-F406 HydrophobicContact CD1-CB 3.88Å; Y54-F406 HydrophobicContact CE1-CB 3.61Å; Y54-F406 AromaticContact CE1-CD2 3.75Å; Y54-F406 HydrophobicContact CE1-CD2 3.75Å; Y54-F406 HydrophobicContact CE1-CG 4.08Å
55	K	89.8	Confident	81.9	Confident	170 Å²	170	65.9 Å²	65.9	74%	0.739	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-63	-20.4	-179.3	-65.8	-174.3	178.6	-179.6	0	114.2	P53 G86 N88	P53-K55 PolarHBondContact O-N 3.43Å; P53-K55 VanDerWaalsContact O-N 3.09Å; K55-G86 WeakPolarHBondContact CA-O 3.17Å; K55-G86 PolarHBondContact N-O 3.26Å; K55-N88 PolarHBondContact O-ND2 2.85Å
56	Q	91.4	Very high	84.3	Confident	132 Å²	132	62.9 Å²	62.9	62%	0.617	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-90.8	-11.7	178.6	-62.7	179	8.3	0	0	112.3	I52 P53 Y54	I52-Q56 HydrophobicContact CG2-CB 4.03Å; P53-Q56 HydrophobicContact CB-CG 4.38Å; P53-Q56 WeakPolarHBondContact O-CB 3.46Å; P53-Q56 PolarHBondContact O-N 2.94Å; Y54-Q56 PolarHBondContact O-N 3.15Å; Y54-Q56 VanDerWaalsContact O-N 3.14Å
57	L	93.8	Very high	86.5	Confident	11 Å²	11	67.1 Å²	67.1	6%	0.058	35%	0.347	C	S	.	.			trans	-97.7	138.1	-177.7	-66.5	169	0	0	0	110.7	I52 Y54 F87 N88 D123 L124 F406	I52-L57 HydrophobicContact CB-CD1 4.31Å; I52-L57 HydrophobicContact CB-CD2 4.38Å; I52-L57 HydrophobicContact CB-CG 4.4Å; I52-L57 HydrophobicContact CD1-CD2 4.4Å; I52-L57 HydrophobicContact CG2-CD1 4.32Å; I52-L57 HydrophobicContact CG2-CD2 3.97Å; I52-L57 HydrophobicContact CG2-CG 3.91Å; Y54-L57 PolarHBondContact O-N 2.93Å; L57-F87 HydrophobicContact CB-CD1 3.86Å; L57-F87 HydrophobicContact CB-CE1 3.96Å; L57-F87 HydrophobicContact CD1-CE1 3.97Å; L57-N88 PolarHBondContact O-N 3.49Å; L57-N88 VanDerWaalsContact O-N 3.14Å; L57-N88 PolarHBondContact O-ND2 2.93Å; L57-D123 HydrophobicContact CD2-CB 3.8Å; L57-L124 HydrophobicContact CB-CD1 4.3Å; L57-L124 HydrophobicContact CD1-CD1 4.35Å; L57-L124 HydrophobicContact CD2-CD1 4.14Å; L57-F406 HydrophobicContact CD1-CB 3.46Å; L57-F406 VanDerWaalsContact CD1-CB 3.46Å; L57-F406 HydrophobicContact CD1-CD1 3.71Å; L57-F406 HydrophobicContact CD1-CG 3.91Å
58	T	96.6	Very high	88.5	Confident	35 Å²	35	66.5 Å²	66.5	22%	0.215	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.5	174	-54	0	0	0	0	110.7	N88 I90 D123 L124	T58-N88 CarbonylContact C-O 3.58Å; T58-N88 WeakPolarHBondContact CA-O 3.02Å; T58-N88 HydrophobicContact CG2-CB 4.37Å; T58-I90 HydrophobicContact CG2-CB 4.48Å; T58-I90 HydrophobicContact CG2-CD1 3.95Å; T58-I90 HydrophobicContact CG2-CG1 3.88Å; T58-I90 HydrophobicContact CG2-CG2 3.93Å; T58-D123 PolarHBondContact N-OD2 3.09Å; T58-D123 PolarHBondContact O-N 3.1Å; T58-L124 PolarHBondContact O-N 3.41Å
59	V	97.2	Very high	90.1	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	119.7	175.1	-176.1	0	0	0	0	109	L74 L82 F87 N88 V89 I90 L124 V126	V59-L74 HydrophobicContact CG1-CD1 4.27Å; V59-L82 HydrophobicContact CG1-CD1 4.27Å; V59-F87 HydrophobicContact CG2-CB 3.95Å; V59-F87 HydrophobicContact CG2-CD1 3.6Å; V59-F87 HydrophobicContact CG2-CE1 4.18Å; V59-F87 HydrophobicContact CG2-CG 3.85Å; V59-N88 PolarHBondContact N-O 3.22Å; V59-V89 HydrophobicContact CB-CG2 4.43Å; V59-V89 WeakPolarHBondContact O-CA 3.33Å; V59-I90 PolarHBondContact O-N 2.96Å; V59-L124 CarbonylContact C-O 3.39Å; V59-L124 WeakPolarHBondContact CA-O 3.23Å; V59-L124 HydrophobicContact CG2-CB 4.14Å; V59-L124 HydrophobicContact CG2-CD2 4.38Å; V59-V126 HydrophobicContact CG1-CG2 3.56Å
60	G	97.3	Very high	91.6	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	129.8	177.2	0	0	0	0	0	112.4	P62 I90 S122 L124 V126	G60-P62 WeakPolarHBondContact O-CD 3.24Å; G60-I90 WeakPolarHBondContact CA-O 3.42Å; G60-S122 VanDerWaalsContact CA-OG 3.3Å; G60-S122 WeakPolarHBondContact CA-OG 3.47Å; G60-S122 PolarHBondContact N-OG 2.94Å; G60-L124 PolarHBondContact N-O 3.21Å; G60-V126 PolarHBondContact O-N 3.02Å
61	V	97.6	Very high	92.5	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	90.6	175.3	-172.2	0	0	0	0	109.3	V72 A73 L74 V89 I90 V91 E92 V119	V61-V72 HydrophobicContact CG1-CG2 3.79Å; V61-A73 HydrophobicContact CG1-CB 4.39Å; V61-L74 HydrophobicContact CG1-CB 4.45Å; V61-L74 HydrophobicContact CG2-CB 4.04Å; V61-L74 HydrophobicContact CG2-CD1 3.61Å; V61-L74 HydrophobicContact CG2-CG 4Å; V61-V89 HydrophobicContact CG2-CG1 4.34Å; V61-I90 PolarHBondContact N-O 3.2Å; V61-V91 HydrophobicContact CB-CB 4.46Å; V61-V91 HydrophobicContact CB-CG1 4.29Å; V61-V91 HydrophobicContact CB-CG2 4.13Å; V61-V91 HydrophobicContact CG2-CG2 4.24Å; V61-E92 PolarHBondContact O-N 3.48Å; V61-V119 VanDerWaalsContact C-CG1 3.47Å
62	P	96.6	Very high	93.3	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.013	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-76.5	160.1	178.6	33.5	-36.8	0	0	0	111.5	G60 E92 V119 L120 V125 V126 K127	G60-P62 WeakPolarHBondContact O-CD 3.24Å; P62-E92 WeakPolarHBondContact CA-OE2 3.17Å; P62-V119 HydrophobicContact CB-CG1 4.1Å; P62-L120 HydrophobicContact CB-CD2 3.9Å; P62-L120 HydrophobicContact CB-CG 4.3Å; P62-L120 HydrophobicContact CG-CD2 4.01Å; P62-V125 HydrophobicContact CG-CG1 4.23Å; P62-V126 WeakPolarHBondContact CD-O 3.32Å; P62-K127 HydrophobicContact CG-CD 3.96Å; P62-K127 HydrophobicContact CG-CG 3.45Å; P62-K127 VanDerWaalsContact CG-CG 3.45Å
63	K	95.1	Very high	93.7	Very high	87 Å²	87	51.1 Å²	51.1	38%	0.378	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-74.5	140.1	169.1	-176.7	173	-178.4	167.1	0	109.6	E92 A95	K63-E92 HydrophobicContact CB-CG 4.22Å; K63-E92 WeakPolarHBondContact CB-OE2 2.92Å; K63-E92 PolarHBondContact N-OE2 3.46Å; K63-A95 HydrophobicContact CB-CB 4.15Å
64	E	94.2	Very high	94	Very high	19 Å²	19	48.9 Å²	48.9	9%	0.089	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-77.5	131.9	174.7	-65.8	-63.7	168.4	0	0	111	E69 K127 V128 R129	E64-E69 HydrophobicContact CB-CB 4.01Å; E64-E69 HydrophobicContact CB-CG 3.56Å; E64-E69 HydrophobicContact CG-CG 3.76Å; E64-K127 IonicContact OE1-NZ 3.44Å; E64-K127 PolarHBondContact OE1-NZ 3.39Å; E64-K127 IonicContact OE2-NZ 3.21Å; E64-K127 PolarHBondContact OE2-NZ 3.17Å; E64-V128 HydrophobicContact CG-CB 4.29Å; E64-V128 HydrophobicContact CG-CG2 4.42Å; E64-V128 PolarHBondContact OE1-N 3.14Å; E64-R129 PolarHBondContact OE1-N 3.4Å
65	I	93.2	Very high	94.4	Very high	54 Å²	54	48.9 Å²	48.9	28%	0.277	23%	0.229	S	C	.	.			trans	-101.6	-5	179.4	54.9	163.6	0	0	0	113.2	I132 N134 E141	I65-I132 HydrophobicContact CD1-CD1 4Å; I65-I132 HydrophobicContact CD1-CG1 3.46Å; I65-I132 VanDerWaalsContact CD1-CG1 3.46Å; I65-I132 HydrophobicContact CG1-CD1 3.85Å; I65-I132 HydrophobicContact CG1-CG1 3.69Å; I65-N134 HydrophobicContact CD1-CB 3.64Å; I65-E141 HydrophobicContact CD1-CG 4.01Å
66	F	90.4	Very high	94.7	Very high	86 Å²	86	41.5 Å²	41.5	38%	0.377	20%	0.198	S	C	.	.	S	Bend	trans	-65.3	138.3	175.7	-171.2	-85.6	0	0	0	110.4	N68 E69 I132	F66-N68 PolarHBondContact O-N 2.78Å; F66-E69 HydrophobicContact CB-CB 4.13Å; F66-E69 HydrophobicContact CD1-CB 4.44Å; F66-E69 WeakPolarHBondContact O-CB 3.36Å; F66-E69 PolarHBondContact O-N 3.23Å; F66-E69 VanDerWaalsContact O-N 3.14Å; F66-I132 HydrophobicContact CB-CD1 4.28Å; F66-I132 HydrophobicContact CD2-CD1 4.27Å
67	Q	87.4	Confident	94.8	Very high	166 Å²	166	38.1 Å²	38.1	78%	0.776	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	131	-177.1	-70.1	-167.9	-1.2	0	0	111.7	E69	Q67-E69 PolarHBondContact O-N 3.17Å; Q67-E69 VanDerWaalsContact O-N 3.15Å
68	N	86.6	Confident	94.8	Very high	110 Å²	110	37.6 Å²	37.6	59%	0.588	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	13.8	179.9	-56.5	-38.9	0	0	0	115.8	F66 K70 S378	F66-N68 PolarHBondContact O-N 2.78Å; N68-K70 PolarHBondContact O-N 2.51Å; N68-S378 PolarHBondContact O-OG 3.2Å
69	E	92.7	Very high	94.8	Very high	23 Å²	23	36 Å²	36	11%	0.107	18%	0.18	C	C	.	.			trans	-76.3	119	168.4	-174.6	58.1	-97.8	0	0	109.7	E64 F66 Q67 R71 R129	E64-E69 HydrophobicContact CB-CB 4.01Å; E64-E69 HydrophobicContact CB-CG 3.56Å; E64-E69 HydrophobicContact CG-CG 3.76Å; F66-E69 HydrophobicContact CB-CB 4.13Å; F66-E69 HydrophobicContact CD1-CB 4.44Å; F66-E69 WeakPolarHBondContact O-CB 3.36Å; F66-E69 PolarHBondContact O-N 3.23Å; F66-E69 VanDerWaalsContact O-N 3.14Å; Q67-E69 PolarHBondContact O-N 3.17Å; Q67-E69 VanDerWaalsContact O-N 3.15Å; E69-R71 VanDerWaalsContact OE1-CB 3.29Å; E69-R71 WeakPolarHBondContact OE1-CB 3.4Å; E69-R71 WeakPolarHBondContact OE1-CG 3.35Å; E69-R71 IonicContact OE1-CZ 3.24Å; E69-R71 PolarHBondContact OE1-N 3.29Å; E69-R71 VanDerWaalsContact OE1-N 3.13Å; E69-R71 IonicContact OE1-NE 3.07Å; E69-R71 PolarHBondContact OE1-NE 3.21Å; E69-R71 IonicContact OE1-NH2 3.51Å; E69-R71 IonicContact OE2-CZ 2.74Å; E69-R71 IonicContact OE2-NE 2.84Å; E69-R71 IonicContact OE2-NH2 2.79Å; E69-R71 PolarHBondContact OE2-NH2 2.92Å; E69-R129 WeakPolarHBondContact OE2-CD 3.4Å
70	K	96.4	Very high	94.7	Very high	96 Å²	96	41.5 Å²	41.5	42%	0.417	21%	0.206	S	C	.	.			trans	-112.6	-13.5	-176.1	-64.4	177.2	-178.1	174.5	0	112.4	N68 A98 S99 S378 A381	N68-K70 PolarHBondContact O-N 2.51Å; K70-A98 HydrophobicContact CB-CB 3.82Å; K70-A98 HydrophobicContact CG-CB 4.09Å; K70-A98 CarbonylContact O-C 3.59Å; K70-A98 WeakPolarHBondContact O-CB 3.49Å; K70-S99 PolarHBondContact O-N 2.72Å; K70-S99 PolarHBondContact O-OG 3.11Å; K70-S378 WeakPolarHBondContact CB-OG 3.41Å; K70-S378 PolarHBondContact N-OG 3.27Å; K70-A381 HydrophobicContact CB-CB 3.67Å
71	R	96.9	Very high	94.4	Very high	29 Å²	29	43.4 Å²	43.4	11%	0.109	22%	0.222	C	C	.	.			trans	-73.4	157	-179.5	-61.8	173.9	-65.8	169.6	2.3	110.7	E69 S99 V128 M195 A381 A384 S385	E69-R71 VanDerWaalsContact OE1-CB 3.29Å; E69-R71 WeakPolarHBondContact OE1-CB 3.4Å; E69-R71 WeakPolarHBondContact OE1-CG 3.35Å; E69-R71 IonicContact OE1-CZ 3.24Å; E69-R71 PolarHBondContact OE1-N 3.29Å; E69-R71 VanDerWaalsContact OE1-N 3.13Å; E69-R71 IonicContact OE1-NE 3.07Å; E69-R71 PolarHBondContact OE1-NE 3.21Å; E69-R71 IonicContact OE1-NH2 3.51Å; E69-R71 IonicContact OE2-CZ 2.74Å; E69-R71 IonicContact OE2-NE 2.84Å; E69-R71 IonicContact OE2-NH2 2.79Å; E69-R71 PolarHBondContact OE2-NH2 2.92Å; R71-S99 VanDerWaalsContact CA-OG 3.31Å; R71-S99 WeakPolarHBondContact CA-OG 3.45Å; R71-V128 HydrophobicContact CB-CG1 4.41Å; R71-V128 HydrophobicContact CB-CG2 4.16Å; R71-M195 PolarHBondContact NH1-SD 3.42Å; R71-A381 HydrophobicContact CG-CB 4.28Å; R71-A384 VanDerWaalsContact CD-CB 3.45Å; R71-A384 HydrophobicContact CG-CB 3.83Å; R71-S385 WeakPolarHBondContact CA-OG 3.48Å
72	V	97.4	Very high	94.2	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.012	22%	0.222	C	C	.	.			trans	-124	148.3	170.9	65	0	0	0	0	109.3	V61 L74 A95 S99 F101 Y106 S385	V61-V72 HydrophobicContact CG1-CG2 3.79Å; V72-L74 PolarHBondContact O-N 3.13Å; V72-A95 HydrophobicContact CG2-CB 4.29Å; V72-S99 PolarHBondContact N-OG 3.33Å; V72-F101 HydrophobicContact CG1-CD2 3.94Å; V72-F101 HydrophobicContact CG1-CE2 4.36Å; V72-Y106 WeakPolarHBondContact CG1-OH 3.47Å; V72-S385 PolarHBondContact N-OG 3.37Å; V72-S385 VanDerWaalsContact O-CB 3.29Å; V72-S385 WeakPolarHBondContact O-CB 3.36Å; V72-S385 PolarHBondContact O-OG 3.35Å
73	A	96.9	Very high	94	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.008	24%	0.236	C	C	.	.	S	Bend	trans	-70.2	-34.5	-172.4	0	0	0	0	0	113.3	V61 V126 V128 Y388 S389	V61-A73 HydrophobicContact CG1-CB 4.39Å; A73-V126 HydrophobicContact CB-CB 4.37Å; A73-V126 HydrophobicContact CB-CG1 3.86Å; A73-V126 WeakPolarHBondContact CB-O 3.49Å; A73-V128 HydrophobicContact CB-CG2 4.09Å; A73-Y388 HydrophobicContact CB-CE1 4.26Å; A73-S389 WeakPolarHBondContact O-CA 3.46Å
74	L	97.3	Very high	93.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.258	C	S	.	.			trans	-125.9	131.8	177.2	-64.7	-177.5	0	0	0	111.7	V59 V61 V72 V79 L82 Y106 V126 I392	V59-L74 HydrophobicContact CG1-CD1 4.27Å; V61-L74 HydrophobicContact CG1-CB 4.45Å; V61-L74 HydrophobicContact CG2-CB 4.04Å; V61-L74 HydrophobicContact CG2-CD1 3.61Å; V61-L74 HydrophobicContact CG2-CG 4Å; V72-L74 PolarHBondContact O-N 3.13Å; L74-V79 HydrophobicContact CB-CG2 4.1Å; L74-V79 HydrophobicContact CD1-CG2 4.46Å; L74-L82 HydrophobicContact CD1-CD1 3.53Å; L74-L82 HydrophobicContact CD2-CD1 4.47Å; L74-Y106 WeakPolarHBondContact O-CE1 3.42Å; L74-Y106 PolarHBondContact O-OH 2.99Å; L74-V126 HydrophobicContact CG-CG1 4.47Å; L74-I392 HydrophobicContact CD2-CG2 4.29Å
75	S	97.1	Very high	93.4	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.021	26%	0.264	C	S	.	.			trans	-81.6	162.9	168.2	68.3	0	0	0	0	110.7	A77 G78 V79 S389	S75-A77 VanDerWaalsContact C-N 3.3Å; S75-A77 PolarHBondContact O-N 2.92Å; S75-G78 WeakPolarHBondContact O-CA 3.46Å; S75-G78 PolarHBondContact O-N 3.36Å; S75-G78 PolarHBondContact OG-N 3.33Å; S75-V79 PolarHBondContact O-N 2.99Å; S75-S389 PolarHBondContact N-OG 3.13Å; S75-S389 VanDerWaalsContact N-OG 3.13Å; S75-S389 PolarHBondContact OG-OG 3.39Å
76	P	96.7	Very high	93.3	Very high	16 Å²	16	50.6 Å²	50.6	10%	0.104	26%	0.261	C	S	.	.	H	α-helix	trans	-55.3	-40.7	174.9	-28.1	35.9	0	0	0	113.8	G78 V79 Q80 F101 H105 Y106 V109	P76-G78 PolarHBondContact O-N 3.11Å; P76-V79 PolarHBondContact O-N 2.94Å; P76-Q80 PolarHBondContact O-N 2.81Å; P76-F101 HydrophobicContact CG-CB 4.19Å; P76-F101 HydrophobicContact CG-CD1 3.95Å; P76-F101 HydrophobicContact CG-CG 4.1Å; P76-H105 HydrophobicContact CB-CB 4.25Å; P76-H105 HydrophobicContact CG-CB 3.81Å; P76-Y106 HydrophobicContact CG-CD1 4.33Å; P76-Y106 HydrophobicContact CG-CE1 4.13Å; P76-V109 HydrophobicContact CB-CG1 4.31Å; P76-V109 HydrophobicContact CB-CG2 4.31Å
77	A	93.3	Very high	93.4	Very high	61 Å²	61	46.8 Å²	46.8	50%	0.504	25%	0.245	S	C	.	.	H	α-helix	trans	-59.8	-36.6	173.8	0	0	0	0	0	111.8	S75 Q80 A81	S75-A77 VanDerWaalsContact C-N 3.3Å; S75-A77 PolarHBondContact O-N 2.92Å; A77-Q80 WeakPolarHBondContact O-CB 3.4Å; A77-Q80 PolarHBondContact O-N 3.44Å; A77-A81 PolarHBondContact O-N 3.27Å
78	G	94.3	Very high	93.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-70.8	-38.4	177	0	0	0	0	0	114.4	S75 P76 A81 L82 I393	S75-G78 WeakPolarHBondContact O-CA 3.46Å; S75-G78 PolarHBondContact O-N 3.36Å; S75-G78 PolarHBondContact OG-N 3.33Å; P76-G78 PolarHBondContact O-N 3.11Å; G78-A81 PolarHBondContact O-N 3.25Å; G78-L82 PolarHBondContact O-N 3.12Å; G78-L82 VanDerWaalsContact O-N 3.17Å; G78-I393 WeakPolarHBondContact O-CD1 3.45Å
79	V	95.8	Very high	94.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.5	-45.7	171.7	171.6	0	0	0	0	110.6	L74 S75 P76 A81 L82 V83 V89 Y106 V109 A111	L74-V79 HydrophobicContact CB-CG2 4.1Å; L74-V79 HydrophobicContact CD1-CG2 4.46Å; S75-V79 PolarHBondContact O-N 2.99Å; P76-V79 PolarHBondContact O-N 2.94Å; V79-A81 PolarHBondContact O-N 3.23Å; V79-L82 PolarHBondContact O-N 3.21Å; V79-L82 VanDerWaalsContact O-N 3.14Å; V79-V83 HydrophobicContact CG1-CG2 4.17Å; V79-V83 WeakPolarHBondContact O-CG2 3.11Å; V79-V83 PolarHBondContact O-N 3.48Å; V79-V89 HydrophobicContact CG1-CB 4.05Å; V79-V89 HydrophobicContact CG1-CG1 3.98Å; V79-V89 HydrophobicContact CG1-CG2 4.25Å; V79-V89 HydrophobicContact CG2-CG1 4.04Å; V79-Y106 HydrophobicContact CG2-CD1 3.84Å; V79-Y106 HydrophobicContact CG2-CE1 3.91Å; V79-V109 HydrophobicContact CB-CG2 3.87Å; V79-V109 HydrophobicContact CG1-CG2 3.61Å; V79-A111 HydrophobicContact CG1-CB 3.71Å
80	Q	94.9	Very high	94.6	Very high	117 Å²	117	37 Å²	37	55%	0.547	20%	0.199	S	C	.	.	H	α-helix	trans	-55.4	-41.2	176.5	-168.2	-176.2	26.5	0	0	111.9	P76 A77 K84 V109	P76-Q80 PolarHBondContact O-N 2.81Å; A77-Q80 WeakPolarHBondContact O-CB 3.4Å; A77-Q80 PolarHBondContact O-N 3.44Å; Q80-K84 VanDerWaalsContact O-CB 3.29Å; Q80-K84 WeakPolarHBondContact O-CB 3.31Å; Q80-K84 PolarHBondContact O-N 2.85Å; Q80-V109 HydrophobicContact CB-CB 4.09Å; Q80-V109 HydrophobicContact CB-CG1 4.27Å
81	A	92.2	Very high	94.6	Very high	40 Å²	40	32.5 Å²	32.5	33%	0.331	18%	0.179	S	C	.	.	H	α-helix	trans	-65.3	-43.4	177.8	0	0	0	0	0	112.8	A77 G78 V79 K84 Q85 I393	A77-A81 PolarHBondContact O-N 3.27Å; G78-A81 PolarHBondContact O-N 3.25Å; V79-A81 PolarHBondContact O-N 3.23Å; A81-K84 PolarHBondContact O-N 3.4Å; A81-Q85 PolarHBondContact O-N 3.06Å; A81-I393 HydrophobicContact CB-CD1 4.29Å; A81-I393 HydrophobicContact CB-CG2 4.11Å
82	L	92.4	Very high	94.6	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-69.3	-38.9	178.3	-67.5	-178.8	0	0	0	112.6	V59 L74 G78 V79 K84 Q85 G86 F87 V89 I393 L396	V59-L82 HydrophobicContact CG1-CD1 4.27Å; L74-L82 HydrophobicContact CD1-CD1 3.53Å; L74-L82 HydrophobicContact CD2-CD1 4.47Å; G78-L82 PolarHBondContact O-N 3.12Å; G78-L82 VanDerWaalsContact O-N 3.17Å; V79-L82 PolarHBondContact O-N 3.21Å; V79-L82 VanDerWaalsContact O-N 3.14Å; L82-K84 VanDerWaalsContact C-N 3.33Å; L82-Q85 WeakPolarHBondContact O-CB 3.26Å; L82-Q85 PolarHBondContact O-N 2.58Å; L82-G86 PolarHBondContact O-N 3.35Å; L82-F87 HydrophobicContact CB-CB 4.41Å; L82-F87 HydrophobicContact CB-CD2 4.34Å; L82-F87 HydrophobicContact CD2-CD2 4.08Å; L82-F87 HydrophobicContact CD2-CE2 4.26Å; L82-F87 PolarHBondContact O-N 3.14Å; L82-F87 VanDerWaalsContact O-N 3.08Å; L82-V89 HydrophobicContact CB-CG2 4.06Å; L82-I393 HydrophobicContact CD2-CG1 4.32Å; L82-I393 HydrophobicContact CG-CG1 4.33Å; L82-L396 HydrophobicContact CD2-CD1 3.96Å
83	V	93.3	Very high	94.6	Very high	51 Å²	51	35.1 Å²	35.1	31%	0.309	20%	0.2	S	C	.	.	H	α-helix	trans	-62.4	-42.9	173.6	172.5	0	0	0	0	110.2	V79 Q85 G86 V89	V79-V83 HydrophobicContact CG1-CG2 4.17Å; V79-V83 WeakPolarHBondContact O-CG2 3.11Å; V79-V83 PolarHBondContact O-N 3.48Å; V83-Q85 VanDerWaalsContact C-N 3.28Å; V83-Q85 PolarHBondContact O-N 2.95Å; V83-G86 WeakPolarHBondContact O-CA 3.5Å; V83-G86 PolarHBondContact O-N 2.91Å; V83-V89 HydrophobicContact CG2-CB 4.47Å; V83-V89 HydrophobicContact CG2-CG2 3.96Å
84	K	89.7	Confident	94.4	Very high	195 Å²	195	35.3 Å²	35.3	85%	0.848	20%	0.202	S	C	*	.	H	α-helix	trans	-63.4	-32.5	174.5	-173.9	176.3	-179.8	176.9	0	112.7	Q80 A81 L82 G86	Q80-K84 VanDerWaalsContact O-CB 3.29Å; Q80-K84 WeakPolarHBondContact O-CB 3.31Å; Q80-K84 PolarHBondContact O-N 2.85Å; A81-K84 PolarHBondContact O-N 3.4Å; L82-K84 VanDerWaalsContact C-N 3.33Å; K84-G86 VanDerWaalsContact C-N 3.31Å
85	Q	86.6	Confident	94.3	Very high	46 Å²	46	35.6 Å²	35.6	22%	0.215	20%	0.204	C	C	.	.	H	α-helix	trans	-73.2	-23.9	173.8	-172	170.8	-1.4	0	0	112.5	Y54 A81 L82 V83 F87	Y54-Q85 HydrophobicContact CE1-CG 4.3Å; Y54-Q85 HydrophobicContact CE2-CG 4.35Å; Y54-Q85 PolarHBondContact OH-NE2 2.78Å; A81-Q85 PolarHBondContact O-N 3.06Å; L82-Q85 WeakPolarHBondContact O-CB 3.26Å; L82-Q85 PolarHBondContact O-N 2.58Å; V83-Q85 VanDerWaalsContact C-N 3.28Å; V83-Q85 PolarHBondContact O-N 2.95Å; Q85-F87 HydrophobicContact CB-CD2 4.47Å; Q85-F87 HydrophobicContact CG-CD2 4.47Å; Q85-F87 HydrophobicContact CG-CE2 4.36Å
86	G	90.5	Very high	94.1	Very high	21 Å²	21	35.5 Å²	35.5	22%	0.216	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	117.8	5.1	171.5	0	0	0	0	0	115.4	Y54 K55 L82 V83 K84	Y54-G86 CarbonylContact C-O 3.59Å; Y54-G86 VanDerWaalsContact C-O 3.23Å; K55-G86 WeakPolarHBondContact CA-O 3.17Å; K55-G86 PolarHBondContact N-O 3.26Å; L82-G86 PolarHBondContact O-N 3.35Å; V83-G86 WeakPolarHBondContact O-CA 3.5Å; V83-G86 PolarHBondContact O-N 2.91Å; K84-G86 VanDerWaalsContact C-N 3.31Å
87	F	94	Very high	94	Very high	5 Å²	5	40.3 Å²	40.3	2%	0.022	22%	0.224	C	C	.	.			trans	-73.4	150.8	174.2	-72.1	-82.8	0	0	0	111.7	Y54 L57 V59 L82 Q85 L124 F406	Y54-F87 HydrophobicContact CD1-CD1 4.2Å; Y54-F87 AromaticContact CD1-CD2 3.85Å; Y54-F87 HydrophobicContact CD1-CD2 3.85Å; Y54-F87 AromaticContact CD1-CE1 3.73Å; Y54-F87 HydrophobicContact CD1-CE1 3.73Å; Y54-F87 AromaticContact CD1-CE2 3.33Å; Y54-F87 HydrophobicContact CD1-CE2 3.33Å; Y54-F87 HydrophobicContact CD1-CG 4.27Å; Y54-F87 AromaticContact CD1-CZ 3.29Å; Y54-F87 HydrophobicContact CD1-CZ 3.29Å; Y54-F87 HydrophobicContact CE1-CD2 4.33Å; Y54-F87 HydrophobicContact CE1-CE1 4.25Å; Y54-F87 AromaticContact CE1-CE2 3.43Å; Y54-F87 HydrophobicContact CE1-CE2 3.43Å; Y54-F87 VanDerWaalsContact CE1-CE2 3.43Å; Y54-F87 AromaticContact CE1-CZ 3.39Å; Y54-F87 HydrophobicContact CE1-CZ 3.39Å; Y54-F87 HydrophobicContact CG-CE2 4.45Å; L57-F87 HydrophobicContact CB-CD1 3.86Å; L57-F87 HydrophobicContact CB-CE1 3.96Å; L57-F87 HydrophobicContact CD1-CE1 3.97Å; V59-F87 HydrophobicContact CG2-CB 3.95Å; V59-F87 HydrophobicContact CG2-CD1 3.6Å; V59-F87 HydrophobicContact CG2-CE1 4.18Å; V59-F87 HydrophobicContact CG2-CG 3.85Å; L82-F87 HydrophobicContact CB-CB 4.41Å; L82-F87 HydrophobicContact CB-CD2 4.34Å; L82-F87 HydrophobicContact CD2-CD2 4.08Å; L82-F87 HydrophobicContact CD2-CE2 4.26Å; L82-F87 PolarHBondContact O-N 3.14Å; L82-F87 VanDerWaalsContact O-N 3.08Å; Q85-F87 HydrophobicContact CB-CD2 4.47Å; Q85-F87 HydrophobicContact CG-CD2 4.47Å; Q85-F87 HydrophobicContact CG-CE2 4.36Å; F87-L124 HydrophobicContact CE1-CD1 4.37Å; F87-L124 HydrophobicContact CE1-CD2 4.12Å; F87-L124 HydrophobicContact CZ-CD2 4.44Å; F87-F406 HydrophobicContact CE1-CG 4.49Å; F87-F406 AromaticContact CZ-CD2 3.91Å; F87-F406 HydrophobicContact CZ-CD2 3.91Å; F87-F406 HydrophobicContact CZ-CE2 4.27Å; F87-F406 HydrophobicContact CZ-CG 4.18Å
88	N	95.8	Very high	94.1	Very high	77 Å²	77	39.9 Å²	39.9	41%	0.412	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	133.4	161.1	-55.2	-66.9	0	0	0	108.6	K55 L57 T58 V59	K55-N88 PolarHBondContact O-ND2 2.85Å; L57-N88 PolarHBondContact O-N 3.49Å; L57-N88 VanDerWaalsContact O-N 3.14Å; L57-N88 PolarHBondContact O-ND2 2.93Å; T58-N88 CarbonylContact C-O 3.58Å; T58-N88 WeakPolarHBondContact CA-O 3.02Å; T58-N88 HydrophobicContact CG2-CB 4.37Å; V59-N88 PolarHBondContact N-O 3.22Å
89	V	97.2	Very high	94.1	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.024	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.8	178.9	-173.7	0	0	0	0	110	V59 V61 V79 L82 V83 V91 A111 K112	V59-V89 HydrophobicContact CB-CG2 4.43Å; V59-V89 WeakPolarHBondContact O-CA 3.33Å; V61-V89 HydrophobicContact CG2-CG1 4.34Å; V79-V89 HydrophobicContact CG1-CB 4.05Å; V79-V89 HydrophobicContact CG1-CG1 3.98Å; V79-V89 HydrophobicContact CG1-CG2 4.25Å; V79-V89 HydrophobicContact CG2-CG1 4.04Å; L82-V89 HydrophobicContact CB-CG2 4.06Å; V83-V89 HydrophobicContact CG2-CB 4.47Å; V83-V89 HydrophobicContact CG2-CG2 3.96Å; V89-V91 HydrophobicContact CG1-CG2 4.17Å; V89-A111 HydrophobicContact CB-CB 4.16Å; V89-A111 HydrophobicContact CG1-CB 4.17Å; V89-A111 WeakPolarHBondContact O-CA 3.34Å; V89-A111 WeakPolarHBondContact O-CB 3.34Å; V89-K112 PolarHBondContact O-N 2.63Å
90	I	97.4	Very high	94.2	Very high	14 Å²	14	47.7 Å²	47.7	7%	0.072	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	135	171.5	66.4	176.7	0	0	0	110	T58 V59 G60 V61 K112 Q114 V119 S122	T58-I90 HydrophobicContact CG2-CB 4.48Å; T58-I90 HydrophobicContact CG2-CD1 3.95Å; T58-I90 HydrophobicContact CG2-CG1 3.88Å; T58-I90 HydrophobicContact CG2-CG2 3.93Å; V59-I90 PolarHBondContact O-N 2.96Å; G60-I90 WeakPolarHBondContact CA-O 3.42Å; V61-I90 PolarHBondContact N-O 3.2Å; I90-K112 CarbonylContact C-O 3.56Å; I90-K112 VanDerWaalsContact CA-O 3.28Å; I90-K112 WeakPolarHBondContact CA-O 3.11Å; I90-K112 HydrophobicContact CG2-CB 4.21Å; I90-Q114 VanDerWaalsContact CD1-OE1 3.31Å; I90-V119 HydrophobicContact CD1-CG2 4.26Å; I90-V119 HydrophobicContact CG1-CG2 4.24Å; I90-S122 VanDerWaalsContact CD1-OG 3.31Å; I90-S122 WeakPolarHBondContact CD1-OG 3.44Å
91	V	97.6	Very high	94.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	136	-176.2	-176.6	0	0	0	0	108.3	V61 V89 A95 Y106 A111 K112 I113 Q114	V61-V91 HydrophobicContact CB-CB 4.46Å; V61-V91 HydrophobicContact CB-CG1 4.29Å; V61-V91 HydrophobicContact CB-CG2 4.13Å; V61-V91 HydrophobicContact CG2-CG2 4.24Å; V89-V91 HydrophobicContact CG1-CG2 4.17Å; V91-A95 HydrophobicContact CG1-CB 4Å; V91-Y106 HydrophobicContact CG1-CD1 4.44Å; V91-Y106 HydrophobicContact CG1-CD2 4.27Å; V91-Y106 HydrophobicContact CG1-CE2 4.38Å; V91-Y106 HydrophobicContact CG1-CG 4.29Å; V91-Y106 HydrophobicContact CG2-CD1 3.92Å; V91-Y106 HydrophobicContact CG2-CE1 4.38Å; V91-Y106 HydrophobicContact CG2-CG 4.24Å; V91-A111 HydrophobicContact CG2-CB 3.91Å; V91-K112 PolarHBondContact N-O 3.13Å; V91-I113 HydrophobicContact CB-CD1 3.98Å; V91-I113 HydrophobicContact CG1-CD1 4.48Å; V91-I113 WeakPolarHBondContact O-CA 3.44Å; V91-Q114 PolarHBondContact O-N 3.05Å
92	E	97.3	Very high	94.5	Very high	19 Å²	19	43.5 Å²	43.5	9%	0.089	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	137.6	175	-179.2	176.4	174	0	0	110.5	V61 P62 K63 G94 A95 Q114 T116 V119	V61-E92 PolarHBondContact O-N 3.48Å; P62-E92 WeakPolarHBondContact CA-OE2 3.17Å; K63-E92 HydrophobicContact CB-CG 4.22Å; K63-E92 WeakPolarHBondContact CB-OE2 2.92Å; K63-E92 PolarHBondContact N-OE2 3.46Å; E92-G94 PolarHBondContact O-N 2.88Å; E92-A95 HydrophobicContact CB-CB 4.3Å; E92-A95 WeakPolarHBondContact O-CB 3.5Å; E92-A95 PolarHBondContact O-N 3Å; E92-Q114 WeakPolarHBondContact CA-O 3.38Å; E92-T116 WeakPolarHBondContact OE1-CB 3.23Å; E92-T116 WeakPolarHBondContact OE1-CG2 3.17Å; E92-T116 PolarHBondContact OE1-OG1 3.06Å; E92-V119 HydrophobicContact CB-CB 4.45Å; E92-V119 HydrophobicContact CB-CG1 4.4Å; E92-V119 HydrophobicContact CB-CG2 4.08Å
93	S	95.8	Very high	94.7	Very high	67 Å²	67	44.3 Å²	44.3	47%	0.469	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	128.8	178.1	-170.9	0	0	0	0	111.6	A95 D103 Q114	S93-A95 VanDerWaalsContact C-N 3.29Å; S93-A95 PolarHBondContact O-N 3.05Å; S93-D103 WeakPolarHBondContact CA-OD2 3.25Å; S93-D103 PolarHBondContact OG-OD2 3.03Å; S93-Q114 PolarHBondContact N-O 2.85Å; S93-Q114 VanDerWaalsContact N-O 3.17Å
94	G	94.3	Very high	94.8	Very high	5 Å²	5	46.2 Å²	46.2	5%	0.052	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	13.1	-178.7	0	0	0	0	0	114.9	E92 G96 D103	E92-G94 PolarHBondContact O-N 2.88Å; G94-G96 VanDerWaalsContact C-N 3.32Å; G94-G96 PolarHBondContact O-N 2.82Å; G94-D103 PolarHBondContact N-OD1 3.08Å; G94-D103 PolarHBondContact N-OD2 3.16Å
95	A	93.8	Very high	95	Very high	7 Å²	7	40.8 Å²	40.8	6%	0.058	22%	0.223	C	C	.	.	S	Bend	trans	-62.8	-37.1	177.8	0	0	0	0	0	112.9	K63 V72 V91 E92 S93	K63-A95 HydrophobicContact CB-CB 4.15Å; V72-A95 HydrophobicContact CG2-CB 4.29Å; V91-A95 HydrophobicContact CG1-CB 4Å; E92-A95 HydrophobicContact CB-CB 4.3Å; E92-A95 WeakPolarHBondContact O-CB 3.5Å; E92-A95 PolarHBondContact O-N 3Å; S93-A95 VanDerWaalsContact C-N 3.29Å; S93-A95 PolarHBondContact O-N 3.05Å
96	G	93.6	Very high	95.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	-91.8	-8.7	-176	0	0	0	0	0	115.8	G94 A98 S99 K100 F101	G94-G96 VanDerWaalsContact C-N 3.32Å; G94-G96 PolarHBondContact O-N 2.82Å; G96-A98 VanDerWaalsContact C-N 3.34Å; G96-A98 PolarHBondContact O-N 2.86Å; G96-S99 CarbonylContact O-C 3.55Å; G96-S99 WeakPolarHBondContact O-CA 3.39Å; G96-S99 WeakPolarHBondContact O-CB 3.48Å; G96-S99 PolarHBondContact O-N 3.33Å; G96-K100 PolarHBondContact O-N 3.21Å; G96-F101 CarbonylContact C-O 3.31Å; G96-F101 WeakPolarHBondContact CA-O 3.44Å; G96-F101 PolarHBondContact O-N 3.19Å
97	E	94.6	Very high	95.8	Very high	117 Å²	117	43.3 Å²	43.3	55%	0.547	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-57.6	-43.5	-169.5	-76.3	177	174.1	0	0	113	S99 K100 F101	E97-S99 PolarHBondContact O-N 3.29Å; E97-K100 PolarHBondContact O-N 2.84Å; E97-F101 PolarHBondContact N-O 2.84Å
98	A	94.6	Very high	95.8	Very high	53 Å²	53	50.5 Å²	50.5	44%	0.438	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-67.5	-25.8	178.6	0	0	0	0	0	112.8	K70 G96	K70-A98 HydrophobicContact CB-CB 3.82Å; K70-A98 HydrophobicContact CG-CB 4.09Å; K70-A98 CarbonylContact O-C 3.59Å; K70-A98 WeakPolarHBondContact O-CB 3.49Å; G96-A98 VanDerWaalsContact C-N 3.34Å; G96-A98 PolarHBondContact O-N 2.86Å
99	S	95.2	Very high	95.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-89.2	3.2	172.3	-74.9	0	0	0	0	113.9	K70 R71 V72 G96 E97 F101 T382 S385	K70-S99 PolarHBondContact O-N 2.72Å; K70-S99 PolarHBondContact O-OG 3.11Å; R71-S99 VanDerWaalsContact CA-OG 3.31Å; R71-S99 WeakPolarHBondContact CA-OG 3.45Å; V72-S99 PolarHBondContact N-OG 3.33Å; G96-S99 CarbonylContact O-C 3.55Å; G96-S99 WeakPolarHBondContact O-CA 3.39Å; G96-S99 WeakPolarHBondContact O-CB 3.48Å; G96-S99 PolarHBondContact O-N 3.33Å; E97-S99 PolarHBondContact O-N 3.29Å; S99-F101 VanDerWaalsContact C-N 3.34Å; S99-T382 WeakPolarHBondContact O-CB 3.33Å; S99-T382 PolarHBondContact O-OG1 3.39Å; S99-S385 PolarHBondContact OG-OG 2.91Å
100	K	96.8	Very high	95.6	Very high	163 Å²	163	50.4 Å²	50.4	71%	0.709	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	31.1	-176.9	-52	-60.6	-175.1	-178.8	0	114.3	G96 E97	G96-K100 PolarHBondContact O-N 3.21Å; E97-K100 PolarHBondContact O-N 2.84Å
101	F	96.6	Very high	95.4	Very high	28 Å²	28	50 Å²	50	12%	0.123	27%	0.269	C	S	.	.			trans	-109	116.7	166.7	-57.8	-54.2	0	0	0	109.3	V72 P76 G96 E97 S99 Y106 T382	V72-F101 HydrophobicContact CG1-CD2 3.94Å; V72-F101 HydrophobicContact CG1-CE2 4.36Å; P76-F101 HydrophobicContact CG-CB 4.19Å; P76-F101 HydrophobicContact CG-CD1 3.95Å; P76-F101 HydrophobicContact CG-CG 4.1Å; G96-F101 CarbonylContact C-O 3.31Å; G96-F101 WeakPolarHBondContact CA-O 3.44Å; G96-F101 PolarHBondContact O-N 3.19Å; E97-F101 PolarHBondContact N-O 2.84Å; S99-F101 VanDerWaalsContact C-N 3.34Å; F101-Y106 HydrophobicContact CB-CE2 3.8Å; F101-T382 HydrophobicContact CE1-CG2 4.12Å; F101-T382 HydrophobicContact CE2-CG2 4.44Å; F101-T382 HydrophobicContact CZ-CG2 3.74Å
102	S	96.8	Very high	95.4	Very high	42 Å²	42	57 Å²	57	29%	0.294	30%	0.299	S	S	.	.			trans	-75.4	156.8	176.8	59.8	0	0	0	0	111.2	D104 H105 Y106	S102-D104 PolarHBondContact O-N 2.95Å; S102-H105 PolarHBondContact O-N 3.37Å; S102-H105 PolarHBondContact OG-N 3.41Å; S102-H105 PolarHBondContact OG-ND1 3.13Å; S102-Y106 VanDerWaalsContact O-CD2 3.3Å; S102-Y106 WeakPolarHBondContact O-CD2 3.31Å
103	D	96.8	Very high	95.4	Very high	16 Å²	16	57.8 Å²	57.8	9%	0.086	30%	0.303	C	S	.	.	H	α-helix	trans	-57.3	-30.5	172.3	-75.9	6.5	0	0	0	111.9	S93 G94 Y106 R107 I113	S93-D103 WeakPolarHBondContact CA-OD2 3.25Å; S93-D103 PolarHBondContact OG-OD2 3.03Å; G94-D103 PolarHBondContact N-OD1 3.08Å; G94-D103 PolarHBondContact N-OD2 3.16Å; D103-Y106 PolarHBondContact O-N 2.88Å; D103-R107 WeakPolarHBondContact O-CG 3.22Å; D103-R107 PolarHBondContact O-N 2.82Å; D103-I113 HydrophobicContact CB-CD1 4.23Å; D103-I113 HydrophobicContact CB-CG1 4.19Å
104	D	95.6	Very high	95.3	Very high	91 Å²	91	57.8 Å²	57.8	49%	0.487	30%	0.296	S	S	.	.	H	α-helix	trans	-64.8	-42.7	177.6	-65.2	-37.4	0	0	0	112.6	S102 Y106 R107 E108	S102-D104 PolarHBondContact O-N 2.95Å; D104-Y106 PolarHBondContact O-N 2.7Å; D104-R107 WeakPolarHBondContact O-CB 3.46Å; D104-R107 PolarHBondContact O-N 2.91Å; D104-R107 IonicContact OD1-CZ 3.29Å; D104-R107 IonicContact OD1-NH1 2.58Å; D104-R107 PolarHBondContact OD1-NH1 3.48Å; D104-E108 WeakPolarHBondContact O-CG 3.43Å; D104-E108 PolarHBondContact O-N 2.74Å
105	H	94.6	Very high	95.2	Very high	81 Å²	81	59.4 Å²	59.4	38%	0.375	31%	0.313	S	S	.	.	H	α-helix	trans	-59.1	-34.9	175.3	-64.7	159	0	0	0	111.8	P76 S102 V109	P76-H105 HydrophobicContact CB-CB 4.25Å; P76-H105 HydrophobicContact CG-CB 3.81Å; S102-H105 PolarHBondContact O-N 3.37Å; S102-H105 PolarHBondContact OG-N 3.41Å; S102-H105 PolarHBondContact OG-ND1 3.13Å; H105-V109 WeakPolarHBondContact O-CG2 3.47Å; H105-V109 PolarHBondContact O-N 2.96Å
106	Y	96.7	Very high	95.1	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-71.6	-37.2	175.9	-71.8	-71.1	0	0	0	112.5	V72 L74 P76 V79 V91 F101 S102 D103 D104 V109 G110 A111	V72-Y106 WeakPolarHBondContact CG1-OH 3.47Å; L74-Y106 WeakPolarHBondContact O-CE1 3.42Å; L74-Y106 PolarHBondContact O-OH 2.99Å; P76-Y106 HydrophobicContact CG-CD1 4.33Å; P76-Y106 HydrophobicContact CG-CE1 4.13Å; V79-Y106 HydrophobicContact CG2-CD1 3.84Å; V79-Y106 HydrophobicContact CG2-CE1 3.91Å; V91-Y106 HydrophobicContact CG1-CD1 4.44Å; V91-Y106 HydrophobicContact CG1-CD2 4.27Å; V91-Y106 HydrophobicContact CG1-CE2 4.38Å; V91-Y106 HydrophobicContact CG1-CG 4.29Å; V91-Y106 HydrophobicContact CG2-CD1 3.92Å; V91-Y106 HydrophobicContact CG2-CE1 4.38Å; V91-Y106 HydrophobicContact CG2-CG 4.24Å; F101-Y106 HydrophobicContact CB-CE2 3.8Å; S102-Y106 VanDerWaalsContact O-CD2 3.3Å; S102-Y106 WeakPolarHBondContact O-CD2 3.31Å; D103-Y106 PolarHBondContact O-N 2.88Å; D104-Y106 PolarHBondContact O-N 2.7Å; Y106-V109 VanDerWaalsContact O-CG2 3.31Å; Y106-V109 WeakPolarHBondContact O-CG2 3.36Å; Y106-G110 PolarHBondContact O-N 2.92Å; Y106-A111 WeakPolarHBondContact O-CB 3.43Å; Y106-A111 PolarHBondContact O-N 2.91Å
107	R	95.9	Very high	94.9	Very high	121 Å²	121	67.4 Å²	67.4	46%	0.457	35%	0.35	S	S	.	.	H	α-helix	trans	-64	-43.5	174.5	-68.2	176.8	-171.3	110.3	8.1	111.7	D103 D104 V109 G110 I113	D103-R107 WeakPolarHBondContact O-CG 3.22Å; D103-R107 PolarHBondContact O-N 2.82Å; D104-R107 WeakPolarHBondContact O-CB 3.46Å; D104-R107 PolarHBondContact O-N 2.91Å; D104-R107 IonicContact OD1-CZ 3.29Å; D104-R107 IonicContact OD1-NH1 2.58Å; D104-R107 PolarHBondContact OD1-NH1 3.48Å; R107-V109 VanDerWaalsContact C-N 3.29Å; R107-V109 PolarHBondContact O-N 2.79Å; R107-G110 PolarHBondContact O-N 2.84Å; R107-I113 HydrophobicContact CG-CG1 3.84Å
108	E	95.3	Very high	94.9	Very high	155 Å²	155	67 Å²	67	72%	0.724	35%	0.348	S	S	*	.	H	α-helix	trans	-60	-36.2	-179.3	-74.2	173	178.8	0	0	113	D104 G110	D104-E108 WeakPolarHBondContact O-CG 3.43Å; D104-E108 PolarHBondContact O-N 2.74Å; E108-G110 VanDerWaalsContact C-N 3.3Å; E108-G110 PolarHBondContact O-N 3.24Å
109	V	94.6	Very high	94.9	Very high	32 Å²	32	64.5 Å²	64.5	19%	0.194	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	5.9	178.5	-58.7	0	0	0	0	113.7	P76 V79 Q80 H105 Y106 R107	P76-V109 HydrophobicContact CB-CG1 4.31Å; P76-V109 HydrophobicContact CB-CG2 4.31Å; V79-V109 HydrophobicContact CB-CG2 3.87Å; V79-V109 HydrophobicContact CG1-CG2 3.61Å; Q80-V109 HydrophobicContact CB-CB 4.09Å; Q80-V109 HydrophobicContact CB-CG1 4.27Å; H105-V109 WeakPolarHBondContact O-CG2 3.47Å; H105-V109 PolarHBondContact O-N 2.96Å; Y106-V109 VanDerWaalsContact O-CG2 3.31Å; Y106-V109 WeakPolarHBondContact O-CG2 3.36Å; R107-V109 VanDerWaalsContact C-N 3.29Å; R107-V109 PolarHBondContact O-N 2.79Å
110	G	93	Very high	94.8	Very high	47 Å²	47	64.5 Å²	64.5	49%	0.485	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.5	11.7	170.5	0	0	0	0	0	116.6	Y106 R107 E108	Y106-G110 PolarHBondContact O-N 2.92Å; R107-G110 PolarHBondContact O-N 2.84Å; E108-G110 VanDerWaalsContact C-N 3.3Å; E108-G110 PolarHBondContact O-N 3.24Å
111	A	95.1	Very high	94.7	Very high	7 Å²	7	58.9 Å²	58.9	6%	0.058	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-83	154.1	171.1	0	0	0	0	0	112.5	V79 V89 V91 Y106	V79-A111 HydrophobicContact CG1-CB 3.71Å; V89-A111 HydrophobicContact CB-CB 4.16Å; V89-A111 HydrophobicContact CG1-CB 4.17Å; V89-A111 WeakPolarHBondContact O-CA 3.34Å; V89-A111 WeakPolarHBondContact O-CB 3.34Å; V91-A111 HydrophobicContact CG2-CB 3.91Å; Y106-A111 WeakPolarHBondContact O-CB 3.43Å; Y106-A111 PolarHBondContact O-N 2.91Å
112	K	96.2	Very high	94.6	Very high	146 Å²	146	57.8 Å²	57.8	64%	0.635	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	134.2	171.1	-61.5	177.8	-178.6	175.1	0	110.1	V89 I90 V91	V89-K112 PolarHBondContact O-N 2.63Å; I90-K112 CarbonylContact C-O 3.56Å; I90-K112 VanDerWaalsContact CA-O 3.28Å; I90-K112 WeakPolarHBondContact CA-O 3.11Å; I90-K112 HydrophobicContact CG2-CB 4.21Å; V91-K112 PolarHBondContact N-O 3.13Å
113	I	97.1	Very high	94.6	Very high	36 Å²	36	57.3 Å²	57.3	19%	0.185	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	124.3	175.2	-53.8	-55.6	0	0	0	109.2	V91 D103 R107	V91-I113 HydrophobicContact CB-CD1 3.98Å; V91-I113 HydrophobicContact CG1-CD1 4.48Å; V91-I113 WeakPolarHBondContact O-CA 3.44Å; D103-I113 HydrophobicContact CB-CD1 4.23Å; D103-I113 HydrophobicContact CB-CG1 4.19Å; R107-I113 HydrophobicContact CG-CG1 3.84Å
114	Q	95.4	Very high	94.5	Very high	66 Å²	66	56.6 Å²	56.6	31%	0.308	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	173.6	-176.8	-78.1	-168.2	-25.8	0	0	112.3	I90 V91 E92 S93 E118 V119	I90-Q114 VanDerWaalsContact CD1-OE1 3.31Å; V91-Q114 PolarHBondContact O-N 3.05Å; E92-Q114 WeakPolarHBondContact CA-O 3.38Å; S93-Q114 PolarHBondContact N-O 2.85Å; S93-Q114 VanDerWaalsContact N-O 3.17Å; Q114-E118 HydrophobicContact CB-CB 4.3Å; Q114-E118 WeakPolarHBondContact CB-OE2 3.28Å; Q114-E118 WeakPolarHBondContact CG-OE2 3.28Å; Q114-E118 PolarHBondContact NE2-OE2 2.86Å; Q114-E118 PolarHBondContact OE1-OE2 3.06Å; Q114-V119 HydrophobicContact CB-CG2 4.05Å
115	G	91.9	Very high	94.6	Very high	40 Å²	40	52.3 Å²	52.3	41%	0.412	27%	0.274	S	S	.	.			trans	-80.5	159.3	177.1	0	0	0	0	0	113.3	K117 E118 V119	G115-K117 VanDerWaalsContact C-N 3.33Å; G115-K117 PolarHBondContact O-N 3.07Å; G115-E118 PolarHBondContact O-N 2.85Å; G115-E118 VanDerWaalsContact O-N 3.1Å; G115-V119 WeakPolarHBondContact O-CG2 3.31Å; G115-V119 PolarHBondContact O-N 2.98Å
116	T	90.9	Very high	94.8	Very high	39 Å²	39	48.5 Å²	48.5	24%	0.239	26%	0.256	C	S	.	.	H	α-helix	trans	-49.7	-45	-174.1	-42.1	0	0	0	0	114.2	E92 V119 L120 L137	E92-T116 WeakPolarHBondContact OE1-CB 3.23Å; E92-T116 WeakPolarHBondContact OE1-CG2 3.17Å; E92-T116 PolarHBondContact OE1-OG1 3.06Å; T116-V119 PolarHBondContact O-N 3.09Å; T116-L120 HydrophobicContact CG2-CD1 3.96Å; T116-L120 WeakPolarHBondContact O-CG 3.22Å; T116-L120 PolarHBondContact O-N 2.84Å; T116-L120 VanDerWaalsContact O-N 3.15Å; T116-L137 HydrophobicContact CG2-CD1 4.11Å
117	K	90.4	Very high	94.8	Very high	135 Å²	135	48.5 Å²	48.5	59%	0.587	26%	0.256	S	S	*	.	H	α-helix	trans	-67	-37.9	-177.6	-70.8	-174.7	179.8	179.9	0	112.9	G115 A121	G115-K117 VanDerWaalsContact C-N 3.33Å; G115-K117 PolarHBondContact O-N 3.07Å; K117-A121 WeakPolarHBondContact O-CB 3.39Å; K117-A121 PolarHBondContact O-N 2.79Å
118	E	92.5	Very high	94.8	Very high	110 Å²	110	42.7 Å²	42.7	51%	0.514	24%	0.235	S	C	.	.	H	α-helix	trans	-70.6	-40.3	-179.9	-62.8	178.1	178	0	0	110.5	Q114 G115 A121	Q114-E118 HydrophobicContact CB-CB 4.3Å; Q114-E118 WeakPolarHBondContact CB-OE2 3.28Å; Q114-E118 WeakPolarHBondContact CG-OE2 3.28Å; Q114-E118 PolarHBondContact NE2-OE2 2.86Å; Q114-E118 PolarHBondContact OE1-OE2 3.06Å; G115-E118 PolarHBondContact O-N 2.85Å; G115-E118 VanDerWaalsContact O-N 3.1Å; E118-A121 PolarHBondContact O-N 3.41Å
119	V	94.8	Very high	94.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.2	-44.9	180	176.6	0	0	0	0	112	V61 P62 I90 E92 Q114 G115 T116 A121 S122	V61-V119 VanDerWaalsContact C-CG1 3.47Å; P62-V119 HydrophobicContact CB-CG1 4.1Å; I90-V119 HydrophobicContact CD1-CG2 4.26Å; I90-V119 HydrophobicContact CG1-CG2 4.24Å; E92-V119 HydrophobicContact CB-CB 4.45Å; E92-V119 HydrophobicContact CB-CG1 4.4Å; E92-V119 HydrophobicContact CB-CG2 4.08Å; Q114-V119 HydrophobicContact CB-CG2 4.05Å; G115-V119 WeakPolarHBondContact O-CG2 3.31Å; G115-V119 PolarHBondContact O-N 2.98Å; T116-V119 PolarHBondContact O-N 3.09Å; V119-A121 PolarHBondContact O-N 3.46Å; V119-S122 WeakPolarHBondContact O-CB 3.48Å; V119-S122 PolarHBondContact O-N 2.83Å; V119-S122 PolarHBondContact O-OG 2.95Å
120	L	93.9	Very high	94.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-68.9	-19.2	177.1	-69	164.4	0	0	0	113	P62 T116 S122 V125 E141 L144 F145	P62-L120 HydrophobicContact CB-CD2 3.9Å; P62-L120 HydrophobicContact CB-CG 4.3Å; P62-L120 HydrophobicContact CG-CD2 4.01Å; T116-L120 HydrophobicContact CG2-CD1 3.96Å; T116-L120 WeakPolarHBondContact O-CG 3.22Å; T116-L120 PolarHBondContact O-N 2.84Å; T116-L120 VanDerWaalsContact O-N 3.15Å; L120-S122 VanDerWaalsContact C-N 3.26Å; L120-S122 PolarHBondContact O-N 2.85Å; L120-V125 HydrophobicContact CD2-CG1 4.33Å; L120-E141 HydrophobicContact CD1-CG 4.49Å; L120-L144 HydrophobicContact CB-CB 4.04Å; L120-L144 HydrophobicContact CD1-CB 4.22Å; L120-L144 HydrophobicContact CD1-CD1 3.63Å; L120-F145 HydrophobicContact CB-CD1 4.38Å; L120-F145 HydrophobicContact CB-CE1 4.46Å; L120-F145 HydrophobicContact CD2-CD1 4.46Å; L120-F145 HydrophobicContact CD2-CE1 3.73Å; L120-F145 WeakPolarHBondContact O-CD1 3.46Å
121	A	94.2	Very high	94.7	Very high	44 Å²	44	35.9 Å²	35.9	36%	0.364	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	15.2	176.8	0	0	0	0	0	114.1	K117 E118 V119	K117-A121 WeakPolarHBondContact O-CB 3.39Å; K117-A121 PolarHBondContact O-N 2.79Å; E118-A121 PolarHBondContact O-N 3.41Å; V119-A121 PolarHBondContact O-N 3.46Å
122	S	95.9	Very high	94.7	Very high	5 Å²	5	38.2 Å²	38.2	4%	0.035	20%	0.2	C	C	.	.	S	Bend	trans	-71.8	162.1	178	-62.6	0	0	0	0	113.5	G60 I90 V119 L120 L124	G60-S122 VanDerWaalsContact CA-OG 3.3Å; G60-S122 WeakPolarHBondContact CA-OG 3.47Å; G60-S122 PolarHBondContact N-OG 2.94Å; I90-S122 VanDerWaalsContact CD1-OG 3.31Å; I90-S122 WeakPolarHBondContact CD1-OG 3.44Å; V119-S122 WeakPolarHBondContact O-CB 3.48Å; V119-S122 PolarHBondContact O-N 2.83Å; V119-S122 PolarHBondContact O-OG 2.95Å; L120-S122 VanDerWaalsContact C-N 3.26Å; L120-S122 PolarHBondContact O-N 2.85Å; S122-L124 WeakPolarHBondContact CB-O 3.41Å
123	D	95.4	Very high	94.5	Very high	32 Å²	32	37.4 Å²	37.4	17%	0.171	19%	0.194	C	C	.	.	S	Bend	trans	-70	-38.9	174.8	-53.8	-60.2	0	0	0	111.6	L57 T58 K146 A149 T150	L57-D123 HydrophobicContact CD2-CB 3.8Å; T58-D123 PolarHBondContact N-OD2 3.09Å; T58-D123 PolarHBondContact O-N 3.1Å; D123-K146 IonicContact OD1-NZ 2.87Å; D123-K146 PolarHBondContact OD1-NZ 2.83Å; D123-A149 WeakPolarHBondContact O-CA 3.47Å; D123-T150 PolarHBondContact O-N 3.28Å
124	L	96.1	Very high	94.2	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.9	170.2	-78.1	77.2	0	0	0	108.8	L57 T58 V59 G60 F87 S122 T150 L396 F406	L57-L124 HydrophobicContact CB-CD1 4.3Å; L57-L124 HydrophobicContact CD1-CD1 4.35Å; L57-L124 HydrophobicContact CD2-CD1 4.14Å; T58-L124 PolarHBondContact O-N 3.41Å; V59-L124 CarbonylContact C-O 3.39Å; V59-L124 WeakPolarHBondContact CA-O 3.23Å; V59-L124 HydrophobicContact CG2-CB 4.14Å; V59-L124 HydrophobicContact CG2-CD2 4.38Å; G60-L124 PolarHBondContact N-O 3.21Å; F87-L124 HydrophobicContact CE1-CD1 4.37Å; F87-L124 HydrophobicContact CE1-CD2 4.12Å; F87-L124 HydrophobicContact CZ-CD2 4.44Å; S122-L124 WeakPolarHBondContact CB-O 3.41Å; L124-T150 CarbonylContact C-O 3.41Å; L124-T150 WeakPolarHBondContact CA-O 3.26Å; L124-L396 HydrophobicContact CD2-CD2 4.31Å; L124-F406 HydrophobicContact CD1-CE1 4.29Å; L124-F406 HydrophobicContact CD2-CE1 4.01Å; L124-F406 HydrophobicContact CD2-CZ 4.04Å
125	V	97.4	Very high	93.9	Very high	1 Å²	1	38 Å²	38	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	121.8	173.1	-179.9	0	0	0	0	108.3	P62 L120 K127 F145 T150 L151 I152	P62-V125 HydrophobicContact CG-CG1 4.23Å; L120-V125 HydrophobicContact CD2-CG1 4.33Å; V125-K127 HydrophobicContact CG1-CD 4.37Å; V125-K127 HydrophobicContact CG1-CG 4.19Å; V125-F145 HydrophobicContact CB-CE1 4.35Å; V125-F145 HydrophobicContact CG1-CE1 3.98Å; V125-F145 HydrophobicContact CG1-CZ 4.32Å; V125-F145 HydrophobicContact CG2-CD1 4.27Å; V125-F145 HydrophobicContact CG2-CE1 4.14Å; V125-T150 PolarHBondContact N-O 2.88Å; V125-L151 HydrophobicContact CB-CD1 4.32Å; V125-L151 HydrophobicContact CG1-CD1 4.22Å; V125-L151 WeakPolarHBondContact O-CA 3.38Å; V125-I152 PolarHBondContact O-N 2.92Å
126	V	97.3	Very high	93.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	110.4	-177.4	-169.2	0	0	0	0	108.6	V59 G60 P62 A73 L74 I152 I392	V59-V126 HydrophobicContact CG1-CG2 3.56Å; G60-V126 PolarHBondContact O-N 3.02Å; P62-V126 WeakPolarHBondContact CD-O 3.32Å; A73-V126 HydrophobicContact CB-CB 4.37Å; A73-V126 HydrophobicContact CB-CG1 3.86Å; A73-V126 WeakPolarHBondContact CB-O 3.49Å; L74-V126 HydrophobicContact CG-CG1 4.47Å; V126-I152 HydrophobicContact CG1-CB 4.43Å; V126-I152 HydrophobicContact CG2-CD1 4.44Å; V126-I392 HydrophobicContact CG1-CD1 3.43Å; V126-I392 VanDerWaalsContact CG1-CD1 3.43Å; V126-I392 HydrophobicContact CG1-CG1 4.24Å; V126-I392 HydrophobicContact CG1-CG2 3.92Å
127	K	97.6	Very high	93.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.226	C	C	.	.			trans	-116.5	160.6	179.5	-77.6	-180	64	67.2	0	111	P62 E64 V125 R129 P131 E141 L151 I152 Y388	P62-K127 HydrophobicContact CG-CD 3.96Å; P62-K127 HydrophobicContact CG-CG 3.45Å; P62-K127 VanDerWaalsContact CG-CG 3.45Å; E64-K127 IonicContact OE1-NZ 3.44Å; E64-K127 PolarHBondContact OE1-NZ 3.39Å; E64-K127 IonicContact OE2-NZ 3.21Å; E64-K127 PolarHBondContact OE2-NZ 3.17Å; V125-K127 HydrophobicContact CG1-CD 4.37Å; V125-K127 HydrophobicContact CG1-CG 4.19Å; K127-R129 WeakPolarHBondContact CB-O 3.42Å; K127-R129 VanDerWaalsContact CE-O 3.31Å; K127-R129 WeakPolarHBondContact CE-O 3.39Å; K127-P131 HydrophobicContact CD-CG 4.37Å; K127-E141 WeakPolarHBondContact CE-OE2 3.45Å; K127-E141 IonicContact NZ-OE1 2.77Å; K127-E141 PolarHBondContact NZ-OE1 3.42Å; K127-E141 IonicContact NZ-OE2 2.73Å; K127-E141 PolarHBondContact NZ-OE2 3.42Å; K127-L151 HydrophobicContact CD-CD1 4.48Å; K127-I152 PolarHBondContact N-O 3.05Å; K127-Y388 WeakPolarHBondContact O-CE1 3.23Å; K127-Y388 PolarHBondContact O-OH 3.42Å
128	V	95.1	Very high	93.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.218	C	C	.	.	S	Bend	trans	-79.2	-56.6	167.7	-176.7	0	0	0	0	108.4	E64 R71 A73 F154 Y388	E64-V128 HydrophobicContact CG-CB 4.29Å; E64-V128 HydrophobicContact CG-CG2 4.42Å; E64-V128 PolarHBondContact OE1-N 3.14Å; R71-V128 HydrophobicContact CB-CG1 4.41Å; R71-V128 HydrophobicContact CB-CG2 4.16Å; A73-V128 HydrophobicContact CB-CG2 4.09Å; V128-F154 VanDerWaalsContact O-CD2 3.22Å; V128-F154 WeakPolarHBondContact O-CD2 3.4Å; V128-F154 PolarHBondContact O-N 2.8Å; V128-Y388 HydrophobicContact CB-CE1 4.24Å; V128-Y388 HydrophobicContact CG1-CE1 4.42Å; V128-Y388 HydrophobicContact CG2-CD1 4.13Å; V128-Y388 HydrophobicContact CG2-CE1 4.02Å
129	R	93.4	Very high	93.6	Very high	65 Å²	65	34.3 Å²	34.3	25%	0.245	21%	0.209	C	C	.	.	S	Bend	trans	-105.6	168.9	-177.2	-60.9	-165.1	73.5	160.5	7.2	112	E64 E69 K127 E349	E64-R129 PolarHBondContact OE1-N 3.4Å; E69-R129 WeakPolarHBondContact OE2-CD 3.4Å; K127-R129 WeakPolarHBondContact CB-O 3.42Å; K127-R129 VanDerWaalsContact CE-O 3.31Å; K127-R129 WeakPolarHBondContact CE-O 3.39Å; R129-E349 IonicContact NH2-OE1 3.47Å
130	A	94.1	Very high	93.5	Very high	21 Å²	21	35.6 Å²	35.6	17%	0.174	22%	0.215	C	C	.	.			trans	-60.9	148	176.1	0	0	0	0	0	111.2	F154 L163	A130-F154 WeakPolarHBondContact CA-O 3.12Å; A130-F154 WeakPolarHBondContact CB-O 3.45Å; A130-F154 PolarHBondContact N-O 2.92Å; A130-L163 HydrophobicContact CB-CD2 3.58Å
131	P	94.7	Very high	93.5	Very high	4 Å²	4	35.7 Å²	35.7	3%	0.026	22%	0.215	C	C	.	.			trans	-61.7	137.8	175.7	-21.7	32.6	0	0	0	112.5	K127 H140 E141 F145 L151 L163	K127-P131 HydrophobicContact CD-CG 4.37Å; P131-H140 PolarHBondContact O-CE1 3.27Å; P131-E141 WeakPolarHBondContact CA-OE2 3.37Å; P131-E141 HydrophobicContact CB-CB 3.83Å; P131-F145 HydrophobicContact CB-CZ 4.29Å; P131-F145 HydrophobicContact CG-CE2 3.95Å; P131-F145 HydrophobicContact CG-CZ 3.72Å; P131-L151 HydrophobicContact CG-CD1 4.41Å; P131-L151 HydrophobicContact CG-CD2 3.76Å; P131-L163 HydrophobicContact CB-CD1 4.48Å
132	I	93.9	Very high	93.4	Very high	56 Å²	56	33.6 Å²	33.6	29%	0.287	20%	0.198	S	C	.	.			trans	-126.4	177.9	-179	68.9	175	0	0	0	112.8	I65 F66 N134 E141	I65-I132 HydrophobicContact CD1-CD1 4Å; I65-I132 HydrophobicContact CD1-CG1 3.46Å; I65-I132 VanDerWaalsContact CD1-CG1 3.46Å; I65-I132 HydrophobicContact CG1-CD1 3.85Å; I65-I132 HydrophobicContact CG1-CG1 3.69Å; F66-I132 HydrophobicContact CB-CD1 4.28Å; F66-I132 HydrophobicContact CD2-CD1 4.27Å; I132-N134 PolarHBondContact O-N 3.09Å; I132-E141 PolarHBondContact N-OE2 3.12Å; I132-E141 WeakPolarHBondContact O-CG 3.3Å; I132-E141 PolarHBondContact O-N 3.16Å
133	Y	93	Very high	93.2	Very high	130 Å²	130	36.2 Å²	36.2	51%	0.51	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	124.5	170.5	-175.1	-103.6	0	0	0	110.7	P135 G138 H140	Y133-P135 VanDerWaalsContact O-CD 3.24Å; Y133-P135 WeakPolarHBondContact O-CD 3.41Å; Y133-G138 WeakPolarHBondContact OH-CA 3.42Å; Y133-G138 PolarHBondContact OH-O 2.98Å; Y133-G138 VanDerWaalsContact OH-O 3.09Å; Y133-H140 PolarHBondContact N-CD2 3.12Å
134	N	91.1	Very high	93.1	Very high	8 Å²	8	36.5 Å²	36.5	4%	0.043	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	105.1	179	-171.8	-27.4	0	0	0	110.4	I65 I132 A136 L137 G138 V139 E141	I65-N134 HydrophobicContact CD1-CB 3.64Å; I132-N134 PolarHBondContact O-N 3.09Å; N134-A136 PolarHBondContact O-N 3.4Å; N134-A136 WeakPolarHBondContact OD1-CB 3.44Å; N134-A136 PolarHBondContact OD1-N 3.21Å; N134-L137 HydrophobicContact CB-CB 4.39Å; N134-L137 PolarHBondContact O-N 3.37Å; N134-L137 PolarHBondContact OD1-N 3.45Å; N134-G138 PolarHBondContact O-N 3.42Å; N134-V139 WeakPolarHBondContact CB-O 3.44Å; N134-V139 PolarHBondContact N-O 3.44Å; N134-E141 HydrophobicContact CB-CG 4.39Å
135	P	87.6	Confident	93	Very high	106 Å²	106	36.9 Å²	36.9	69%	0.688	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-25.1	-178.8	27.6	-34.9	0	0	0	113	Y133	Y133-P135 VanDerWaalsContact O-CD 3.24Å; Y133-P135 WeakPolarHBondContact O-CD 3.41Å
136	A	87.9	Confident	92.7	Very high	91 Å²	91	42 Å²	42	75%	0.752	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-29.5	179.7	0	0	0	0	0	112.8	N134	N134-A136 PolarHBondContact O-N 3.4Å; N134-A136 WeakPolarHBondContact OD1-CB 3.44Å; N134-A136 PolarHBondContact OD1-N 3.21Å
137	L	88.9	Confident	92.4	Very high	63 Å²	63	46.5 Å²	46.5	33%	0.33	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-9.8	179.2	-62.6	179.6	0	0	0	113.4	T116 N134 V139 L144	T116-L137 HydrophobicContact CG2-CD1 4.11Å; N134-L137 HydrophobicContact CB-CB 4.39Å; N134-L137 PolarHBondContact O-N 3.37Å; N134-L137 PolarHBondContact OD1-N 3.45Å; L137-V139 HydrophobicContact CB-CG2 3.87Å; L137-V139 PolarHBondContact O-N 3.37Å; L137-L144 HydrophobicContact CD1-CD1 3.9Å
138	G	90.4	Very high	92	Very high	42 Å²	42	49.2 Å²	49.2	43%	0.433	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	10.3	-179.1	0	0	0	0	0	114.7	Y133 N134	Y133-G138 WeakPolarHBondContact OH-CA 3.42Å; Y133-G138 PolarHBondContact OH-O 2.98Å; Y133-G138 VanDerWaalsContact OH-O 3.09Å; N134-G138 PolarHBondContact O-N 3.42Å
139	V	93	Very high	91.9	Very high	51 Å²	51	49.3 Å²	49.3	31%	0.309	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	157.5	-175	-63.9	0	0	0	0	111	N134 L137 L144	N134-V139 WeakPolarHBondContact CB-O 3.44Å; N134-V139 PolarHBondContact N-O 3.44Å; L137-V139 HydrophobicContact CB-CG2 3.87Å; L137-V139 PolarHBondContact O-N 3.37Å; V139-L144 HydrophobicContact CG2-CD1 4.01Å; V139-L144 HydrophobicContact CG2-CD2 4.06Å; V139-L144 HydrophobicContact CG2-CG 4.06Å
140	H	93.6	Very high	92	Very high	27 Å²	27	47.1 Å²	47.1	13%	0.125	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	139.8	172.7	-162.6	-85.3	0	0	0	110.2	P131 Y133 A142 D143	P131-H140 PolarHBondContact O-CE1 3.27Å; Y133-H140 PolarHBondContact N-CD2 3.12Å; H140-A142 VanDerWaalsContact ND1-CB 3.34Å; H140-A142 WeakPolarHBondContact ND1-CB 3.29Å; H140-A142 PolarHBondContact ND1-N 3.26Å; H140-A142 PolarHBondContact O-N 3.38Å; H140-D143 WeakPolarHBondContact CB-OD2 3.27Å; H140-D143 PolarHBondContact N-OD2 3.18Å; H140-D143 WeakPolarHBondContact O-CB 3.33Å; H140-D143 PolarHBondContact O-N 2.9Å
141	E	93.3	Very high	92.2	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.009	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-57.4	-36.5	-178.8	-75.8	-178.2	137.4	0	0	112.3	I65 L120 K127 P131 I132 N134 D143 L144	I65-E141 HydrophobicContact CD1-CG 4.01Å; L120-E141 HydrophobicContact CD1-CG 4.49Å; K127-E141 WeakPolarHBondContact CE-OE2 3.45Å; K127-E141 IonicContact NZ-OE1 2.77Å; K127-E141 PolarHBondContact NZ-OE1 3.42Å; K127-E141 IonicContact NZ-OE2 2.73Å; K127-E141 PolarHBondContact NZ-OE2 3.42Å; P131-E141 WeakPolarHBondContact CA-OE2 3.37Å; P131-E141 HydrophobicContact CB-CB 3.83Å; I132-E141 PolarHBondContact N-OE2 3.12Å; I132-E141 WeakPolarHBondContact O-CG 3.3Å; I132-E141 PolarHBondContact O-N 3.16Å; N134-E141 HydrophobicContact CB-CG 4.39Å; E141-D143 PolarHBondContact O-N 3.18Å; E141-L144 WeakPolarHBondContact O-CB 3.49Å; E141-L144 PolarHBondContact O-N 3.02Å; E141-L144 VanDerWaalsContact O-N 3.08Å
142	A	92	Very high	92.3	Very high	0 Å²	0	46 Å²	46	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-58	-27.9	174.8	0	0	0	0	0	113.6	H140 L144 F145 K166 L167	H140-A142 VanDerWaalsContact ND1-CB 3.34Å; H140-A142 WeakPolarHBondContact ND1-CB 3.29Å; H140-A142 PolarHBondContact ND1-N 3.26Å; H140-A142 PolarHBondContact O-N 3.38Å; A142-L144 PolarHBondContact O-N 3.21Å; A142-F145 PolarHBondContact O-N 3.04Å; A142-K166 HydrophobicContact CB-CB 4.48Å; A142-L167 HydrophobicContact CB-CD2 3.92Å
143	D	91.3	Very high	92.5	Very high	60 Å²	60	43.3 Å²	43.3	32%	0.321	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-72.5	-21.5	-179.9	-61.1	-36.1	0	0	0	112.3	H140 E141 K170	H140-D143 WeakPolarHBondContact CB-OD2 3.27Å; H140-D143 PolarHBondContact N-OD2 3.18Å; H140-D143 WeakPolarHBondContact O-CB 3.33Å; H140-D143 PolarHBondContact O-N 2.9Å; E141-D143 PolarHBondContact O-N 3.18Å; D143-K170 WeakPolarHBondContact O-CE 3.42Å; D143-K170 PolarHBondContact O-NZ 3.29Å
144	L	92.7	Very high	92.5	Very high	38 Å²	38	37.8 Å²	37.8	20%	0.199	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-86.5	-7.1	-179	-61.7	175	0	0	0	113.1	L120 L137 V139 E141 A142	L120-L144 HydrophobicContact CB-CB 4.04Å; L120-L144 HydrophobicContact CD1-CB 4.22Å; L120-L144 HydrophobicContact CD1-CD1 3.63Å; L137-L144 HydrophobicContact CD1-CD1 3.9Å; V139-L144 HydrophobicContact CG2-CD1 4.01Å; V139-L144 HydrophobicContact CG2-CD2 4.06Å; V139-L144 HydrophobicContact CG2-CG 4.06Å; E141-L144 WeakPolarHBondContact O-CB 3.49Å; E141-L144 PolarHBondContact O-N 3.02Å; E141-L144 VanDerWaalsContact O-N 3.08Å; A142-L144 PolarHBondContact O-N 3.21Å
145	F	93.9	Very high	92.7	Very high	10 Å²	10	37.4 Å²	37.4	4%	0.044	24%	0.235	C	C	.	.	S	Bend	trans	-70.8	143.7	177.2	-65.2	-15.8	0	0	0	112.1	L120 V125 P131 A142 A149 L151 L167 T172	L120-F145 HydrophobicContact CB-CD1 4.38Å; L120-F145 HydrophobicContact CB-CE1 4.46Å; L120-F145 HydrophobicContact CD2-CD1 4.46Å; L120-F145 HydrophobicContact CD2-CE1 3.73Å; L120-F145 WeakPolarHBondContact O-CD1 3.46Å; V125-F145 HydrophobicContact CB-CE1 4.35Å; V125-F145 HydrophobicContact CG1-CE1 3.98Å; V125-F145 HydrophobicContact CG1-CZ 4.32Å; V125-F145 HydrophobicContact CG2-CD1 4.27Å; V125-F145 HydrophobicContact CG2-CE1 4.14Å; P131-F145 HydrophobicContact CB-CZ 4.29Å; P131-F145 HydrophobicContact CG-CE2 3.95Å; P131-F145 HydrophobicContact CG-CZ 3.72Å; A142-F145 PolarHBondContact O-N 3.04Å; F145-A149 HydrophobicContact CB-CB 4.49Å; F145-L151 HydrophobicContact CE2-CD1 4.39Å; F145-L151 HydrophobicContact CE2-CD2 4.16Å; F145-L151 HydrophobicContact CZ-CD1 4.08Å; F145-L167 HydrophobicContact CD2-CD2 3.85Å; F145-L167 HydrophobicContact CE2-CD2 3.61Å; F145-T172 HydrophobicContact CB-CG2 4.44Å; F145-T172 HydrophobicContact CD2-CG2 4.18Å
146	K	92.1	Very high	92.8	Very high	107 Å²	107	36.4 Å²	36.4	47%	0.465	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-66.5	147.1	168.5	-176.2	-178.7	171.7	-172.2	0	109.8	D123 A148 A149	D123-K146 IonicContact OD1-NZ 2.87Å; D123-K146 PolarHBondContact OD1-NZ 2.83Å; K146-A148 PolarHBondContact O-N 3.45Å; K146-A149 HydrophobicContact CB-CB 4.45Å; K146-A149 VanDerWaalsContact O-CB 3.26Å; K146-A149 WeakPolarHBondContact O-CB 3.29Å; K146-A149 PolarHBondContact O-N 3.44Å; K146-A149 VanDerWaalsContact O-N 3.11Å
147	T	90.8	Very high	92.9	Very high	96 Å²	96	32.3 Å²	32.3	59%	0.589	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	132.7	172.4	-50.3	0	0	0	0	110	A149 K171	T147-A149 VanDerWaalsContact C-N 3.29Å; T147-A149 PolarHBondContact O-N 2.99Å; T147-K171 HydrophobicContact CG2-CB 4.45Å
148	A	88.9	Confident	92.9	Very high	56 Å²	56	32.6 Å²	32.6	46%	0.463	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	23.9	-176	0	0	0	0	0	115.5	K146 K170 K171	K146-A148 PolarHBondContact O-N 3.45Å; A148-K170 PolarHBondContact N-O 2.94Å; A148-K171 WeakPolarHBondContact CA-O 2.96Å
149	A	93.6	Very high	92.7	Very high	3 Å²	3	35.3 Å²	35.3	3%	0.025	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-65.7	152.3	169	0	0	0	0	0	111.9	D123 F145 K146 T147 T172 T173	D123-A149 WeakPolarHBondContact O-CA 3.47Å; F145-A149 HydrophobicContact CB-CB 4.49Å; K146-A149 HydrophobicContact CB-CB 4.45Å; K146-A149 VanDerWaalsContact O-CB 3.26Å; K146-A149 WeakPolarHBondContact O-CB 3.29Å; K146-A149 PolarHBondContact O-N 3.44Å; K146-A149 VanDerWaalsContact O-N 3.11Å; T147-A149 VanDerWaalsContact C-N 3.29Å; T147-A149 PolarHBondContact O-N 2.99Å; A149-T172 HydrophobicContact CB-CG2 4.44Å; A149-T172 VanDerWaalsContact O-CA 3.31Å; A149-T172 WeakPolarHBondContact O-CA 3.35Å; A149-T172 WeakPolarHBondContact O-CB 3.31Å; A149-T173 PolarHBondContact O-N 2.78Å
150	T	96.3	Very high	92.5	Very high	18 Å²	18	35.9 Å²	35.9	11%	0.11	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	120.8	174.1	-59.8	0	0	0	0	110.4	D123 L124 V125 T173 L175	D123-T150 PolarHBondContact O-N 3.28Å; L124-T150 CarbonylContact C-O 3.41Å; L124-T150 WeakPolarHBondContact CA-O 3.26Å; V125-T150 PolarHBondContact N-O 2.88Å; T150-T173 CarbonylContact C-O 3.58Å; T150-T173 VanDerWaalsContact CA-O 3.23Å; T150-T173 WeakPolarHBondContact CA-O 3.22Å; T150-L175 HydrophobicContact CG2-CD1 3.8Å
151	L	97.3	Very high	92.4	Very high	2 Å²	2	38 Å²	38	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	132.3	176.9	175.6	65.2	0	0	0	110.7	V125 K127 P131 F145 I155 L167 T173 V174 L175	V125-L151 HydrophobicContact CB-CD1 4.32Å; V125-L151 HydrophobicContact CG1-CD1 4.22Å; V125-L151 WeakPolarHBondContact O-CA 3.38Å; K127-L151 HydrophobicContact CD-CD1 4.48Å; P131-L151 HydrophobicContact CG-CD1 4.41Å; P131-L151 HydrophobicContact CG-CD2 3.76Å; F145-L151 HydrophobicContact CE2-CD1 4.39Å; F145-L151 HydrophobicContact CE2-CD2 4.16Å; F145-L151 HydrophobicContact CZ-CD1 4.08Å; L151-I155 HydrophobicContact CD2-CD1 3.82Å; L151-L167 HydrophobicContact CD2-CD1 4.07Å; L151-L167 HydrophobicContact CD2-CD2 4.25Å; L151-T173 PolarHBondContact N-O 3.05Å; L151-V174 HydrophobicContact CB-CG1 4.47Å; L151-V174 HydrophobicContact CB-CG2 4.42Å; L151-V174 HydrophobicContact CD2-CG1 4.25Å; L151-L175 PolarHBondContact O-N 3.03Å
152	I	97.5	Very high	92.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	114.7	169.2	-51.9	178.7	0	0	0	108.1	V125 V126 K127 L175 M177 I392 L396	V125-I152 PolarHBondContact O-N 2.92Å; V126-I152 HydrophobicContact CG1-CB 4.43Å; V126-I152 HydrophobicContact CG2-CD1 4.44Å; K127-I152 PolarHBondContact N-O 3.05Å; I152-L175 HydrophobicContact CG1-CB 4.25Å; I152-M177 HydrophobicContact CG2-CG 3.92Å; I152-M177 HydrophobicContact CG2-SD 3.7Å; I152-I392 HydrophobicContact CD1-CG2 4.45Å; I152-I392 HydrophobicContact CG2-CG1 4.27Å; I152-L396 HydrophobicContact CD1-CD1 4.3Å; I152-L396 HydrophobicContact CD1-CD2 3.64Å; I152-L396 HydrophobicContact CD1-CG 4.15Å
153	S	96.6	Very high	92.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	175.7	177.6	63.1	0	0	0	0	111.9	I155 L175 A176 M177	S153-I155 WeakPolarHBondContact OG-CD1 3.28Å; S153-L175 PolarHBondContact N-O 2.97Å; S153-A176 WeakPolarHBondContact O-CA 3.44Å; S153-M177 PolarHBondContact O-N 3.44Å
154	F	94.8	Very high	92.4	Very high	13 Å²	13	42.1 Å²	42.1	6%	0.057	24%	0.236	C	C	.	.			trans	-72	124.5	158.7	-71.7	-61.9	0	0	0	110.4	V128 A130 Y156 M177 D178 A191 L192 M195 Y388	V128-F154 VanDerWaalsContact O-CD2 3.22Å; V128-F154 WeakPolarHBondContact O-CD2 3.4Å; V128-F154 PolarHBondContact O-N 2.8Å; A130-F154 WeakPolarHBondContact CA-O 3.12Å; A130-F154 WeakPolarHBondContact CB-O 3.45Å; A130-F154 PolarHBondContact N-O 2.92Å; F154-Y156 HydrophobicContact CB-CD2 4.4Å; F154-Y156 HydrophobicContact CB-CE2 3.91Å; F154-Y156 HydrophobicContact CG-CE2 4.41Å; F154-M177 HydrophobicContact CD1-CB 3.98Å; F154-M177 HydrophobicContact CE1-CB 3.95Å; F154-D178 HydrophobicContact CD1-CB 3.85Å; F154-D178 HydrophobicContact CE1-CB 4.35Å; F154-A191 HydrophobicContact CE1-CB 3.87Å; F154-A191 HydrophobicContact CE2-CB 4.42Å; F154-A191 HydrophobicContact CZ-CB 3.48Å; F154-A191 VanDerWaalsContact CZ-CB 3.48Å; F154-L192 HydrophobicContact CD1-CD2 4.4Å; F154-L192 HydrophobicContact CE1-CD2 3.63Å; F154-L192 HydrophobicContact CE1-CG 4.16Å; F154-L192 HydrophobicContact CZ-CD2 4.2Å; F154-M195 HydrophobicContact CE2-CG 4.43Å; F154-M195 HydrophobicContact CZ-CG 4.36Å; F154-Y388 HydrophobicContact CD2-CE2 4.32Å; F154-Y388 HydrophobicContact CE2-CD2 4.26Å; F154-Y388 AromaticContact CE2-CE2 3.74Å; F154-Y388 HydrophobicContact CE2-CE2 3.74Å; F154-Y388 HydrophobicContact CZ-CE2 4.11Å
155	I	94	Very high	92.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.25	C	S	.	.			trans	-114.1	-41.5	-174.9	-63.1	-67.2	0	0	0	112.1	L151 S153 P157 N160 L163 L164 V174 A176 D178	L151-I155 HydrophobicContact CD2-CD1 3.82Å; S153-I155 WeakPolarHBondContact OG-CD1 3.28Å; I155-P157 HydrophobicContact CG2-CB 4.23Å; I155-N160 PolarHBondContact O-ND2 2.9Å; I155-L163 HydrophobicContact CD1-CD2 4.49Å; I155-L164 HydrophobicContact CG2-CD2 4.05Å; I155-V174 HydrophobicContact CD1-CG1 3.69Å; I155-V174 HydrophobicContact CG1-CG1 3.67Å; I155-A176 HydrophobicContact CB-CB 3.98Å; I155-A176 HydrophobicContact CG1-CB 4.03Å; I155-D178 PolarHBondContact N-OD1 3.43Å
156	Y	90.3	Very high	92.3	Very high	86 Å²	86	47.8 Å²	47.8	34%	0.337	26%	0.263	S	S	.	.			trans	51.4	62.9	-172.6	-59.9	-73.8	0	0	0	111.8	F154 A158 Q159 N160 D178	F154-Y156 HydrophobicContact CB-CD2 4.4Å; F154-Y156 HydrophobicContact CB-CE2 3.91Å; F154-Y156 HydrophobicContact CG-CE2 4.41Å; Y156-A158 VanDerWaalsContact C-N 3.26Å; Y156-A158 PolarHBondContact O-N 3.45Å; Y156-Q159 PolarHBondContact O-N 3.22Å; Y156-Q159 PolarHBondContact O-OE1 3.43Å; Y156-N160 PolarHBondContact O-N 3.49Å; Y156-N160 PolarHBondContact O-ND2 2.88Å; Y156-N160 VanDerWaalsContact O-ND2 3.16Å; Y156-D178 VanDerWaalsContact CA-OD2 3.29Å; Y156-D178 WeakPolarHBondContact CA-OD2 3.38Å; Y156-D178 HydrophobicContact CD1-CB 4.06Å; Y156-D178 HydrophobicContact CE1-CB 3.81Å; Y156-D178 PolarHBondContact N-OD1 3.3Å; Y156-D178 PolarHBondContact N-OD2 3.05Å
157	P	90.5	Very high	92.4	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.032	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-29.3	-167.9	25.7	-36.5	0	0	0	113.8	I155 Q159 L164 D178 Q179 V428 F436	I155-P157 HydrophobicContact CG2-CB 4.23Å; P157-Q159 VanDerWaalsContact C-N 3.27Å; P157-Q159 PolarHBondContact O-N 3.04Å; P157-L164 HydrophobicContact CB-CD1 3.83Å; P157-L164 HydrophobicContact CB-CD2 4.38Å; P157-D178 VanDerWaalsContact CD-OD2 3.31Å; P157-D178 WeakPolarHBondContact CD-OD2 3.49Å; P157-Q179 HydrophobicContact CG-CG 4.02Å; P157-V428 HydrophobicContact CG-CG1 4.07Å; P157-F436 HydrophobicContact CB-CD1 4.04Å; P157-F436 HydrophobicContact CB-CD2 4.17Å; P157-F436 HydrophobicContact CB-CE1 4.28Å; P157-F436 HydrophobicContact CB-CE2 4.41Å; P157-F436 HydrophobicContact CB-CG 3.99Å; P157-F436 HydrophobicContact CB-CZ 4.47Å; P157-F436 HydrophobicContact CG-CD1 4.26Å; P157-F436 HydrophobicContact CG-CD2 3.59Å; P157-F436 HydrophobicContact CG-CE1 4.26Å; P157-F436 HydrophobicContact CG-CE2 3.61Å; P157-F436 HydrophobicContact CG-CG 3.95Å; P157-F436 HydrophobicContact CG-CZ 3.96Å
158	A	88.4	Confident	92.5	Very high	68 Å²	68	39.5 Å²	39.5	56%	0.562	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-27.5	177.1	0	0	0	0	0	112.9	Y156 F436	Y156-A158 VanDerWaalsContact C-N 3.26Å; Y156-A158 PolarHBondContact O-N 3.45Å; A158-F436 HydrophobicContact CB-CE1 4.21Å; A158-F436 HydrophobicContact CB-CZ 4.01Å
159	Q	86	Confident	92.7	Very high	99 Å²	99	43.8 Å²	43.8	46%	0.463	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-21.9	-177.5	-66.6	77.3	12	0	0	112.7	Y156 P157 P161	Y156-Q159 PolarHBondContact O-N 3.22Å; Y156-Q159 PolarHBondContact O-OE1 3.43Å; P157-Q159 VanDerWaalsContact C-N 3.27Å; P157-Q159 PolarHBondContact O-N 3.04Å; Q159-P161 VanDerWaalsContact C-CD 3.41Å; Q159-P161 VanDerWaalsContact O-CD 3.29Å; Q159-P161 WeakPolarHBondContact O-CD 3.44Å
160	N	89.2	Confident	92.5	Very high	63 Å²	63	46.5 Å²	46.5	34%	0.337	25%	0.246	S	C	.	.			trans	-122.1	62.7	-170.2	-61.3	-62.7	0	0	0	113.2	I155 Y156 D162 L163 L164	I155-N160 PolarHBondContact O-ND2 2.9Å; Y156-N160 PolarHBondContact O-N 3.49Å; Y156-N160 PolarHBondContact O-ND2 2.88Å; Y156-N160 VanDerWaalsContact O-ND2 3.16Å; N160-D162 VanDerWaalsContact C-N 3.34Å; N160-D162 PolarHBondContact O-N 3.49Å; N160-L163 HydrophobicContact CB-CB 4.07Å; N160-L163 HydrophobicContact CB-CD2 4.49Å; N160-L163 PolarHBondContact O-N 2.91Å; N160-L164 PolarHBondContact O-N 3.23Å
161	P	90.3	Very high	92.4	Very high	71 Å²	71	51.9 Å²	51.9	46%	0.461	27%	0.268	S	S	.	.	H	α-helix	trans	-64.2	-35.9	-179.8	26.7	-34.3	0	0	0	112.9	Q159 L163 L164 N165	Q159-P161 VanDerWaalsContact C-CD 3.41Å; Q159-P161 VanDerWaalsContact O-CD 3.29Å; Q159-P161 WeakPolarHBondContact O-CD 3.44Å; P161-L163 VanDerWaalsContact C-N 3.32Å; P161-L163 PolarHBondContact O-N 2.86Å; P161-L164 PolarHBondContact O-N 2.83Å; P161-N165 PolarHBondContact O-N 3.3Å; P161-N165 PolarHBondContact O-ND2 3.38Å
162	D	91.8	Very high	92.2	Very high	123 Å²	123	51.9 Å²	51.9	66%	0.658	27%	0.268	S	S	*	.	H	α-helix	trans	-65.2	-35.8	-179.8	-65	-30.7	0	0	0	112.5	N160 N165 K166	N160-D162 VanDerWaalsContact C-N 3.34Å; N160-D162 PolarHBondContact O-N 3.49Å; D162-N165 PolarHBondContact O-N 3.03Å; D162-K166 PolarHBondContact O-N 2.89Å; D162-K166 VanDerWaalsContact O-N 3.12Å
163	L	93.3	Very high	92.1	Very high	16 Å²	16	52.4 Å²	52.4	8%	0.084	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-42.3	175.1	177.4	64.1	0	0	0	111.1	A130 P131 I155 N160 P161 N165 K166 L167	A130-L163 HydrophobicContact CB-CD2 3.58Å; P131-L163 HydrophobicContact CB-CD1 4.48Å; I155-L163 HydrophobicContact CD1-CD2 4.49Å; N160-L163 HydrophobicContact CB-CB 4.07Å; N160-L163 HydrophobicContact CB-CD2 4.49Å; N160-L163 PolarHBondContact O-N 2.91Å; P161-L163 VanDerWaalsContact C-N 3.32Å; P161-L163 PolarHBondContact O-N 2.86Å; L163-N165 VanDerWaalsContact C-N 3.31Å; L163-N165 PolarHBondContact O-N 2.92Å; L163-K166 PolarHBondContact O-N 3.31Å; L163-L167 HydrophobicContact CD1-CD1 4.08Å; L163-L167 HydrophobicContact CD1-CG 4.25Å; L163-L167 HydrophobicContact CG-CD1 3.9Å; L163-L167 HydrophobicContact CG-CG 4.47Å; L163-L167 WeakPolarHBondContact O-CG 3.32Å; L163-L167 PolarHBondContact O-N 2.88Å
164	L	93.4	Very high	92.1	Very high	11 Å²	11	52.4 Å²	52.4	6%	0.058	27%	0.271	C	S	.	.	H	α-helix	trans	-62.1	-40.1	176.4	-64.3	178.9	0	0	0	111.1	I155 P157 N160 P161 K166 L167 A168 M429 V434	I155-L164 HydrophobicContact CG2-CD2 4.05Å; P157-L164 HydrophobicContact CB-CD1 3.83Å; P157-L164 HydrophobicContact CB-CD2 4.38Å; N160-L164 PolarHBondContact O-N 3.23Å; P161-L164 PolarHBondContact O-N 2.83Å; L164-K166 PolarHBondContact O-N 3.36Å; L164-L167 PolarHBondContact O-N 3.37Å; L164-A168 VanDerWaalsContact O-CB 3.32Å; L164-A168 WeakPolarHBondContact O-CB 3.32Å; L164-A168 PolarHBondContact O-N 3.28Å; L164-M429 HydrophobicContact CB-CE 4.24Å; L164-M429 HydrophobicContact CD2-CE 4.26Å; L164-M429 WeakPolarHBondContact O-CE 3.41Å; L164-V434 HydrophobicContact CB-CG2 4.36Å; L164-V434 HydrophobicContact CD1-CG1 4.38Å
165	N	92.4	Very high	92.2	Very high	93 Å²	93	51.9 Å²	51.9	50%	0.497	27%	0.269	S	S	.	.	H	α-helix	trans	-61.3	-45.7	176.2	-69.1	-27.3	0	0	0	111.8	P161 D162 L163 L167 A168 E169	P161-N165 PolarHBondContact O-N 3.3Å; P161-N165 PolarHBondContact O-ND2 3.38Å; D162-N165 PolarHBondContact O-N 3.03Å; L163-N165 VanDerWaalsContact C-N 3.31Å; L163-N165 PolarHBondContact O-N 2.92Å; N165-L167 PolarHBondContact O-N 2.69Å; N165-A168 WeakPolarHBondContact O-CB 3.39Å; N165-A168 PolarHBondContact O-N 2.94Å; N165-E169 PolarHBondContact O-N 3.16Å; N165-E169 VanDerWaalsContact O-N 3.16Å
166	K	91.9	Very high	92.3	Very high	74 Å²	74	51.9 Å²	51.9	32%	0.322	27%	0.269	S	S	.	.	H	α-helix	trans	-62.1	-40.6	176.8	-76.1	-175.6	165	-67.5	0	113.3	A142 D162 L163 L164 A168	A142-K166 HydrophobicContact CB-CB 4.48Å; D162-K166 PolarHBondContact O-N 2.89Å; D162-K166 VanDerWaalsContact O-N 3.12Å; L163-K166 PolarHBondContact O-N 3.31Å; L164-K166 PolarHBondContact O-N 3.36Å; K166-A168 VanDerWaalsContact C-N 3.35Å
167	L	93.9	Very high	92.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-69.5	-34.8	177.1	-69.6	171.6	0	0	0	111.5	A142 F145 L151 L163 L164 N165 E169 K170 K171 T172 V174 M429	A142-L167 HydrophobicContact CB-CD2 3.92Å; F145-L167 HydrophobicContact CD2-CD2 3.85Å; F145-L167 HydrophobicContact CE2-CD2 3.61Å; L151-L167 HydrophobicContact CD2-CD1 4.07Å; L151-L167 HydrophobicContact CD2-CD2 4.25Å; L163-L167 HydrophobicContact CD1-CD1 4.08Å; L163-L167 HydrophobicContact CD1-CG 4.25Å; L163-L167 HydrophobicContact CG-CD1 3.9Å; L163-L167 HydrophobicContact CG-CG 4.47Å; L163-L167 WeakPolarHBondContact O-CG 3.32Å; L163-L167 PolarHBondContact O-N 2.88Å; L164-L167 PolarHBondContact O-N 3.37Å; N165-L167 PolarHBondContact O-N 2.69Å; L167-E169 PolarHBondContact O-N 3.22Å; L167-K170 PolarHBondContact O-N 2.95Å; L167-K171 PolarHBondContact O-N 3.42Å; L167-T172 PolarHBondContact O-N 3.43Å; L167-T172 PolarHBondContact O-OG1 2.92Å; L167-V174 HydrophobicContact CB-CG2 4.45Å; L167-V174 HydrophobicContact CD1-CG2 4.04Å; L167-M429 HydrophobicContact CB-CE 3.87Å; L167-M429 HydrophobicContact CB-SD 4.04Å
168	A	93.3	Very high	92.6	Very high	29 Å²	29	48.2 Å²	48.2	24%	0.24	26%	0.255	C	S	.	.	H	α-helix	trans	-62.9	-39.9	176.5	0	0	0	0	0	112.5	L164 N165 K166 K170 K171 M429 G432	L164-A168 VanDerWaalsContact O-CB 3.32Å; L164-A168 WeakPolarHBondContact O-CB 3.32Å; L164-A168 PolarHBondContact O-N 3.28Å; N165-A168 WeakPolarHBondContact O-CB 3.39Å; N165-A168 PolarHBondContact O-N 2.94Å; K166-A168 VanDerWaalsContact C-N 3.35Å; A168-K170 PolarHBondContact O-N 3.28Å; A168-K171 PolarHBondContact O-N 3.14Å; A168-M429 HydrophobicContact CB-CE 3.94Å; A168-M429 HydrophobicContact CB-SD 4.39Å; A168-G432 VanDerWaalsContact CB-O 3.28Å; A168-G432 WeakPolarHBondContact CB-O 3.34Å
169	E	92.3	Very high	92.8	Very high	146 Å²	146	48 Å²	48	68%	0.682	24%	0.242	S	C	*	.	H	α-helix	trans	-57.1	-31.4	176.4	-71.1	173.1	-171.6	0	0	112.7	N165 L167 K171	N165-E169 PolarHBondContact O-N 3.16Å; N165-E169 VanDerWaalsContact O-N 3.16Å; L167-E169 PolarHBondContact O-N 3.22Å; E169-K171 VanDerWaalsContact C-N 3.35Å
170	K	89.6	Confident	93.1	Very high	60 Å²	60	43.8 Å²	43.8	26%	0.261	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	1.9	178.3	-66.3	-66.8	-171.3	163.9	0	114.3	D143 A148 L167 A168 T172	D143-K170 WeakPolarHBondContact O-CE 3.42Å; D143-K170 PolarHBondContact O-NZ 3.29Å; A148-K170 PolarHBondContact N-O 2.94Å; L167-K170 PolarHBondContact O-N 2.95Å; A168-K170 PolarHBondContact O-N 3.28Å; K170-T172 HydrophobicContact CB-CG2 3.86Å; K170-T172 PolarHBondContact O-N 3.33Å
171	K	93.1	Very high	93	Very high	131 Å²	131	41.9 Å²	41.9	57%	0.57	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	34.3	-175.8	-56	-175.7	178	-176.3	0	113.1	T147 A148 L167 A168 E169	T147-K171 HydrophobicContact CG2-CB 4.45Å; A148-K171 WeakPolarHBondContact CA-O 2.96Å; L167-K171 PolarHBondContact O-N 3.42Å; A168-K171 PolarHBondContact O-N 3.14Å; E169-K171 VanDerWaalsContact C-N 3.35Å
172	T	93.1	Very high	92.7	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.006	21%	0.214	C	C	.	.			trans	-74.2	157.9	-178.6	54.7	0	0	0	0	112.2	F145 A149 L167 K170 M429 G432	F145-T172 HydrophobicContact CB-CG2 4.44Å; F145-T172 HydrophobicContact CD2-CG2 4.18Å; A149-T172 HydrophobicContact CB-CG2 4.44Å; A149-T172 VanDerWaalsContact O-CA 3.31Å; A149-T172 WeakPolarHBondContact O-CA 3.35Å; A149-T172 WeakPolarHBondContact O-CB 3.31Å; L167-T172 PolarHBondContact O-N 3.43Å; L167-T172 PolarHBondContact O-OG1 2.92Å; K170-T172 HydrophobicContact CB-CG2 3.86Å; K170-T172 PolarHBondContact O-N 3.33Å; T172-M429 WeakPolarHBondContact O-CG 3.27Å; T172-M429 VanDerWaalsContact O-SD 3.38Å; T172-G432 PolarHBondContact O-N 2.83Å
173	T	96.3	Very high	92.4	Very high	12 Å²	12	38.6 Å²	38.6	7%	0.074	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	131.9	165.3	-69.6	0	0	0	0	108.7	A149 T150 L151 L175 F408 V427 M429 D431	A149-T173 PolarHBondContact O-N 2.78Å; T150-T173 CarbonylContact C-O 3.58Å; T150-T173 VanDerWaalsContact CA-O 3.23Å; T150-T173 WeakPolarHBondContact CA-O 3.22Å; L151-T173 PolarHBondContact N-O 3.05Å; T173-L175 HydrophobicContact CG2-CD1 4.11Å; T173-F408 HydrophobicContact CG2-CE2 4.3Å; T173-F408 HydrophobicContact CG2-CZ 4.12Å; T173-V427 HydrophobicContact CG2-CG1 4.44Å; T173-M429 CarbonylContact C-O 3.51Å; T173-M429 WeakPolarHBondContact CA-O 3.49Å; T173-D431 PolarHBondContact OG1-N 2.82Å; T173-D431 VanDerWaalsContact OG1-N 3.17Å
174	V	97	Very high	91.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	121	-170.3	-174.7	0	0	0	0	110.6	L151 I155 L167 V428 M429	L151-V174 HydrophobicContact CB-CG1 4.47Å; L151-V174 HydrophobicContact CB-CG2 4.42Å; L151-V174 HydrophobicContact CD2-CG1 4.25Å; I155-V174 HydrophobicContact CD1-CG1 3.69Å; I155-V174 HydrophobicContact CG1-CG1 3.67Å; L167-V174 HydrophobicContact CB-CG2 4.45Å; L167-V174 HydrophobicContact CD1-CG2 4.04Å; V174-V428 HydrophobicContact CB-CG2 3.9Å; V174-V428 HydrophobicContact CG1-CG2 3.76Å; V174-V428 PolarHBondContact O-N 3.31Å; V174-M429 HydrophobicContact CB-CB 4Å; V174-M429 HydrophobicContact CG2-CB 4Å; V174-M429 HydrophobicContact CG2-SD 3.99Å; V174-M429 PolarHBondContact N-O 3.16Å
175	L	96.8	Very high	91.3	Very high	2 Å²	2	47 Å²	47	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	115.4	172.4	-77.9	71.6	0	0	0	108.6	T150 L151 I152 S153 T173 I399 F408 T426 V427	T150-L175 HydrophobicContact CG2-CD1 3.8Å; L151-L175 PolarHBondContact O-N 3.03Å; I152-L175 HydrophobicContact CG1-CB 4.25Å; S153-L175 PolarHBondContact N-O 2.97Å; T173-L175 HydrophobicContact CG2-CD1 4.11Å; L175-I399 HydrophobicContact CD2-CD1 3.77Å; L175-F408 HydrophobicContact CD1-CE2 4.08Å; L175-F408 HydrophobicContact CD1-CZ 3.85Å; L175-T426 WeakPolarHBondContact CA-O 3.31Å; L175-T426 HydrophobicContact CB-CG2 4Å; L175-T426 HydrophobicContact CD2-CG2 4.4Å; L175-T426 HydrophobicContact CG-CG2 4.21Å; L175-V427 HydrophobicContact CD1-CG2 4.22Å; L175-V427 HydrophobicContact CG-CG2 4.13Å
176	A	96.1	Very high	91.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	112.7	-178.8	0	0	0	0	0	110.3	S153 I155 D178 Q179 T426 V428	S153-A176 WeakPolarHBondContact O-CA 3.44Å; I155-A176 HydrophobicContact CB-CB 3.98Å; I155-A176 HydrophobicContact CG1-CB 4.03Å; A176-D178 PolarHBondContact O-N 3.38Å; A176-Q179 HydrophobicContact CB-CB 4.02Å; A176-Q179 HydrophobicContact CB-CG 3.73Å; A176-Q179 PolarHBondContact O-N 3.28Å; A176-T426 PolarHBondContact N-O 2.91Å; A176-V428 HydrophobicContact CB-CG1 3.63Å; A176-V428 HydrophobicContact CB-CG2 4.07Å
177	M	95.2	Very high	90.8	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-21	179	-66.6	-59.8	-63.3	0	0	112.8	I152 S153 F154 A191 Y388 N391 I392 L395	I152-M177 HydrophobicContact CG2-CG 3.92Å; I152-M177 HydrophobicContact CG2-SD 3.7Å; S153-M177 PolarHBondContact O-N 3.44Å; F154-M177 HydrophobicContact CD1-CB 3.98Å; F154-M177 HydrophobicContact CE1-CB 3.95Å; M177-A191 HydrophobicContact CB-CB 4.04Å; M177-A191 HydrophobicContact CE-CB 3.83Å; M177-Y388 HydrophobicContact CB-CE2 4.32Å; M177-Y388 HydrophobicContact CE-CE2 4.47Å; M177-Y388 HydrophobicContact CG-CE2 4.08Å; M177-N391 HydrophobicContact CE-CB 4.18Å; M177-I392 HydrophobicContact CE-CG1 4.28Å; M177-I392 HydrophobicContact SD-CG1 4.39Å; M177-L395 HydrophobicContact CE-CD2 4.27Å; M177-L395 HydrophobicContact SD-CD2 3.56Å; M177-L395 VanDerWaalsContact SD-CD2 3.56Å
178	D	90.8	Very high	90.5	Very high	13 Å²	13	47.3 Å²	47.3	7%	0.07	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-18.1	173	51.6	-69.7	0	0	0	114	F154 I155 Y156 P157 A176 L192	F154-D178 HydrophobicContact CD1-CB 3.85Å; F154-D178 HydrophobicContact CE1-CB 4.35Å; I155-D178 PolarHBondContact N-OD1 3.43Å; Y156-D178 VanDerWaalsContact CA-OD2 3.29Å; Y156-D178 WeakPolarHBondContact CA-OD2 3.38Å; Y156-D178 HydrophobicContact CD1-CB 4.06Å; Y156-D178 HydrophobicContact CE1-CB 3.81Å; Y156-D178 PolarHBondContact N-OD1 3.3Å; Y156-D178 PolarHBondContact N-OD2 3.05Å; P157-D178 VanDerWaalsContact CD-OD2 3.31Å; P157-D178 WeakPolarHBondContact CD-OD2 3.49Å; A176-D178 PolarHBondContact O-N 3.38Å; D178-L192 HydrophobicContact CB-CD1 4.44Å
179	Q	92.7	Very high	90.5	Very high	63 Å²	63	46.7 Å²	46.7	29%	0.294	23%	0.233	S	C	.	.	S	Bend	trans	-100.6	8.1	-177.9	-57.8	-58	-55.9	0	0	113.2	P157 A176 P181 G425 V428	P157-Q179 HydrophobicContact CG-CG 4.02Å; A176-Q179 HydrophobicContact CB-CB 4.02Å; A176-Q179 HydrophobicContact CB-CG 3.73Å; A176-Q179 PolarHBondContact O-N 3.28Å; Q179-P181 WeakPolarHBondContact O-CD 3.46Å; Q179-G425 VanDerWaalsContact CB-O 3.26Å; Q179-G425 WeakPolarHBondContact CB-O 3.44Å; Q179-G425 CarbonylContact O-C 3.48Å; Q179-V428 HydrophobicContact CB-CG1 4.33Å; Q179-V428 HydrophobicContact CG-CG1 3.87Å
180	V	91.8	Very high	90.5	Very high	11 Å²	11	40.3 Å²	40.3	7%	0.067	20%	0.204	C	C	.	.			trans	-62.1	121.2	172.5	179	0	0	0	0	108.9	A186 Y189 T426	V180-A186 HydrophobicContact CG1-CB 4.18Å; V180-Y189 HydrophobicContact CG1-CD2 4Å; V180-Y189 HydrophobicContact CG1-CE2 4.06Å; V180-T426 HydrophobicContact CG2-CG2 4.17Å
181	P	88.1	Confident	90.6	Very high	22 Å²	22	37.4 Å²	37.4	14%	0.143	19%	0.191	C	C	.	.			trans	-69.2	139.8	-178	26.6	-32.8	0	0	0	111.1	Q179 V183 A186 V422	Q179-P181 WeakPolarHBondContact O-CD 3.46Å; P181-V183 VanDerWaalsContact C-N 3.3Å; P181-V183 PolarHBondContact O-N 2.96Å; P181-A186 WeakPolarHBondContact O-CB 3.24Å; P181-V422 HydrophobicContact CG-CB 4.41Å; P181-V422 HydrophobicContact CG-CG2 4.21Å
182	R	83.9	Confident	90.5	Very high	120 Å²	120	33.3 Å²	33.3	45%	0.453	18%	0.175	S	C	.	.			trans	-78.7	75.7	178.4	-66	-176.1	-178.7	173	5.2	111.3	Y288	R182-Y288 PolarHBondContact NE-OH 2.94Å; R182-Y288 VanDerWaalsContact NE-OH 3.17Å; R182-Y288 VanDerWaalsContact NH1-CZ 3.3Å; R182-Y288 PolarHBondContact NH1-OH 3.4Å; R182-Y288 PolarHBondContact NH2-OH 2.79Å
183	V	84.3	Confident	90.4	Very high	6 Å²	6	34.8 Å²	34.8	4%	0.036	19%	0.185	C	C	.	.			trans	-117.5	156.9	174.3	-64.2	0	0	0	0	110.9	P181 I185 A186 Q187 Y416 V422	P181-V183 VanDerWaalsContact C-N 3.3Å; P181-V183 PolarHBondContact O-N 2.96Å; V183-I185 VanDerWaalsContact C-N 3.3Å; V183-I185 HydrophobicContact CG2-CG1 3.88Å; V183-I185 PolarHBondContact O-N 3.46Å; V183-A186 HydrophobicContact CG2-CB 3.68Å; V183-A186 PolarHBondContact O-N 3.42Å; V183-Q187 PolarHBondContact O-N 3.3Å; V183-Y416 HydrophobicContact CG1-CE1 4.33Å; V183-Y416 HydrophobicContact CG1-CE2 3.91Å; V183-V422 HydrophobicContact CG2-CG2 4Å
184	T	81	Confident	90.3	Very high	117 Å²	117	35.1 Å²	35.1	72%	0.718	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-52	-44.7	-173.7	-50.6	0	0	0	0	113.3	A186	T184-A186 PolarHBondContact O-N 3.19Å
185	I	83.6	Confident	90.2	Very high	86 Å²	86	35.9 Å²	35.9	44%	0.441	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-70.4	-14.5	-179.5	62.7	160.5	0	0	0	114.1	V183 Y189 G417 V422	V183-I185 VanDerWaalsContact C-N 3.3Å; V183-I185 HydrophobicContact CG2-CG1 3.88Å; V183-I185 PolarHBondContact O-N 3.46Å; I185-Y189 PolarHBondContact O-OH 3Å; I185-G417 WeakPolarHBondContact CD1-O 3.32Å; I185-V422 HydrophobicContact CD1-CG2 4.11Å; I185-V422 HydrophobicContact CG1-CG2 4.36Å
186	A	88.1	Confident	90	Very high	1 Å²	1	37 Å²	37	1%	0.008	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-104.1	-7.3	-174.9	0	0	0	0	0	114.4	V180 P181 V183 T184 G188 Y189 D190 V422	V180-A186 HydrophobicContact CG1-CB 4.18Å; P181-A186 WeakPolarHBondContact O-CB 3.24Å; V183-A186 HydrophobicContact CG2-CB 3.68Å; V183-A186 PolarHBondContact O-N 3.42Å; T184-A186 PolarHBondContact O-N 3.19Å; A186-G188 PolarHBondContact O-N 3.37Å; A186-G188 VanDerWaalsContact O-N 3.13Å; A186-Y189 VanDerWaalsContact CA-CZ 3.42Å; A186-Y189 WeakPolarHBondContact CA-OH 3.28Å; A186-Y189 HydrophobicContact CB-CD2 4.34Å; A186-Y189 HydrophobicContact CB-CE2 3.51Å; A186-Y189 WeakPolarHBondContact O-CD2 3.4Å; A186-Y189 PolarHBondContact O-N 3.38Å; A186-Y189 VanDerWaalsContact O-N 3.12Å; A186-D190 PolarHBondContact O-N 3.31Å; A186-V422 HydrophobicContact CB-CG2 3.92Å
187	Q	86.6	Confident	90	Very high	139 Å²	139	40.8 Å²	40.8	65%	0.65	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-56.7	-32.6	-179.5	-67.8	-179.9	-12.6	0	0	112.8	V183 Y189	V183-Q187 PolarHBondContact O-N 3.3Å; Q187-Y189 PolarHBondContact O-N 3.06Å
188	G	87.4	Confident	90	Very high	34 Å²	34	41.1 Å²	41.1	35%	0.351	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-67.6	-13.2	-178.5	0	0	0	0	0	115.2	A186 N391 K394	A186-G188 PolarHBondContact O-N 3.37Å; A186-G188 VanDerWaalsContact O-N 3.13Å; G188-N391 PolarHBondContact O-OD1 3.13Å; G188-K394 WeakPolarHBondContact O-CD 3.34Å
189	Y	91.8	Very high	90.2	Very high	15 Å²	15	41 Å²	41	6%	0.059	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-134.3	21.4	179.9	44.7	-99.4	0	0	0	113.5	V180 I185 A186 Q187 A191 N391 K394 L395 A398 V422	V180-Y189 HydrophobicContact CG1-CD2 4Å; V180-Y189 HydrophobicContact CG1-CE2 4.06Å; I185-Y189 PolarHBondContact O-OH 3Å; A186-Y189 VanDerWaalsContact CA-CZ 3.42Å; A186-Y189 WeakPolarHBondContact CA-OH 3.28Å; A186-Y189 HydrophobicContact CB-CD2 4.34Å; A186-Y189 HydrophobicContact CB-CE2 3.51Å; A186-Y189 WeakPolarHBondContact O-CD2 3.4Å; A186-Y189 PolarHBondContact O-N 3.38Å; A186-Y189 VanDerWaalsContact O-N 3.12Å; Q187-Y189 PolarHBondContact O-N 3.06Å; Y189-A191 PolarHBondContact O-N 3.46Å; Y189-N391 WeakPolarHBondContact CB-O 3.42Å; Y189-K394 HydrophobicContact CD1-CB 4.08Å; Y189-L395 HydrophobicContact CD2-CB 4.32Å; Y189-L395 HydrophobicContact CD2-CD1 3.85Å; Y189-L395 HydrophobicContact CE2-CD1 3.97Å; Y189-L395 HydrophobicContact CG-CB 4.19Å; Y189-L395 HydrophobicContact CG-CD1 4.49Å; Y189-A398 HydrophobicContact CE1-CB 3.87Å; Y189-V422 HydrophobicContact CE2-CG1 3.61Å
190	D	92.8	Very high	90.4	Very high	12 Å²	12	38 Å²	38	6%	0.064	21%	0.211	C	C	.	.			trans	-74.8	108.6	171.6	-179.5	-10.3	0	0	0	110.7	A186 L192 S193 S194 N391	A186-D190 PolarHBondContact O-N 3.31Å; D190-L192 PolarHBondContact OD1-N 3.41Å; D190-S193 VanDerWaalsContact CG-OG 3.25Å; D190-S193 PolarHBondContact OD1-N 3.36Å; D190-S193 WeakPolarHBondContact OD2-CB 3.32Å; D190-S193 PolarHBondContact OD2-OG 3.49Å; D190-S194 PolarHBondContact O-N 3.22Å; D190-S194 PolarHBondContact O-OG 2.88Å; D190-N391 PolarHBondContact O-ND2 2.93Å; D190-N391 VanDerWaalsContact O-ND2 3.08Å
191	A	93.1	Very high	90.7	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-71.9	-34.5	179.2	0	0	0	0	0	113.9	F154 M177 Y189 S194 M195 Y388 N391	F154-A191 HydrophobicContact CE1-CB 3.87Å; F154-A191 HydrophobicContact CE2-CB 4.42Å; F154-A191 HydrophobicContact CZ-CB 3.48Å; F154-A191 VanDerWaalsContact CZ-CB 3.48Å; M177-A191 HydrophobicContact CB-CB 4.04Å; M177-A191 HydrophobicContact CE-CB 3.83Å; Y189-A191 PolarHBondContact O-N 3.46Å; A191-S194 PolarHBondContact O-N 3.16Å; A191-M195 VanDerWaalsContact O-CG 3.32Å; A191-M195 WeakPolarHBondContact O-CG 3.32Å; A191-M195 PolarHBondContact O-N 3.21Å; A191-Y388 HydrophobicContact CB-CD2 3.86Å; A191-Y388 HydrophobicContact CB-CE2 3.83Å; A191-N391 VanDerWaalsContact CA-ND2 3.3Å; A191-N391 WeakPolarHBondContact CA-ND2 3.16Å
192	L	90.9	Very high	91.1	Very high	45 Å²	45	43.8 Å²	43.8	24%	0.236	23%	0.23	C	C	.	.	H	α-helix	trans	-67.3	-41.3	179.3	-65.6	176.7	0	0	0	110.5	F154 D178 D190 M195 A196	F154-L192 HydrophobicContact CD1-CD2 4.4Å; F154-L192 HydrophobicContact CE1-CD2 3.63Å; F154-L192 HydrophobicContact CE1-CG 4.16Å; F154-L192 HydrophobicContact CZ-CD2 4.2Å; D178-L192 HydrophobicContact CB-CD1 4.44Å; D190-L192 PolarHBondContact OD1-N 3.41Å; L192-M195 PolarHBondContact O-N 3.44Å; L192-A196 WeakPolarHBondContact O-CB 3.1Å; L192-A196 PolarHBondContact O-N 3.17Å
193	S	91	Very high	91.7	Very high	31 Å²	31	38 Å²	38	22%	0.217	21%	0.209	C	C	.	.	H	α-helix	trans	-62.4	-44.5	175.6	-71.5	0	0	0	0	112.1	D190 M195 A196 N197 V237	D190-S193 VanDerWaalsContact CG-OG 3.25Å; D190-S193 PolarHBondContact OD1-N 3.36Å; D190-S193 WeakPolarHBondContact OD2-CB 3.32Å; D190-S193 PolarHBondContact OD2-OG 3.49Å; S193-M195 PolarHBondContact O-N 3.25Å; S193-A196 PolarHBondContact O-N 3.45Å; S193-N197 WeakPolarHBondContact O-CB 3.31Å; S193-N197 PolarHBondContact O-N 2.95Å; S193-V237 WeakPolarHBondContact O-CG1 3.41Å
194	S	93.4	Very high	92.4	Very high	19 Å²	19	37.8 Å²	37.8	13%	0.133	21%	0.207	C	C	.	.	H	α-helix	trans	-59.5	-45.9	174.9	-70.2	0	0	0	0	112.5	D190 A191 N197 I198 N391	D190-S194 PolarHBondContact O-N 3.22Å; D190-S194 PolarHBondContact O-OG 2.88Å; A191-S194 PolarHBondContact O-N 3.16Å; S194-N197 PolarHBondContact O-N 2.9Å; S194-I198 WeakPolarHBondContact O-CD1 3.32Å; S194-I198 WeakPolarHBondContact O-CG1 3.29Å; S194-I198 PolarHBondContact O-N 3.4Å; S194-N391 WeakPolarHBondContact CB-ND2 3.34Å; S194-N391 PolarHBondContact OG-ND2 3.16Å
195	M	94.5	Very high	93.2	Very high	16 Å²	16	34.5 Å²	34.5	8%	0.079	19%	0.187	C	C	.	.	H	α-helix	trans	-68.4	-38.8	179.6	-65.8	-52.7	107.7	0	0	112.1	R71 F154 A191 L192 S193 I198 A199 P377 A384	R71-M195 PolarHBondContact NH1-SD 3.42Å; F154-M195 HydrophobicContact CE2-CG 4.43Å; F154-M195 HydrophobicContact CZ-CG 4.36Å; A191-M195 VanDerWaalsContact O-CG 3.32Å; A191-M195 WeakPolarHBondContact O-CG 3.32Å; A191-M195 PolarHBondContact O-N 3.21Å; L192-M195 PolarHBondContact O-N 3.44Å; S193-M195 PolarHBondContact O-N 3.25Å; M195-I198 HydrophobicContact CE-CD1 4.05Å; M195-I198 PolarHBondContact O-N 2.74Å; M195-A199 VanDerWaalsContact O-CB 3.31Å; M195-A199 WeakPolarHBondContact O-CB 3.43Å; M195-A199 PolarHBondContact O-N 3.23Å; M195-P377 HydrophobicContact CB-CG 4.15Å; M195-P377 HydrophobicContact SD-CB 3.76Å; M195-P377 HydrophobicContact SD-CG 4.25Å; M195-A384 HydrophobicContact CE-CB 4.29Å; M195-A384 HydrophobicContact SD-CB 4.22Å
196	A	93	Very high	93.8	Very high	27 Å²	27	31.2 Å²	31.2	22%	0.223	17%	0.17	C	C	.	.	H	α-helix	trans	-63.2	-42.5	176.1	0	0	0	0	0	111.8	L192 S193 A199 G200 V237 A238	L192-A196 WeakPolarHBondContact O-CB 3.1Å; L192-A196 PolarHBondContact O-N 3.17Å; S193-A196 PolarHBondContact O-N 3.45Å; A196-A199 PolarHBondContact O-N 3.38Å; A196-G200 PolarHBondContact O-N 3.39Å; A196-V237 HydrophobicContact CB-CB 4.01Å; A196-V237 HydrophobicContact CB-CG1 4.18Å; A196-A238 HydrophobicContact CB-CB 4.08Å; A196-A238 VanDerWaalsContact O-CA 3.27Å; A196-A238 WeakPolarHBondContact O-CA 3.47Å; A196-A238 VanDerWaalsContact O-CB 3.27Å; A196-A238 WeakPolarHBondContact O-CB 3.15Å
197	N	95	Very high	94.2	Very high	78 Å²	78	31.1 Å²	31.1	42%	0.417	17%	0.17	S	C	.	.	H	α-helix	trans	-59.2	-49.6	176	-174	6.3	0	0	0	111.2	S193 S194 A199 G200 Y201 V237 A241	S193-N197 WeakPolarHBondContact O-CB 3.31Å; S193-N197 PolarHBondContact O-N 2.95Å; S194-N197 PolarHBondContact O-N 2.9Å; N197-A199 PolarHBondContact O-N 3.12Å; N197-G200 PolarHBondContact O-N 3.48Å; N197-Y201 PolarHBondContact O-N 2.88Å; N197-V237 HydrophobicContact CB-CG1 3.93Å; N197-A241 VanDerWaalsContact OD1-CB 3.23Å; N197-A241 WeakPolarHBondContact OD1-CB 3.27Å
198	I	95.4	Very high	94.6	Very high	8 Å²	8	26.1 Å²	26.1	4%	0.041	15%	0.152	C	C	.	.	H	α-helix	trans	-61.7	-43.6	176.7	-65.2	160.4	0	0	0	111.3	S194 M195 G200 Y201 K202 P377 M380 Q383 A384 L387	S194-I198 WeakPolarHBondContact O-CD1 3.32Å; S194-I198 WeakPolarHBondContact O-CG1 3.29Å; S194-I198 PolarHBondContact O-N 3.4Å; M195-I198 HydrophobicContact CE-CD1 4.05Å; M195-I198 PolarHBondContact O-N 2.74Å; I198-G200 VanDerWaalsContact C-N 3.34Å; I198-G200 PolarHBondContact O-N 3.02Å; I198-Y201 PolarHBondContact O-N 3.49Å; I198-K202 VanDerWaalsContact O-CB 3.25Å; I198-K202 WeakPolarHBondContact O-CB 3.09Å; I198-K202 PolarHBondContact O-N 3.48Å; I198-P377 HydrophobicContact CG2-CB 4.43Å; I198-M380 HydrophobicContact CG2-CB 3.96Å; I198-M380 HydrophobicContact CG2-SD 4.28Å; I198-Q383 HydrophobicContact CD1-CG 4.5Å; I198-Q383 HydrophobicContact CG1-CG 4.47Å; I198-A384 VanDerWaalsContact CD1-CA 3.42Å; I198-A384 HydrophobicContact CD1-CB 3.77Å; I198-L387 HydrophobicContact CD1-CD1 3.98Å; I198-L387 HydrophobicContact CG1-CD1 4.25Å
199	A	95.8	Very high	95.1	Very high	12 Å²	12	30.4 Å²	30.4	10%	0.099	17%	0.167	C	C	.	.	H	α-helix	trans	-60.4	-44.1	178.9	0	0	0	0	0	111.2	M195 A196 N197 K202 A203 L376 P377	M195-A199 VanDerWaalsContact O-CB 3.31Å; M195-A199 WeakPolarHBondContact O-CB 3.43Å; M195-A199 PolarHBondContact O-N 3.23Å; A196-A199 PolarHBondContact O-N 3.38Å; N197-A199 PolarHBondContact O-N 3.12Å; A199-K202 PolarHBondContact O-N 2.88Å; A199-A203 VanDerWaalsContact O-CB 3.31Å; A199-A203 WeakPolarHBondContact O-CB 3.32Å; A199-A203 PolarHBondContact O-N 3.25Å; A199-L376 HydrophobicContact CB-CB 4.32Å; A199-P377 HydrophobicContact CB-CG 4.42Å
200	G	96.4	Very high	95.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.9	-48.5	176.4	0	0	0	0	0	113.1	A196 N197 I198 K202 A203 V204 A238 S242	A196-G200 PolarHBondContact O-N 3.39Å; N197-G200 PolarHBondContact O-N 3.48Å; I198-G200 VanDerWaalsContact C-N 3.34Å; I198-G200 PolarHBondContact O-N 3.02Å; G200-K202 PolarHBondContact O-N 2.91Å; G200-A203 WeakPolarHBondContact O-CB 3.28Å; G200-A203 PolarHBondContact O-N 2.84Å; G200-V204 PolarHBondContact O-N 3.27Å; G200-A238 WeakPolarHBondContact CA-O 3.23Å; G200-S242 WeakPolarHBondContact CA-OG 3.37Å; G200-S242 PolarHBondContact O-OG 3.47Å
201	Y	97.6	Very high	95.5	Very high	116 Å²	116	32.9 Å²	32.9	46%	0.455	18%	0.178	S	C	.	.	H	α-helix	trans	-59.1	-46.5	174.2	177.7	-92	0	0	0	111.8	N197 I198 A203 V204 V205 A245 M380	N197-Y201 PolarHBondContact O-N 2.88Å; I198-Y201 PolarHBondContact O-N 3.49Å; Y201-A203 VanDerWaalsContact C-N 3.32Å; Y201-A203 PolarHBondContact O-N 3.48Å; Y201-V204 PolarHBondContact O-N 3.31Å; Y201-V205 HydrophobicContact CD1-CG2 4.1Å; Y201-V205 HydrophobicContact CE1-CG2 3.6Å; Y201-V205 HydrophobicContact CE2-CG2 4.45Å; Y201-V205 WeakPolarHBondContact O-CG2 3.49Å; Y201-V205 PolarHBondContact O-N 3.34Å; Y201-V205 VanDerWaalsContact O-N 3.12Å; Y201-A245 HydrophobicContact CD2-CB 4.01Å; Y201-M380 HydrophobicContact CD1-CE 3.8Å; Y201-M380 HydrophobicContact CD1-SD 3.65Å; Y201-M380 HydrophobicContact CE1-CE 3.72Å; Y201-M380 HydrophobicContact CE1-SD 3.96Å
202	K	97.4	Very high	95.6	Very high	37 Å²	37	36.8 Å²	36.8	16%	0.161	22%	0.219	C	C	.	.	H	α-helix	trans	-66.9	-33.9	-178.5	-172.3	51.3	169.9	179.5	0	112.3	I198 A199 G200 V204 V205 L206 L376 M380	I198-K202 VanDerWaalsContact O-CB 3.25Å; I198-K202 WeakPolarHBondContact O-CB 3.09Å; I198-K202 PolarHBondContact O-N 3.48Å; A199-K202 PolarHBondContact O-N 2.88Å; G200-K202 PolarHBondContact O-N 2.91Å; K202-V204 VanDerWaalsContact C-N 3.31Å; K202-V204 PolarHBondContact O-N 2.9Å; K202-V205 PolarHBondContact O-N 2.82Å; K202-L206 HydrophobicContact CD-CD1 4.4Å; K202-L206 HydrophobicContact CD-CG 4.14Å; K202-L206 HydrophobicContact CG-CD1 4.09Å; K202-L206 HydrophobicContact CG-CG 4.33Å; K202-L206 WeakPolarHBondContact O-CB 3.45Å; K202-L206 VanDerWaalsContact O-CG 3.32Å; K202-L206 WeakPolarHBondContact O-CG 3.25Å; K202-L206 PolarHBondContact O-N 3.04Å; K202-L376 HydrophobicContact CG-CD2 4.22Å; K202-M380 HydrophobicContact CB-CG 4.45Å; K202-M380 HydrophobicContact CB-SD 3.89Å; K202-M380 HydrophobicContact CD-CG 3.81Å; K202-M380 HydrophobicContact CD-SD 3.81Å; K202-M380 HydrophobicContact CG-CG 4.23Å; K202-M380 HydrophobicContact CG-SD 4.22Å
203	A	97.4	Very high	95.8	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-55.8	-48.6	173.9	0	0	0	0	0	111	A199 G200 Y201 L206 A207 I315 V344 L346	A199-A203 VanDerWaalsContact O-CB 3.31Å; A199-A203 WeakPolarHBondContact O-CB 3.32Å; A199-A203 PolarHBondContact O-N 3.25Å; G200-A203 WeakPolarHBondContact O-CB 3.28Å; G200-A203 PolarHBondContact O-N 2.84Å; Y201-A203 VanDerWaalsContact C-N 3.32Å; Y201-A203 PolarHBondContact O-N 3.48Å; A203-L206 PolarHBondContact O-N 3.01Å; A203-A207 VanDerWaalsContact O-CB 3.32Å; A203-A207 WeakPolarHBondContact O-CB 3.39Å; A203-A207 PolarHBondContact O-N 3.17Å; A203-I315 HydrophobicContact CB-CD1 4.3Å; A203-I315 HydrophobicContact CB-CG2 4.19Å; A203-V344 HydrophobicContact CB-CG1 3.87Å; A203-L346 HydrophobicContact CB-CD1 4.36Å; A203-L346 HydrophobicContact CB-CD2 3.87Å
204	V	97.8	Very high	96	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-66	-43.8	-179.5	169.6	0	0	0	0	111.7	G200 Y201 K202 L206 A207 A208 F215 S242 A245 A246 M249 I315	G200-V204 PolarHBondContact O-N 3.27Å; Y201-V204 PolarHBondContact O-N 3.31Å; K202-V204 VanDerWaalsContact C-N 3.31Å; K202-V204 PolarHBondContact O-N 2.9Å; V204-L206 PolarHBondContact O-N 3.42Å; V204-A207 PolarHBondContact O-N 3.44Å; V204-A208 WeakPolarHBondContact O-CB 3.49Å; V204-A208 PolarHBondContact O-N 3.35Å; V204-F215 HydrophobicContact CG1-CE1 4.41Å; V204-S242 WeakPolarHBondContact CG2-O 3.29Å; V204-A245 HydrophobicContact CB-CB 4.14Å; V204-A245 HydrophobicContact CG1-CB 3.94Å; V204-A245 HydrophobicContact CG2-CB 4.23Å; V204-A246 HydrophobicContact CG1-CB 4.27Å; V204-A246 HydrophobicContact CG2-CB 4.32Å; V204-M249 HydrophobicContact CG1-CE 3.08Å; V204-M249 HydrophobicContact CG1-SD 4.5Å; V204-I315 HydrophobicContact CG2-CD1 3.6Å
205	V	97.3	Very high	96.2	Very high	47 Å²	47	44.7 Å²	44.7	29%	0.285	24%	0.242	S	C	.	.	H	α-helix	trans	-63	-41.5	176.4	173.3	0	0	0	0	111.6	Y201 K202 A208 N209	Y201-V205 HydrophobicContact CD1-CG2 4.1Å; Y201-V205 HydrophobicContact CE1-CG2 3.6Å; Y201-V205 HydrophobicContact CE2-CG2 4.45Å; Y201-V205 WeakPolarHBondContact O-CG2 3.49Å; Y201-V205 PolarHBondContact O-N 3.34Å; Y201-V205 VanDerWaalsContact O-N 3.12Å; K202-V205 PolarHBondContact O-N 2.82Å; V205-A208 PolarHBondContact O-N 2.84Å; V205-N209 WeakPolarHBondContact O-CB 3.38Å; V205-N209 PolarHBondContact O-N 3.3Å
206	L	96.6	Very high	96.2	Very high	17 Å²	17	47 Å²	47	9%	0.089	26%	0.257	C	S	.	.	H	α-helix	trans	-67.7	-41.6	176	-73.2	173.9	0	0	0	111.4	K202 A203 V204 A208 N209 H210 I371 Y373 L376	K202-L206 HydrophobicContact CD-CD1 4.4Å; K202-L206 HydrophobicContact CD-CG 4.14Å; K202-L206 HydrophobicContact CG-CD1 4.09Å; K202-L206 HydrophobicContact CG-CG 4.33Å; K202-L206 WeakPolarHBondContact O-CB 3.45Å; K202-L206 VanDerWaalsContact O-CG 3.32Å; K202-L206 WeakPolarHBondContact O-CG 3.25Å; K202-L206 PolarHBondContact O-N 3.04Å; A203-L206 PolarHBondContact O-N 3.01Å; V204-L206 PolarHBondContact O-N 3.42Å; L206-A208 VanDerWaalsContact C-N 3.32Å; L206-A208 PolarHBondContact O-N 3.47Å; L206-N209 PolarHBondContact O-N 3.05Å; L206-H210 PolarHBondContact O-CD2 3.41Å; L206-H210 VanDerWaalsContact O-CD2 3.23Å; L206-H210 PolarHBondContact O-N 3.29Å; L206-I371 HydrophobicContact CB-CD1 4.01Å; L206-I371 HydrophobicContact CD1-CG2 4.35Å; L206-Y373 HydrophobicContact CD1-CD2 4.04Å; L206-Y373 HydrophobicContact CD1-CE2 4.33Å; L206-L376 HydrophobicContact CD1-CD2 3.4Å; L206-L376 VanDerWaalsContact CD1-CD2 3.4Å
207	A	96.8	Very high	96.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-58.3	-46.4	175.6	0	0	0	0	0	111	A203 V204 N209 H210 F211 I313 V342 V344	A203-A207 VanDerWaalsContact O-CB 3.32Å; A203-A207 WeakPolarHBondContact O-CB 3.39Å; A203-A207 PolarHBondContact O-N 3.17Å; V204-A207 PolarHBondContact O-N 3.44Å; A207-N209 PolarHBondContact O-N 3.44Å; A207-H210 PolarHBondContact O-N 2.87Å; A207-F211 WeakPolarHBondContact O-CB 3.44Å; A207-F211 PolarHBondContact O-N 2.75Å; A207-I313 HydrophobicContact CB-CD1 4.15Å; A207-I313 HydrophobicContact CB-CG2 3.84Å; A207-V342 HydrophobicContact CB-CG1 4.3Å; A207-V344 HydrophobicContact CB-CG2 4.03Å
208	A	95.6	Very high	96.1	Very high	34 Å²	34	47.9 Å²	47.9	28%	0.281	26%	0.262	S	S	.	.	H	α-helix	trans	-61.5	-41	176.1	0	0	0	0	0	113.1	V204 V205 L206 H210 F211 F215 M249	V204-A208 WeakPolarHBondContact O-CB 3.49Å; V204-A208 PolarHBondContact O-N 3.35Å; V205-A208 PolarHBondContact O-N 2.84Å; L206-A208 VanDerWaalsContact C-N 3.32Å; L206-A208 PolarHBondContact O-N 3.47Å; A208-H210 VanDerWaalsContact C-N 3.31Å; A208-H210 PolarHBondContact O-N 3.11Å; A208-F211 PolarHBondContact O-N 2.92Å; A208-F215 HydrophobicContact CB-CD2 4.23Å; A208-F215 HydrophobicContact CB-CE2 3.7Å; A208-F215 HydrophobicContact CB-CZ 3.88Å; A208-M249 HydrophobicContact CB-CE 4.42Å
209	N	96.6	Very high	96	Very high	124 Å²	124	54.3 Å²	54.3	66%	0.663	30%	0.295	S	S	*	.	H	α-helix	trans	-66.7	-31.9	178.8	-174.6	71.9	0	0	0	113.3	V205 L206 A207	V205-N209 WeakPolarHBondContact O-CB 3.38Å; V205-N209 PolarHBondContact O-N 3.3Å; L206-N209 PolarHBondContact O-N 3.05Å; A207-N209 PolarHBondContact O-N 3.44Å
210	H	96.7	Very high	95.9	Very high	66 Å²	66	56.9 Å²	56.9	31%	0.306	31%	0.31	S	S	.	.	H	α-helix	trans	-95.8	-7	-179.5	-72.3	-73.7	0	0	0	113.7	L206 A207 A208 V342 L362 T369 I371	L206-H210 PolarHBondContact O-CD2 3.41Å; L206-H210 VanDerWaalsContact O-CD2 3.23Å; L206-H210 PolarHBondContact O-N 3.29Å; A207-H210 PolarHBondContact O-N 2.87Å; A208-H210 VanDerWaalsContact C-N 3.31Å; A208-H210 PolarHBondContact O-N 3.11Å; H210-V342 HydrophobicContact CB-CG2 4.24Å; H210-L362 VanDerWaalsContact CE1-CD1 3.48Å; H210-L362 WeakPolarHBondContact CE1-CD1 3.12Å; H210-L362 WeakPolarHBondContact NE2-CD1 3.42Å; H210-T369 HydrophobicContact CB-CG2 4.3Å; H210-I371 HydrophobicContact CB-CD1 4.36Å
211	F	97.4	Very high	95.6	Very high	12 Å²	12	62.6 Å²	62.6	5%	0.053	36%	0.357	C	S	.	.			trans	-94.9	120.5	177.8	-174.4	-119.5	0	0	0	110.7	A207 A208 R213 F215 A228 D312 I313 G340 V342	A207-F211 WeakPolarHBondContact O-CB 3.44Å; A207-F211 PolarHBondContact O-N 2.75Å; A208-F211 PolarHBondContact O-N 2.92Å; F211-R213 HydrophobicContact CD1-CB 4.16Å; F211-R213 VanDerWaalsContact CD1-O 3.26Å; F211-R213 WeakPolarHBondContact CD1-O 3.37Å; F211-R213 HydrophobicContact CE1-CB 3.6Å; F211-R213 HydrophobicContact CZ-CB 3.94Å; F211-R213 PolarHBondContact O-N 3.36Å; F211-F215 HydrophobicContact CB-CE2 4.47Å; F211-F215 HydrophobicContact CD1-CD2 4.22Å; F211-F215 AromaticContact CD1-CE2 3.99Å; F211-F215 HydrophobicContact CD1-CE2 3.99Å; F211-A228 HydrophobicContact CE1-CB 3.86Å; F211-A228 HydrophobicContact CZ-CB 4.5Å; F211-D312 HydrophobicContact CE1-CB 4.47Å; F211-D312 HydrophobicContact CE2-CB 3.73Å; F211-D312 HydrophobicContact CZ-CB 3.53Å; F211-I313 HydrophobicContact CB-CD1 4.22Å; F211-I313 HydrophobicContact CD1-CD1 4.17Å; F211-I313 HydrophobicContact CD2-CG1 4.39Å; F211-I313 HydrophobicContact CG-CD1 4.07Å; F211-I313 HydrophobicContact CG-CG1 4.43Å; F211-G340 WeakPolarHBondContact CD2-O 3.31Å; F211-V342 HydrophobicContact CB-CG2 3.92Å; F211-V342 HydrophobicContact CD2-CG2 4.25Å
212	G	94.3	Very high	95.2	Very high	83 Å²	83	62 Å²	62	86%	0.856	38%	0.376	S	S	*	.	S	Bend	trans	-75.4	11.6	-172.6	0	0	0	0	0	116.4
213	R	95.3	Very high	94.9	Very high	112 Å²	112	61.9 Å²	61.9	42%	0.423	39%	0.386	S	S	.	.	S	Bend	trans	-133.4	163.9	-177.3	-67.5	-174.7	-73.9	149.5	-4.3	111.4	F211 D312	F211-R213 HydrophobicContact CD1-CB 4.16Å; F211-R213 VanDerWaalsContact CD1-O 3.26Å; F211-R213 WeakPolarHBondContact CD1-O 3.37Å; F211-R213 HydrophobicContact CE1-CB 3.6Å; F211-R213 HydrophobicContact CZ-CB 3.94Å; F211-R213 PolarHBondContact O-N 3.36Å; R213-D312 IonicContact CZ-OD1 3.65Å; R213-D312 IonicContact NH1-OD1 2.84Å; R213-D312 VanDerWaalsContact NH2-CG 3.34Å; R213-D312 IonicContact NH2-OD1 3.24Å; R213-D312 PolarHBondContact NH2-OD1 2.99Å
214	F	95.9	Very high	94.7	Very high	132 Å²	132	69.7 Å²	69.7	58%	0.579	42%	0.42	S	S	*	.			trans	-67.6	143.3	176.6	-62.3	-49.3	0	0	0	112.5	V225	F214-V225 HydrophobicContact CD2-CG1 4.29Å
215	F	96.6	Very high	94.6	Very high	17 Å²	17	72.1 Å²	72.1	8%	0.075	44%	0.435	C	S	.	.	S	Bend	trans	-73.6	-47.2	166.7	-90.2	-130.4	0	0	0	110.8	V204 A208 F211 P227 A228 V230 M249 A251 I313	V204-F215 HydrophobicContact CG1-CE1 4.41Å; A208-F215 HydrophobicContact CB-CD2 4.23Å; A208-F215 HydrophobicContact CB-CE2 3.7Å; A208-F215 HydrophobicContact CB-CZ 3.88Å; F211-F215 HydrophobicContact CB-CE2 4.47Å; F211-F215 HydrophobicContact CD1-CD2 4.22Å; F211-F215 AromaticContact CD1-CE2 3.99Å; F211-F215 HydrophobicContact CD1-CE2 3.99Å; F215-P227 VanDerWaalsContact O-CA 3.28Å; F215-P227 WeakPolarHBondContact O-CA 3.25Å; F215-P227 WeakPolarHBondContact O-CB 3.42Å; F215-A228 HydrophobicContact CD2-CB 4.24Å; F215-A228 HydrophobicContact CG-CB 4.3Å; F215-A228 PolarHBondContact O-N 3.28Å; F215-V230 HydrophobicContact CE1-CG2 4.12Å; F215-M249 HydrophobicContact CB-CB 4.37Å; F215-M249 HydrophobicContact CD1-CB 4.19Å; F215-M249 HydrophobicContact CD1-CE 3.59Å; F215-M249 HydrophobicContact CE1-CE 3.55Å; F215-M249 HydrophobicContact CG-CE 4.38Å; F215-M249 HydrophobicContact CZ-CE 4.32Å; F215-A251 HydrophobicContact CB-CB 4.38Å; F215-A251 HydrophobicContact CD1-CB 3.7Å; F215-A251 HydrophobicContact CE1-CB 4.39Å; F215-A251 HydrophobicContact CG-CB 4.32Å; F215-I313 HydrophobicContact CE1-CD1 4.18Å; F215-I313 HydrophobicContact CE2-CD1 3.38Å; F215-I313 HydrophobicContact CZ-CD1 3.19Å
216	T	95.3	Very high	94.5	Very high	63 Å²	63	73.5 Å²	73.5	39%	0.387	44%	0.444	S	S	.	.	S	Bend	trans	-76.5	126.3	179.7	-37.2	0	0	0	0	110.9	Q218 M249	T216-Q218 HydrophobicContact CG2-CG 4.49Å; T216-M249 PolarHBondContact OG1-O 3.49Å
217	G	92.4	Very high	94.5	Very high	30 Å²	30	74.9 Å²	74.9	31%	0.309	45%	0.454	S	S	.	.			trans	-74.2	138.7	169.8	0	0	0	0	0	111.1	V225	G217-V225 CarbonylContact C-O 3.57Å; G217-V225 VanDerWaalsContact CA-O 3.22Å; G217-V225 WeakPolarHBondContact CA-O 3.31Å
218	Q	93.1	Very high	94.6	Very high	94 Å²	94	74.9 Å²	74.9	44%	0.439	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	146.7	-178.3	-59.2	179.1	22.5	0	0	110.3	T216 T220 V225	T216-Q218 HydrophobicContact CG2-CG 4.49Å; Q218-T220 HydrophobicContact CB-CG2 4.35Å; Q218-V225 PolarHBondContact N-O 3.5Å; Q218-V225 PolarHBondContact O-N 3.4Å
219	I	93.4	Very high	94.7	Very high	143 Å²	143	76.1 Å²	76.1	73%	0.733	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	117.8	168.9	-61.4	175	0	0	0	106.6	K224	I219-K224 HydrophobicContact CG1-CB 4.38Å; I219-K224 HydrophobicContact CG1-CD 4.4Å; I219-K224 HydrophobicContact CG1-CG 4.05Å
220	T	93.4	Very high	94.8	Very high	66 Å²	66	70.2 Å²	70.2	41%	0.405	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	170.4	178.3	72.2	0	0	0	0	109.7	Q218 A222 G223	Q218-T220 HydrophobicContact CB-CG2 4.35Å; T220-A222 PolarHBondContact O-N 3.35Å; T220-A222 VanDerWaalsContact O-N 3.16Å; T220-A222 PolarHBondContact OG1-N 3.15Å; T220-G223 PolarHBondContact N-O 2.99Å; T220-G223 PolarHBondContact O-N 3.14Å; T220-G223 PolarHBondContact OG1-O 3.41Å
221	A	90.3	Very high	94.9	Very high	120 Å²	120	67.1 Å²	67.1	99%	0.992	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-26.6	171.8	0	0	0	0	0	112.8	G223	A221-G223 VanDerWaalsContact C-N 3.27Å; A221-G223 PolarHBondContact O-N 2.96Å
222	A	89	Confident	94.9	Very high	103 Å²	103	66.5 Å²	66.5	85%	0.851	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	2.6	177.9	0	0	0	0	0	113.8	T220	T220-A222 PolarHBondContact O-N 3.35Å; T220-A222 VanDerWaalsContact O-N 3.16Å; T220-A222 PolarHBondContact OG1-N 3.15Å
223	G	92.2	Very high	94.9	Very high	36 Å²	36	62.7 Å²	62.7	37%	0.371	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	119.8	178	177.8	0	0	0	0	0	114	T220 A221	T220-G223 PolarHBondContact N-O 2.99Å; T220-G223 PolarHBondContact O-N 3.14Å; T220-G223 PolarHBondContact OG1-O 3.41Å; A221-G223 VanDerWaalsContact C-N 3.27Å; A221-G223 PolarHBondContact O-N 2.96Å
224	K	93.6	Very high	94.8	Very high	163 Å²	163	57.9 Å²	57.9	71%	0.709	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.1	179.3	179.7	175.2	-178.5	-180	0	110.1	I219	I219-K224 HydrophobicContact CG1-CB 4.38Å; I219-K224 HydrophobicContact CG1-CD 4.4Å; I219-K224 HydrophobicContact CG1-CG 4.05Å
225	V	95.1	Very high	94.5	Very high	53 Å²	53	51.6 Å²	51.6	32%	0.321	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	118.9	169.8	-176.3	0	0	0	0	108.2	F214 G217 Q218	F214-V225 HydrophobicContact CD2-CG1 4.29Å; G217-V225 CarbonylContact C-O 3.57Å; G217-V225 VanDerWaalsContact CA-O 3.22Å; G217-V225 WeakPolarHBondContact CA-O 3.31Å; Q218-V225 PolarHBondContact N-O 3.5Å; Q218-V225 PolarHBondContact O-N 3.4Å
226	P	95.6	Very high	94.2	Very high	76 Å²	76	52.1 Å²	52.1	49%	0.494	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-70.7	150.4	177.2	30.2	-34.3	0	0	0	111
227	P	96.9	Very high	94	Very high	45 Å²	45	52 Å²	52	29%	0.292	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-66.1	152.8	172.9	29	-34	0	0	0	111.2	F215 V252	F215-P227 VanDerWaalsContact O-CA 3.28Å; F215-P227 WeakPolarHBondContact O-CA 3.25Å; F215-P227 WeakPolarHBondContact O-CB 3.42Å; P227-V252 HydrophobicContact CB-CG2 4.3Å; P227-V252 HydrophobicContact CG-CG2 3.8Å
228	A	97.6	Very high	94	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.008	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-65.8	146.9	171.5	0	0	0	0	0	110.7	F211 F215 A251 V252	F211-A228 HydrophobicContact CE1-CB 3.86Å; F211-A228 HydrophobicContact CZ-CB 4.5Å; F215-A228 HydrophobicContact CD2-CB 4.24Å; F215-A228 HydrophobicContact CG-CB 4.3Å; F215-A228 PolarHBondContact O-N 3.28Å; A228-A251 HydrophobicContact CB-CB 4.44Å; A228-A251 WeakPolarHBondContact O-CB 3.48Å; A228-V252 PolarHBondContact O-N 3.38Å
229	K	98.3	Very high	94.1	Very high	59 Å²	59	46.7 Å²	46.7	26%	0.257	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119.3	174.5	-64.7	178.6	-176.3	179.8	0	110.1	V252 D310 V311 D312 I313	K229-V252 WeakPolarHBondContact CA-O 3.13Å; K229-V252 HydrophobicContact CG-CB 4.49Å; K229-D310 WeakPolarHBondContact CD-OD2 3.35Å; K229-D310 IonicContact NZ-OD1 2.6Å; K229-D310 PolarHBondContact NZ-OD1 2.84Å; K229-D310 IonicContact NZ-OD2 3.13Å; K229-D310 PolarHBondContact NZ-OD2 2.84Å; K229-V311 HydrophobicContact CB-CB 4.38Å; K229-V311 HydrophobicContact CB-CG1 4.36Å; K229-D312 PolarHBondContact N-OD2 2.87Å; K229-D312 PolarHBondContact O-N 3.26Å; K229-I313 PolarHBondContact O-N 3Å; K229-I313 VanDerWaalsContact O-N 3.13Å
230	V	98.3	Very high	94.2	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.006	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	123.6	-177.5	-173.6	0	0	0	0	109.6	F215 I232 A246 A251 V252 V253 R254 I313 I315	F215-V230 HydrophobicContact CE1-CG2 4.12Å; V230-I232 HydrophobicContact CG1-CG1 4.2Å; V230-A246 HydrophobicContact CB-CB 4.46Å; V230-A246 HydrophobicContact CG1-CB 4.4Å; V230-A246 HydrophobicContact CG2-CB 4.28Å; V230-A251 HydrophobicContact CG2-CB 3.86Å; V230-V252 PolarHBondContact N-O 3.36Å; V230-V253 WeakPolarHBondContact O-CA 3.22Å; V230-R254 PolarHBondContact O-N 3.31Å; V230-I313 WeakPolarHBondContact CA-O 3.49Å; V230-I313 HydrophobicContact CG1-CB 4.29Å; V230-I313 HydrophobicContact CG1-CG2 4.18Å; V230-I313 HydrophobicContact CG2-CB 4.19Å; V230-I313 HydrophobicContact CG2-CD1 4.36Å; V230-I315 HydrophobicContact CG1-CD1 4.28Å
231	L	98.1	Very high	94.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	129.5	172.4	-179	64.1	0	0	0	110.1	I233 R254 L274 Q307 V311 I313 I314 I315 F329	L231-I233 HydrophobicContact CD1-CD1 3.93Å; L231-I233 HydrophobicContact CD2-CD1 3.93Å; L231-I233 HydrophobicContact CD2-CG1 4.46Å; L231-I233 HydrophobicContact CG-CD1 3.73Å; L231-I233 HydrophobicContact CG-CG1 4.3Å; L231-R254 CarbonylContact C-O 3.55Å; L231-R254 WeakPolarHBondContact CA-O 3.4Å; L231-R254 HydrophobicContact CD1-CB 4.03Å; L231-L274 HydrophobicContact CD1-CD1 3.56Å; L231-Q307 HydrophobicContact CD2-CB 3.85Å; L231-V311 HydrophobicContact CB-CB 4.36Å; L231-V311 HydrophobicContact CB-CG1 4.16Å; L231-V311 HydrophobicContact CB-CG2 4.13Å; L231-I313 PolarHBondContact N-O 2.94Å; L231-I314 HydrophobicContact CB-CG1 4.31Å; L231-I314 HydrophobicContact CD2-CG1 4.41Å; L231-I314 WeakPolarHBondContact O-CA 3.34Å; L231-I315 PolarHBondContact O-N 3.04Å; L231-F329 HydrophobicContact CD2-CZ 4.29Å
232	I	97.8	Very high	94.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	121.9	178	-59.2	173.6	0	0	0	109.1	V230 A243 V253 R254 G255 F256 F266 I315	V230-I232 HydrophobicContact CG1-CG1 4.2Å; I232-A243 HydrophobicContact CD1-CB 3.68Å; I232-V253 HydrophobicContact CD1-CG1 3.64Å; I232-V253 HydrophobicContact CG1-CG1 4.28Å; I232-R254 PolarHBondContact N-O 3.3Å; I232-G255 WeakPolarHBondContact O-CA 3.37Å; I232-F256 PolarHBondContact O-N 3.37Å; I232-F266 HydrophobicContact CB-CE1 4.44Å; I232-F266 HydrophobicContact CB-CZ 4.49Å; I232-F266 HydrophobicContact CG2-CE1 4.21Å; I232-F266 HydrophobicContact CG2-CZ 4.08Å; I232-I315 WeakPolarHBondContact CA-O 3.29Å; I232-I315 HydrophobicContact CG1-CB 4.49Å
233	I	95.7	Very high	95	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.015	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	110.7	179.9	-55	-53.1	0	0	0	109.7	L231 F256 F304 I315 T316 T317 L328 F329	L231-I233 HydrophobicContact CD1-CD1 3.93Å; L231-I233 HydrophobicContact CD2-CD1 3.93Å; L231-I233 HydrophobicContact CD2-CG1 4.46Å; L231-I233 HydrophobicContact CG-CD1 3.73Å; L231-I233 HydrophobicContact CG-CG1 4.3Å; I233-F256 HydrophobicContact CD1-CB 3.93Å; I233-F304 HydrophobicContact CD1-CD1 3.92Å; I233-F304 HydrophobicContact CD1-CE1 3.4Å; I233-F304 HydrophobicContact CD1-CE2 4.45Å; I233-F304 HydrophobicContact CD1-CZ 3.71Å; I233-F304 HydrophobicContact CG1-CE1 4.41Å; I233-F304 HydrophobicContact CG1-CZ 4.33Å; I233-F304 HydrophobicContact CG2-CE2 4.2Å; I233-F304 HydrophobicContact CG2-CZ 3.9Å; I233-I315 PolarHBondContact N-O 3.27Å; I233-T316 HydrophobicContact CB-CG2 4.37Å; I233-T316 HydrophobicContact CG1-CG2 4.44Å; I233-T317 PolarHBondContact O-N 3.24Å; I233-T317 PolarHBondContact O-OG1 3.48Å; I233-L328 HydrophobicContact CG2-CD1 3.64Å; I233-F329 HydrophobicContact CD1-CZ 4.33Å; I233-F329 HydrophobicContact CG1-CE2 3.78Å; I233-F329 HydrophobicContact CG1-CZ 3.77Å
234	G	92.2	Very high	95.1	Very high	10 Å²	10	28.4 Å²	28.4	10%	0.103	17%	0.172	C	C	.	.			trans	102.3	116.2	-174.1	0	0	0	0	0	112	G236 G239 F256 T317	G234-G236 VanDerWaalsContact C-N 3.3Å; G234-G236 PolarHBondContact O-N 3Å; G234-G239 VanDerWaalsContact O-CA 3.31Å; G234-G239 WeakPolarHBondContact O-CA 3.29Å; G234-F256 WeakPolarHBondContact CA-O 3.43Å; G234-F256 PolarHBondContact N-O 3.01Å; G234-T317 PolarHBondContact O-OG1 3.48Å
235	G	89.3	Confident	95.3	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.01	14%	0.142	C	C	.	.			trans	-93.2	45.4	173.8	0	0	0	0	0	112.4	D257 R259 F266	G235-D257 WeakPolarHBondContact CA-OD2 3.42Å; G235-D257 PolarHBondContact N-OD2 3.23Å; G235-R259 PolarHBondContact O-NH2 2.93Å; G235-F266 VanDerWaalsContact CA-CE2 3.48Å; G235-F266 VanDerWaalsContact CA-CZ 3.44Å
236	G	89.8	Confident	95.4	Very high	27 Å²	27	18.6 Å²	18.6	28%	0.278	13%	0.127	S	C	.	.	S	Bend	trans	-81.7	-171.9	166.1	0	0	0	0	0	111.6	G234 A238 G239 L240	G234-G236 VanDerWaalsContact C-N 3.3Å; G234-G236 PolarHBondContact O-N 3Å; G236-A238 VanDerWaalsContact C-N 3.32Å; G236-A238 PolarHBondContact O-N 2.92Å; G236-G239 PolarHBondContact O-N 3.14Å; G236-G239 VanDerWaalsContact O-N 3.14Å; G236-L240 WeakPolarHBondContact O-CG 3.4Å; G236-L240 PolarHBondContact O-N 2.72Å
237	V	91.3	Very high	95.4	Very high	61 Å²	61	19.5 Å²	19.5	37%	0.37	12%	0.123	S	C	.	.	H	α-helix	trans	-56.9	-44.2	178.9	-178.9	0	0	0	0	112.1	S193 A196 N197 A241	S193-V237 WeakPolarHBondContact O-CG1 3.41Å; A196-V237 HydrophobicContact CB-CB 4.01Å; A196-V237 HydrophobicContact CB-CG1 4.18Å; N197-V237 HydrophobicContact CB-CG1 3.93Å; V237-A241 VanDerWaalsContact O-CB 3.29Å; V237-A241 WeakPolarHBondContact O-CB 3.27Å; V237-A241 PolarHBondContact O-N 2.9Å
238	A	93.5	Very high	95.3	Very high	13 Å²	13	22.1 Å²	22.1	11%	0.107	14%	0.142	C	C	.	.	H	α-helix	trans	-66	-39	177.3	0	0	0	0	0	112.8	A196 G200 G236 S242 T317 L346	A196-A238 HydrophobicContact CB-CB 4.08Å; A196-A238 VanDerWaalsContact O-CA 3.27Å; A196-A238 WeakPolarHBondContact O-CA 3.47Å; A196-A238 VanDerWaalsContact O-CB 3.27Å; A196-A238 WeakPolarHBondContact O-CB 3.15Å; G200-A238 WeakPolarHBondContact CA-O 3.23Å; G236-A238 VanDerWaalsContact C-N 3.32Å; G236-A238 PolarHBondContact O-N 2.92Å; A238-S242 WeakPolarHBondContact O-CB 3.33Å; A238-S242 PolarHBondContact O-N 3.48Å; A238-S242 PolarHBondContact O-OG 3.45Å; A238-T317 HydrophobicContact CB-CG2 4.31Å; A238-L346 HydrophobicContact CB-CD1 3.86Å
239	G	95.1	Very high	95.2	Very high	0 Å²	0	25 Å²	25	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66	-46.6	178	0	0	0	0	0	112.6	G234 G236 S242 A243	G234-G239 VanDerWaalsContact O-CA 3.31Å; G234-G239 WeakPolarHBondContact O-CA 3.29Å; G236-G239 PolarHBondContact O-N 3.14Å; G236-G239 VanDerWaalsContact O-N 3.14Å; G239-S242 WeakPolarHBondContact O-CB 3.38Å; G239-S242 PolarHBondContact O-N 2.94Å; G239-A243 WeakPolarHBondContact O-CB 3.49Å; G239-A243 PolarHBondContact O-N 3.41Å
240	L	94.8	Very high	95	Very high	37 Å²	37	23.7 Å²	23.7	19%	0.194	16%	0.16	C	C	.	.	H	α-helix	trans	-66	-39.2	177	-64.3	173.5	0	0	0	112	G236 S242 A243 G244 Q265 F266 L269	G236-L240 WeakPolarHBondContact O-CG 3.4Å; G236-L240 PolarHBondContact O-N 2.72Å; L240-S242 VanDerWaalsContact C-N 3.32Å; L240-S242 PolarHBondContact O-N 3.3Å; L240-A243 PolarHBondContact O-N 3.11Å; L240-G244 PolarHBondContact O-N 3.13Å; L240-Q265 HydrophobicContact CD1-CB 4.29Å; L240-Q265 HydrophobicContact CD2-CB 3.81Å; L240-F266 HydrophobicContact CD2-CD1 4.14Å; L240-F266 HydrophobicContact CD2-CE1 4.23Å; L240-L269 HydrophobicContact CB-CD1 4.03Å; L240-L269 HydrophobicContact CD2-CD1 3.74Å; L240-L269 HydrophobicContact CG-CD1 4.46Å
241	A	95.9	Very high	95	Very high	18 Å²	18	23.9 Å²	23.9	15%	0.149	16%	0.161	C	C	.	.	H	α-helix	trans	-61.3	-42.1	172.7	0	0	0	0	0	111.8	N197 V237 A245	N197-A241 VanDerWaalsContact OD1-CB 3.23Å; N197-A241 WeakPolarHBondContact OD1-CB 3.27Å; V237-A241 VanDerWaalsContact O-CB 3.29Å; V237-A241 WeakPolarHBondContact O-CB 3.27Å; V237-A241 PolarHBondContact O-N 2.9Å; A241-A245 VanDerWaalsContact O-CB 3.31Å; A241-A245 WeakPolarHBondContact O-CB 3.31Å; A241-A245 PolarHBondContact O-N 3.31Å
242	S	97.3	Very high	94.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.1	-41.2	174.8	-56.2	0	0	0	0	111.5	G200 V204 A238 G239 L240 A245 A246	G200-S242 WeakPolarHBondContact CA-OG 3.37Å; G200-S242 PolarHBondContact O-OG 3.47Å; V204-S242 WeakPolarHBondContact CG2-O 3.29Å; A238-S242 WeakPolarHBondContact O-CB 3.33Å; A238-S242 PolarHBondContact O-N 3.48Å; A238-S242 PolarHBondContact O-OG 3.45Å; G239-S242 WeakPolarHBondContact O-CB 3.38Å; G239-S242 PolarHBondContact O-N 2.94Å; L240-S242 VanDerWaalsContact C-N 3.32Å; L240-S242 PolarHBondContact O-N 3.3Å; S242-A245 PolarHBondContact O-N 2.86Å; S242-A246 VanDerWaalsContact O-CB 3.25Å; S242-A246 WeakPolarHBondContact O-CB 3.48Å; S242-A246 PolarHBondContact O-N 3.28Å
243	A	96.6	Very high	94.9	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.008	18%	0.178	C	C	.	.	H	α-helix	trans	-64.7	-48.3	179.3	0	0	0	0	0	111.3	I232 G239 L240 A245 A246 K247 V253 F266 L269	I232-A243 HydrophobicContact CD1-CB 3.68Å; G239-A243 WeakPolarHBondContact O-CB 3.49Å; G239-A243 PolarHBondContact O-N 3.41Å; L240-A243 PolarHBondContact O-N 3.11Å; A243-A245 PolarHBondContact O-N 2.73Å; A243-A246 PolarHBondContact O-N 2.82Å; A243-K247 WeakPolarHBondContact O-CB 3.41Å; A243-K247 PolarHBondContact O-N 2.93Å; A243-V253 HydrophobicContact CB-CG1 4.1Å; A243-F266 HydrophobicContact CB-CD1 4.01Å; A243-F266 HydrophobicContact CB-CE1 3.93Å; A243-L269 HydrophobicContact CB-CD1 4.29Å
244	G	95.4	Very high	95.1	Very high	28 Å²	28	28.1 Å²	28.1	29%	0.289	18%	0.183	S	C	.	.	H	α-helix	trans	-59.6	-46.1	176.3	0	0	0	0	0	112.4	L240 S248	L240-G244 PolarHBondContact O-N 3.13Å; G244-S248 WeakPolarHBondContact O-CB 3.2Å; G244-S248 PolarHBondContact O-N 3.48Å; G244-S248 PolarHBondContact O-OG 3.15Å
245	A	96.9	Very high	95.2	Very high	10 Å²	10	27.7 Å²	27.7	8%	0.083	18%	0.178	C	C	.	.	H	α-helix	trans	-67.2	-43.5	179.5	0	0	0	0	0	113	Y201 V204 A241 S242 A243 S248 M249	Y201-A245 HydrophobicContact CD2-CB 4.01Å; V204-A245 HydrophobicContact CB-CB 4.14Å; V204-A245 HydrophobicContact CG1-CB 3.94Å; V204-A245 HydrophobicContact CG2-CB 4.23Å; A241-A245 VanDerWaalsContact O-CB 3.31Å; A241-A245 WeakPolarHBondContact O-CB 3.31Å; A241-A245 PolarHBondContact O-N 3.31Å; S242-A245 PolarHBondContact O-N 2.86Å; A243-A245 PolarHBondContact O-N 2.73Å; A245-S248 PolarHBondContact O-OG 3.35Å; A245-M249 WeakPolarHBondContact O-CG 3.33Å; A245-M249 PolarHBondContact O-N 3.3Å
246	A	96.9	Very high	95.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-68.1	-39.5	178.4	0	0	0	0	0	111.5	V204 V230 S242 A243 M249 G250 A251 V253	V204-A246 HydrophobicContact CG1-CB 4.27Å; V204-A246 HydrophobicContact CG2-CB 4.32Å; V230-A246 HydrophobicContact CB-CB 4.46Å; V230-A246 HydrophobicContact CG1-CB 4.4Å; V230-A246 HydrophobicContact CG2-CB 4.28Å; S242-A246 VanDerWaalsContact O-CB 3.25Å; S242-A246 WeakPolarHBondContact O-CB 3.48Å; S242-A246 PolarHBondContact O-N 3.28Å; A243-A246 PolarHBondContact O-N 2.82Å; A246-M249 PolarHBondContact O-N 2.93Å; A246-G250 PolarHBondContact O-N 3.13Å; A246-A251 WeakPolarHBondContact O-CB 3.32Å; A246-A251 PolarHBondContact O-N 2.84Å; A246-A251 VanDerWaalsContact O-N 3.17Å; A246-V253 HydrophobicContact CB-CG2 3.71Å
247	K	96.1	Very high	95.6	Very high	94 Å²	94	27.2 Å²	27.2	41%	0.409	17%	0.169	S	C	.	.	H	α-helix	trans	-65.5	-44.2	177.8	-175.5	68.3	179.5	-166.3	0	111.9	A243 M249 G250 V253 G270	A243-K247 WeakPolarHBondContact O-CB 3.41Å; A243-K247 PolarHBondContact O-N 2.93Å; K247-M249 VanDerWaalsContact C-N 3.25Å; K247-M249 PolarHBondContact O-N 3.32Å; K247-G250 PolarHBondContact O-N 3.32Å; K247-V253 HydrophobicContact CB-CG2 4.1Å; K247-G270 WeakPolarHBondContact CE-O 3.4Å; K247-G270 PolarHBondContact NZ-O 3.41Å
248	S	94.8	Very high	95.5	Very high	101 Å²	101	25.7 Å²	25.7	71%	0.706	16%	0.16	S	C	*	.	H	α-helix	trans	-65.8	-28.5	178.7	67.7	0	0	0	0	112.7	G244 A245 G250	G244-S248 WeakPolarHBondContact O-CB 3.2Å; G244-S248 PolarHBondContact O-N 3.48Å; G244-S248 PolarHBondContact O-OG 3.15Å; A245-S248 PolarHBondContact O-OG 3.35Å; S248-G250 PolarHBondContact O-N 2.95Å
249	M	96	Very high	95.1	Very high	62 Å²	62	27.4 Å²	27.4	31%	0.305	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	2.4	170.7	-67.4	-168	-51.3	0	0	114.1	V204 A208 F215 T216 A245 A246 K247	V204-M249 HydrophobicContact CG1-CE 3.08Å; V204-M249 HydrophobicContact CG1-SD 4.5Å; A208-M249 HydrophobicContact CB-CE 4.42Å; F215-M249 HydrophobicContact CB-CB 4.37Å; F215-M249 HydrophobicContact CD1-CB 4.19Å; F215-M249 HydrophobicContact CD1-CE 3.59Å; F215-M249 HydrophobicContact CE1-CE 3.55Å; F215-M249 HydrophobicContact CG-CE 4.38Å; F215-M249 HydrophobicContact CZ-CE 4.32Å; T216-M249 PolarHBondContact OG1-O 3.49Å; A245-M249 WeakPolarHBondContact O-CG 3.33Å; A245-M249 PolarHBondContact O-N 3.3Å; A246-M249 PolarHBondContact O-N 2.93Å; K247-M249 VanDerWaalsContact C-N 3.25Å; K247-M249 PolarHBondContact O-N 3.32Å
250	G	94.2	Very high	94.6	Very high	31 Å²	31	30.6 Å²	30.6	32%	0.32	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	86	14.8	172.6	0	0	0	0	0	115.6	A246 K247 S248	A246-G250 PolarHBondContact O-N 3.13Å; K247-G250 PolarHBondContact O-N 3.32Å; S248-G250 PolarHBondContact O-N 2.95Å
251	A	97.1	Very high	94	Very high	4 Å²	4	31.4 Å²	31.4	3%	0.033	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-79	157.9	171.8	0	0	0	0	0	112.1	F215 A228 V230 A246	F215-A251 HydrophobicContact CB-CB 4.38Å; F215-A251 HydrophobicContact CD1-CB 3.7Å; F215-A251 HydrophobicContact CE1-CB 4.39Å; F215-A251 HydrophobicContact CG-CB 4.32Å; A228-A251 HydrophobicContact CB-CB 4.44Å; A228-A251 WeakPolarHBondContact O-CB 3.48Å; V230-A251 HydrophobicContact CG2-CB 3.86Å; A246-A251 WeakPolarHBondContact O-CB 3.32Å; A246-A251 PolarHBondContact O-N 2.84Å; A246-A251 VanDerWaalsContact O-N 3.17Å
252	V	97.1	Very high	93.6	Very high	55 Å²	55	30.6 Å²	30.6	33%	0.333	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	116.9	167.2	178.7	0	0	0	0	107.9	P227 A228 K229 V230	P227-V252 HydrophobicContact CB-CG2 4.3Å; P227-V252 HydrophobicContact CG-CG2 3.8Å; A228-V252 PolarHBondContact O-N 3.38Å; K229-V252 WeakPolarHBondContact CA-O 3.13Å; K229-V252 HydrophobicContact CG-CB 4.49Å; V230-V252 PolarHBondContact N-O 3.36Å
253	V	97.9	Very high	93.2	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	129.4	-178	-175.3	0	0	0	0	109.9	V230 I232 A243 A246 K247 A271 E272	V230-V253 WeakPolarHBondContact O-CA 3.22Å; I232-V253 HydrophobicContact CD1-CG1 3.64Å; I232-V253 HydrophobicContact CG1-CG1 4.28Å; A243-V253 HydrophobicContact CB-CG1 4.1Å; A246-V253 HydrophobicContact CB-CG2 3.71Å; K247-V253 HydrophobicContact CB-CG2 4.1Å; V253-A271 HydrophobicContact CB-CB 3.9Å; V253-A271 HydrophobicContact CG1-CB 3.73Å; V253-A271 CarbonylContact O-C 3.59Å; V253-A271 WeakPolarHBondContact O-CA 3.45Å; V253-E272 PolarHBondContact O-N 3.18Å
254	R	97.9	Very high	92.8	Very high	35 Å²	35	38.9 Å²	38.9	13%	0.132	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129.7	169.5	-60.8	-178.1	174.4	147.9	8	108.3	V230 L231 I232 E272 L274 D310	V230-R254 PolarHBondContact O-N 3.31Å; L231-R254 CarbonylContact C-O 3.55Å; L231-R254 WeakPolarHBondContact CA-O 3.4Å; L231-R254 HydrophobicContact CD1-CB 4.03Å; I232-R254 PolarHBondContact N-O 3.3Å; R254-E272 CarbonylContact C-O 3.56Å; R254-E272 WeakPolarHBondContact CA-O 3.21Å; R254-E272 HydrophobicContact CG-CB 4.18Å; R254-E272 WeakPolarHBondContact CG-OE2 3.31Å; R254-E272 IonicContact NE-OE2 3.61Å; R254-E272 PolarHBondContact NE-OE2 2.81Å; R254-E272 VanDerWaalsContact NE-OE2 3.07Å; R254-L274 HydrophobicContact CB-CD1 4.14Å; R254-L274 HydrophobicContact CB-CD2 4.49Å; R254-L274 HydrophobicContact CB-CG 4.28Å; R254-D310 IonicContact CZ-OD2 2.65Å; R254-D310 IonicContact NH1-OD2 3.49Å; R254-D310 PolarHBondContact NH1-OD2 2.87Å; R254-D310 IonicContact NH2-OD2 3.04Å; R254-D310 PolarHBondContact NH2-OD2 2.68Å
255	G	96.1	Very high	92.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	141.1	-176.9	0	0	0	0	0	111.3	I232 E272 P273 L274	I232-G255 WeakPolarHBondContact O-CA 3.37Å; G255-E272 PolarHBondContact N-O 3.41Å; G255-P273 WeakPolarHBondContact O-CA 3.35Å; G255-L274 PolarHBondContact O-N 2.87Å
256	F	95	Very high	92.3	Very high	5 Å²	5	41.3 Å²	41.3	2%	0.022	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	136.9	171.8	-179.7	-95.4	0	0	0	110.5	I232 I233 G234 T258 L274 V276 F296 E300 L303 F304	I232-F256 PolarHBondContact O-N 3.37Å; I233-F256 HydrophobicContact CD1-CB 3.93Å; G234-F256 WeakPolarHBondContact CA-O 3.43Å; G234-F256 PolarHBondContact N-O 3.01Å; F256-T258 HydrophobicContact CE1-CG2 4.22Å; F256-T258 HydrophobicContact CZ-CG2 4.48Å; F256-L274 HydrophobicContact CB-CB 4.28Å; F256-L274 HydrophobicContact CD2-CB 4.09Å; F256-L274 VanDerWaalsContact CD2-O 3.29Å; F256-L274 WeakPolarHBondContact CD2-O 3.37Å; F256-V276 HydrophobicContact CE2-CG2 3.64Å; F256-V276 HydrophobicContact CZ-CG2 3.82Å; F256-F296 HydrophobicContact CZ-CE1 4.35Å; F256-F296 HydrophobicContact CZ-CZ 4.19Å; F256-E300 HydrophobicContact CE1-CG 3.88Å; F256-E300 WeakPolarHBondContact CE1-OE1 3.4Å; F256-E300 HydrophobicContact CZ-CG 4.14Å; F256-L303 HydrophobicContact CD2-CD2 4.04Å; F256-L303 HydrophobicContact CE2-CD2 4.17Å; F256-F304 HydrophobicContact CB-CE1 4.13Å; F256-F304 AromaticContact CD1-CE1 3.64Å; F256-F304 HydrophobicContact CD1-CE1 3.64Å; F256-F304 AromaticContact CD1-CZ 3.44Å; F256-F304 HydrophobicContact CD1-CZ 3.44Å; F256-F304 VanDerWaalsContact CD1-CZ 3.44Å; F256-F304 HydrophobicContact CE1-CE1 4.2Å; F256-F304 AromaticContact CE1-CZ 3.79Å; F256-F304 HydrophobicContact CE1-CZ 3.79Å; F256-F304 AromaticContact CG-CE1 3.81Å; F256-F304 HydrophobicContact CG-CE1 3.81Å; F256-F304 HydrophobicContact CG-CZ 4.11Å
257	D	92.3	Very high	92.1	Very high	13 Å²	13	48.5 Å²	48.5	7%	0.07	27%	0.268	C	S	.	.			trans	-150.1	150.7	169.2	-166.3	-70	0	0	0	108.2	G235 R259 A262 F266	G235-D257 WeakPolarHBondContact CA-OD2 3.42Å; G235-D257 PolarHBondContact N-OD2 3.23Å; D257-R259 PolarHBondContact O-N 3.4Å; D257-R259 VanDerWaalsContact OD1-CB 3.28Å; D257-R259 WeakPolarHBondContact OD1-CB 3.38Å; D257-R259 WeakPolarHBondContact OD1-CG 3.15Å; D257-R259 IonicContact OD1-CZ 2.79Å; D257-R259 PolarHBondContact OD1-N 3.23Å; D257-R259 IonicContact OD1-NE 3.75Å; D257-R259 PolarHBondContact OD1-NE 3.48Å; D257-R259 IonicContact OD1-NH2 3.83Å; D257-R259 IonicContact OD2-CZ 2.7Å; D257-R259 IonicContact OD2-NE 3.8Å; D257-R259 IonicContact OD2-NH2 3.69Å; D257-R259 PolarHBondContact OD2-NH2 3.2Å; D257-A262 HydrophobicContact CB-CB 3.62Å; D257-A262 VanDerWaalsContact CG-CB 3.48Å; D257-F266 HydrophobicContact CB-CE2 4.32Å
258	T	87.6	Confident	91.7	Very high	30 Å²	30	48.7 Å²	48.7	18%	0.184	28%	0.281	C	S	.	.	S	Bend	trans	-75.3	-12.6	178.6	57.8	0	0	0	0	113.1	F256 G282 M292 F296	F256-T258 HydrophobicContact CE1-CG2 4.22Å; F256-T258 HydrophobicContact CZ-CG2 4.48Å; T258-G282 PolarHBondContact O-N 3.38Å; T258-M292 HydrophobicContact CG2-CG 4.11Å; T258-F296 HydrophobicContact CG2-CE1 3.77Å; T258-F296 HydrophobicContact CG2-CZ 4.14Å
259	R	85.9	Confident	91.5	Very high	49 Å²	49	47.2 Å²	47.2	19%	0.185	27%	0.265	C	S	.	.	S	Bend	trans	-97.9	129.9	-180	-58	167.7	-64.8	149.4	10.8	110.9	G235 D257 A261 A262 L263 G287	G235-R259 PolarHBondContact O-NH2 2.93Å; D257-R259 PolarHBondContact O-N 3.4Å; D257-R259 VanDerWaalsContact OD1-CB 3.28Å; D257-R259 WeakPolarHBondContact OD1-CB 3.38Å; D257-R259 WeakPolarHBondContact OD1-CG 3.15Å; D257-R259 IonicContact OD1-CZ 2.79Å; D257-R259 PolarHBondContact OD1-N 3.23Å; D257-R259 IonicContact OD1-NE 3.75Å; D257-R259 PolarHBondContact OD1-NE 3.48Å; D257-R259 IonicContact OD1-NH2 3.83Å; D257-R259 IonicContact OD2-CZ 2.7Å; D257-R259 IonicContact OD2-NE 3.8Å; D257-R259 IonicContact OD2-NH2 3.69Å; D257-R259 PolarHBondContact OD2-NH2 3.2Å; R259-A261 VanDerWaalsContact C-N 3.32Å; R259-A261 PolarHBondContact O-N 2.83Å; R259-A262 HydrophobicContact CB-CB 4.3Å; R259-A262 PolarHBondContact O-N 3.06Å; R259-A262 VanDerWaalsContact O-N 3.14Å; R259-L263 PolarHBondContact O-N 2.92Å; R259-G287 PolarHBondContact NH1-O 3.2Å
260	A	83.9	Confident	91.2	Very high	67 Å²	67	46 Å²	46	55%	0.554	27%	0.269	S	S	*	.	H	α-helix	trans	-59	-41.2	178.9	0	0	0	0	0	112.9	A262 L263 E264	A260-A262 VanDerWaalsContact C-N 3.27Å; A260-A262 PolarHBondContact O-N 3.08Å; A260-L263 PolarHBondContact O-N 3.38Å; A260-L263 VanDerWaalsContact O-N 3.16Å; A260-E264 PolarHBondContact O-N 3.33Å; A260-E264 VanDerWaalsContact O-N 3.13Å
261	A	83.6	Confident	91.2	Very high	53 Å²	53	44.9 Å²	44.9	44%	0.438	26%	0.256	S	S	.	.	H	α-helix	trans	-60.1	-34.6	178.4	0	0	0	0	0	113.1	R259 E264 Q265	R259-A261 VanDerWaalsContact C-N 3.32Å; R259-A261 PolarHBondContact O-N 2.83Å; A261-E264 PolarHBondContact O-N 3.17Å; A261-Q265 WeakPolarHBondContact O-CG 3.43Å; A261-Q265 PolarHBondContact O-N 3.04Å; A261-Q265 VanDerWaalsContact O-N 3.15Å
262	A	87.1	Confident	91.1	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-73.7	-32.7	178.5	0	0	0	0	0	112.2	D257 R259 A260 Q265 F266	D257-A262 HydrophobicContact CB-CB 3.62Å; D257-A262 VanDerWaalsContact CG-CB 3.48Å; R259-A262 HydrophobicContact CB-CB 4.3Å; R259-A262 PolarHBondContact O-N 3.06Å; R259-A262 VanDerWaalsContact O-N 3.14Å; A260-A262 VanDerWaalsContact C-N 3.27Å; A260-A262 PolarHBondContact O-N 3.08Å; A262-Q265 WeakPolarHBondContact O-CB 3.33Å; A262-Q265 PolarHBondContact O-N 3.23Å; A262-F266 VanDerWaalsContact O-CD2 3.32Å; A262-F266 WeakPolarHBondContact O-CD2 3.34Å; A262-F266 PolarHBondContact O-N 3.36Å
263	L	89.3	Confident	91	Very high	27 Å²	27	48.8 Å²	48.8	14%	0.141	27%	0.274	C	S	.	.	H	α-helix	trans	-66.6	-39	172.9	-63.7	177.1	0	0	0	111.8	R259 A260 Q265 F266 K267 P273 E275	R259-L263 PolarHBondContact O-N 2.92Å; A260-L263 PolarHBondContact O-N 3.38Å; A260-L263 VanDerWaalsContact O-N 3.16Å; L263-Q265 VanDerWaalsContact C-N 3.31Å; L263-Q265 PolarHBondContact O-N 3.41Å; L263-F266 HydrophobicContact CD2-CD2 4.45Å; L263-F266 PolarHBondContact O-N 3Å; L263-K267 PolarHBondContact O-N 3.22Å; L263-P273 HydrophobicContact CB-CB 4.02Å; L263-P273 HydrophobicContact CD2-CB 3.99Å; L263-E275 HydrophobicContact CD1-CG 4.43Å
264	E	87.8	Confident	90.8	Very high	148 Å²	148	49.2 Å²	49.2	69%	0.692	28%	0.276	S	S	*	.	H	α-helix	trans	-62.3	-39.9	173	-167.3	180	-179.5	0	0	111.5	A260 A261 K267 S268	A260-E264 PolarHBondContact O-N 3.33Å; A260-E264 VanDerWaalsContact O-N 3.13Å; A261-E264 PolarHBondContact O-N 3.17Å; E264-K267 WeakPolarHBondContact O-CB 3.41Å; E264-K267 PolarHBondContact O-N 3.47Å; E264-S268 PolarHBondContact O-N 2.91Å
265	Q	89.7	Confident	90.4	Very high	89 Å²	89	54.3 Å²	54.3	42%	0.416	30%	0.301	S	S	.	.	H	α-helix	trans	-65.8	-38.4	173.9	-70.6	172.3	-18.1	0	0	113	L240 A261 A262 L263 K267 S268 L269	L240-Q265 HydrophobicContact CD1-CB 4.29Å; L240-Q265 HydrophobicContact CD2-CB 3.81Å; A261-Q265 WeakPolarHBondContact O-CG 3.43Å; A261-Q265 PolarHBondContact O-N 3.04Å; A261-Q265 VanDerWaalsContact O-N 3.15Å; A262-Q265 WeakPolarHBondContact O-CB 3.33Å; A262-Q265 PolarHBondContact O-N 3.23Å; L263-Q265 VanDerWaalsContact C-N 3.31Å; L263-Q265 PolarHBondContact O-N 3.41Å; Q265-K267 VanDerWaalsContact C-N 3.32Å; Q265-K267 PolarHBondContact O-N 2.96Å; Q265-S268 PolarHBondContact O-N 3.32Å; Q265-S268 PolarHBondContact O-OG 2.84Å; Q265-L269 WeakPolarHBondContact O-CG 3.26Å; Q265-L269 PolarHBondContact O-N 2.82Å
266	F	91.9	Very high	89.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-61.6	-43.3	172	-82	-55	0	0	0	111.5	I232 G235 L240 A243 D257 A262 L263 S268 L269 G270 A271	I232-F266 HydrophobicContact CB-CE1 4.44Å; I232-F266 HydrophobicContact CB-CZ 4.49Å; I232-F266 HydrophobicContact CG2-CE1 4.21Å; I232-F266 HydrophobicContact CG2-CZ 4.08Å; G235-F266 VanDerWaalsContact CA-CE2 3.48Å; G235-F266 VanDerWaalsContact CA-CZ 3.44Å; L240-F266 HydrophobicContact CD2-CD1 4.14Å; L240-F266 HydrophobicContact CD2-CE1 4.23Å; A243-F266 HydrophobicContact CB-CD1 4.01Å; A243-F266 HydrophobicContact CB-CE1 3.93Å; D257-F266 HydrophobicContact CB-CE2 4.32Å; A262-F266 VanDerWaalsContact O-CD2 3.32Å; A262-F266 WeakPolarHBondContact O-CD2 3.34Å; A262-F266 PolarHBondContact O-N 3.36Å; L263-F266 HydrophobicContact CD2-CD2 4.45Å; L263-F266 PolarHBondContact O-N 3Å; F266-S268 PolarHBondContact O-N 2.99Å; F266-L269 PolarHBondContact O-N 3.43Å; F266-G270 PolarHBondContact O-N 3.49Å; F266-A271 HydrophobicContact CB-CB 4.17Å; F266-A271 HydrophobicContact CD1-CB 4.22Å; F266-A271 WeakPolarHBondContact O-CB 3.45Å; F266-A271 PolarHBondContact O-N 2.95Å
267	K	92.3	Very high	89	Confident	152 Å²	152	63.5 Å²	63.5	66%	0.661	35%	0.351	S	S	*	.	H	α-helix	trans	-62.9	-41	178.2	-171	177.3	-179.7	179.6	0	112	L263 E264 Q265 L269 G270 P273	L263-K267 PolarHBondContact O-N 3.22Å; E264-K267 WeakPolarHBondContact O-CB 3.41Å; E264-K267 PolarHBondContact O-N 3.47Å; Q265-K267 VanDerWaalsContact C-N 3.32Å; Q265-K267 PolarHBondContact O-N 2.96Å; K267-L269 VanDerWaalsContact C-N 3.27Å; K267-L269 PolarHBondContact O-N 3.19Å; K267-G270 PolarHBondContact O-N 3.19Å; K267-P273 HydrophobicContact CB-CG 4.38Å
268	S	88.9	Confident	88.3	Confident	97 Å²	97	66.3 Å²	66.3	68%	0.678	37%	0.366	S	S	*	.	H	α-helix	trans	-66.4	-29.1	177.6	72.5	0	0	0	0	113	E264 Q265 F266 G270	E264-S268 PolarHBondContact O-N 2.91Å; Q265-S268 PolarHBondContact O-N 3.32Å; Q265-S268 PolarHBondContact O-OG 2.84Å; F266-S268 PolarHBondContact O-N 2.99Å; S268-G270 PolarHBondContact O-N 2.9Å
269	L	90.1	Very high	87.5	Confident	70 Å²	70	75 Å²	75	37%	0.366	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	1.9	171.1	-66.4	176.3	0	0	0	113.7	L240 A243 Q265 F266 K267 A271	L240-L269 HydrophobicContact CB-CD1 4.03Å; L240-L269 HydrophobicContact CD2-CD1 3.74Å; L240-L269 HydrophobicContact CG-CD1 4.46Å; A243-L269 HydrophobicContact CB-CD1 4.29Å; Q265-L269 WeakPolarHBondContact O-CG 3.26Å; Q265-L269 PolarHBondContact O-N 2.82Å; F266-L269 PolarHBondContact O-N 3.43Å; K267-L269 VanDerWaalsContact C-N 3.27Å; K267-L269 PolarHBondContact O-N 3.19Å; L269-A271 VanDerWaalsContact C-N 3.34Å
270	G	89.9	Confident	87.2	Confident	38 Å²	38	75.5 Å²	75.5	39%	0.392	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	21.4	179.6	0	0	0	0	0	114.5	K247 F266 K267 S268	K247-G270 WeakPolarHBondContact CE-O 3.4Å; K247-G270 PolarHBondContact NZ-O 3.41Å; F266-G270 PolarHBondContact O-N 3.49Å; K267-G270 PolarHBondContact O-N 3.19Å; S268-G270 PolarHBondContact O-N 2.9Å
271	A	94.3	Very high	86.8	Confident	7 Å²	7	75.5 Å²	75.5	6%	0.058	40%	0.401	C	S	.	.			trans	-88.1	152.6	167	0	0	0	0	0	110.8	V253 F266 L269 P273	V253-A271 HydrophobicContact CB-CB 3.9Å; V253-A271 HydrophobicContact CG1-CB 3.73Å; V253-A271 CarbonylContact O-C 3.59Å; V253-A271 WeakPolarHBondContact O-CA 3.45Å; F266-A271 HydrophobicContact CB-CB 4.17Å; F266-A271 HydrophobicContact CD1-CB 4.22Å; F266-A271 WeakPolarHBondContact O-CB 3.45Å; F266-A271 PolarHBondContact O-N 2.95Å; L269-A271 VanDerWaalsContact C-N 3.34Å; A271-P273 VanDerWaalsContact O-CD 3.27Å; A271-P273 WeakPolarHBondContact O-CD 3.32Å
272	E	95.4	Very high	86.1	Confident	99 Å²	99	73 Å²	73	46%	0.463	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	112	173.9	-178.4	-176.9	-177.1	0	0	109.2	V253 R254 G255 L274	V253-E272 PolarHBondContact O-N 3.18Å; R254-E272 CarbonylContact C-O 3.56Å; R254-E272 WeakPolarHBondContact CA-O 3.21Å; R254-E272 HydrophobicContact CG-CB 4.18Å; R254-E272 WeakPolarHBondContact CG-OE2 3.31Å; R254-E272 IonicContact NE-OE2 3.61Å; R254-E272 PolarHBondContact NE-OE2 2.81Å; R254-E272 VanDerWaalsContact NE-OE2 3.07Å; G255-E272 PolarHBondContact N-O 3.41Å; E272-L274 PolarHBondContact O-N 3.14Å
273	P	94.6	Very high	85.3	Confident	42 Å²	42	78.4 Å²	78.4	27%	0.273	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	126.8	174.4	30	-32.7	0	0	0	109.5	G255 L263 K267 A271	G255-P273 WeakPolarHBondContact O-CA 3.35Å; L263-P273 HydrophobicContact CB-CB 4.02Å; L263-P273 HydrophobicContact CD2-CB 3.99Å; K267-P273 HydrophobicContact CB-CG 4.38Å; A271-P273 VanDerWaalsContact O-CD 3.27Å; A271-P273 WeakPolarHBondContact O-CD 3.32Å
274	L	93.5	Very high	84.2	Confident	12 Å²	12	78.5 Å²	78.5	6%	0.063	41%	0.413	C	S	.	.			trans	-91.5	141.2	174.3	-60.2	179.6	0	0	0	110	L231 R254 G255 F256 E272 L303 Q307	L231-L274 HydrophobicContact CD1-CD1 3.56Å; R254-L274 HydrophobicContact CB-CD1 4.14Å; R254-L274 HydrophobicContact CB-CD2 4.49Å; R254-L274 HydrophobicContact CB-CG 4.28Å; G255-L274 PolarHBondContact O-N 2.87Å; F256-L274 HydrophobicContact CB-CB 4.28Å; F256-L274 HydrophobicContact CD2-CB 4.09Å; F256-L274 VanDerWaalsContact CD2-O 3.29Å; F256-L274 WeakPolarHBondContact CD2-O 3.37Å; E272-L274 PolarHBondContact O-N 3.14Å; L274-L303 HydrophobicContact CB-CD2 4.23Å; L274-Q307 HydrophobicContact CD1-CG 3.93Å
275	E	88.6	Confident	82.9	Confident	141 Å²	141	80.1 Å²	80.1	66%	0.659	42%	0.421	S	S	*	.			trans	-122.6	153.6	178.4	-65.4	-176.7	-174.2	0	0	110.5	L263	L263-E275 HydrophobicContact CD1-CG 4.43Å
276	V	86.6	Confident	81.5	Confident	21 Å²	21	78.8 Å²	78.8	13%	0.127	43%	0.431	C	S	.	.			trans	-103.6	143.8	173.8	177.5	0	0	0	0	108.3	F256 L278 F296 A299 E300 L303	F256-V276 HydrophobicContact CE2-CG2 3.64Å; F256-V276 HydrophobicContact CZ-CG2 3.82Å; V276-L278 HydrophobicContact CG1-CB 4.3Å; V276-L278 PolarHBondContact O-N 3.47Å; V276-F296 HydrophobicContact CB-CE2 4.36Å; V276-F296 HydrophobicContact CG2-CZ 4.44Å; V276-A299 HydrophobicContact CG1-CB 3.39Å; V276-E300 HydrophobicContact CG2-CB 4.37Å; V276-L303 HydrophobicContact CG2-CD2 3.81Å
277	D	75.3	Confident	80.1	Confident	178 Å²	178	81.1 Å²	81.1	95%	0.952	46%	0.455	S	S	*	.	S	Bend	trans	-64.6	-3.7	-178.1	-70.5	-36.1	0	0	0	114.3
278	L	77.4	Confident	78.9	Confident	71 Å²	71	77.8 Å²	77.8	37%	0.372	44%	0.439	S	S	.	.	S	Bend	trans	-107.5	112	178.7	-159.1	99	0	0	0	110.4	V276 E280 E295 F296	V276-L278 HydrophobicContact CG1-CB 4.3Å; V276-L278 PolarHBondContact O-N 3.47Å; L278-E280 PolarHBondContact O-N 3.18Å; L278-E280 VanDerWaalsContact O-N 3.13Å; L278-E295 HydrophobicContact CD2-CB 4.47Å; L278-F296 HydrophobicContact CB-CD2 4.47Å; L278-F296 HydrophobicContact CD2-CB 3.93Å; L278-F296 HydrophobicContact CD2-CD2 4.17Å
279	K	72.2	Confident	78.1	Confident	214 Å²	214	74.9 Å²	74.9	93%	0.93	42%	0.421	S	S	*	.			trans	-82.4	89.5	178.5	-71.4	-172.9	178.1	-178.4	0	111.5
280	E	79.6	Confident	77.4	Confident	59 Å²	59	75.8 Å²	75.8	28%	0.276	42%	0.422	S	S	.	.			trans	-117.3	137.4	167.3	-172.5	-176.3	169	0	0	109.5	L278 G282 M292 S293 F296	L278-E280 PolarHBondContact O-N 3.18Å; L278-E280 VanDerWaalsContact O-N 3.13Å; E280-G282 PolarHBondContact O-N 3.37Å; E280-M292 HydrophobicContact CB-CE 3.79Å; E280-M292 HydrophobicContact CG-CE 3.73Å; E280-S293 VanDerWaalsContact OE2-CB 3.23Å; E280-S293 WeakPolarHBondContact OE2-CB 3.42Å; E280-S293 PolarHBondContact OE2-N 3.41Å; E280-S293 PolarHBondContact OE2-OG 2.63Å; E280-F296 HydrophobicContact CB-CD2 4.02Å
281	S	74	Confident	76.8	Confident	66 Å²	66	80.2 Å²	80.2	46%	0.462	43%	0.432	S	S	.	.			trans	-75.7	120.7	174.7	172.8	0	0	0	0	110.6	E283 K290	S281-E283 VanDerWaalsContact C-N 3.35Å; S281-E283 PolarHBondContact OG-N 3.01Å; S281-K290 WeakPolarHBondContact O-CE 3.21Å; S281-K290 PolarHBondContact O-NZ 2.97Å
282	G	69.5	Low	76.2	Confident	1 Å²	1	80.9 Å²	80.9	1%	0.01	44%	0.435	C	S	.	.			trans	-87.4	5.7	173.4	0	0	0	0	0	115.3	T258 E280 G284 A289 K290 M292	T258-G282 PolarHBondContact O-N 3.38Å; E280-G282 PolarHBondContact O-N 3.37Å; G282-G284 PolarHBondContact O-N 3.19Å; G282-A289 WeakPolarHBondContact O-CA 3.31Å; G282-K290 PolarHBondContact O-N 3.15Å; G282-M292 WeakPolarHBondContact CA-SD 3.45Å
283	E	71	Confident	75.6	Confident	114 Å²	114	77.8 Å²	77.8	53%	0.533	42%	0.424	S	S	.	.	B	Isolated β-bridge	trans	-70.3	126.3	-178.5	-64.6	-178	170.1	0	0	111.9	S281	S281-E283 VanDerWaalsContact C-N 3.35Å; S281-E283 PolarHBondContact OG-N 3.01Å
284	G	65.4	Low	75.1	Confident	29 Å²	29	84.1 Å²	84.1	30%	0.299	45%	0.447	S	S	.	.			trans	-112.1	-179	170.6	0	0	0	0	0	112.2	G282 Y288	G282-G284 PolarHBondContact O-N 3.19Å; G284-Y288 CarbonylContact C-O 3.59Å; G284-Y288 WeakPolarHBondContact CA-O 3.47Å; G284-Y288 PolarHBondContact N-O 3.48Å
285	Q	60.8	Low	74.7	Confident	183 Å²	183	89.3 Å²	89.3	86%	0.855	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-68.9	143.8	178.8	-71.6	-176.8	-3.9	0	0	111.9	G287 Y288	Q285-G287 VanDerWaalsContact C-N 3.28Å; Q285-G287 PolarHBondContact O-N 3.16Å; Q285-Y288 PolarHBondContact O-N 2.66Å
286	G	59.6	Low	74.6	Confident	61 Å²	61	83 Å²	83	63%	0.629	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	68	20.9	176.3	0	0	0	0	0	115.1	Y288	G286-Y288 VanDerWaalsContact C-N 3.29Å; G286-Y288 PolarHBondContact O-N 2.84Å
287	G	63.1	Low	74.5	Confident	48 Å²	48	85 Å²	85	50%	0.495	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	80	5.4	-179.7	0	0	0	0	0	114.8	R259 Q285	R259-G287 PolarHBondContact NH1-O 3.2Å; Q285-G287 VanDerWaalsContact C-N 3.28Å; Q285-G287 PolarHBondContact O-N 3.16Å
288	Y	67.1	Low	75	Confident	82 Å²	82	83.7 Å²	83.7	32%	0.322	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-80	157.8	172	-70.3	-79.2	0	0	0	111.6	R182 G284 Q285 G286 P321	R182-Y288 PolarHBondContact NE-OH 2.94Å; R182-Y288 VanDerWaalsContact NE-OH 3.17Å; R182-Y288 VanDerWaalsContact NH1-CZ 3.3Å; R182-Y288 PolarHBondContact NH1-OH 3.4Å; R182-Y288 PolarHBondContact NH2-OH 2.79Å; G284-Y288 CarbonylContact C-O 3.59Å; G284-Y288 WeakPolarHBondContact CA-O 3.47Å; G284-Y288 PolarHBondContact N-O 3.48Å; Q285-Y288 PolarHBondContact O-N 2.66Å; G286-Y288 VanDerWaalsContact C-N 3.29Å; G286-Y288 PolarHBondContact O-N 2.84Å; Y288-P321 HydrophobicContact CD1-CG 4.04Å; Y288-P321 HydrophobicContact CE1-CG 3.55Å
289	A	71.5	Confident	75.5	Confident	37 Å²	37	81.8 Å²	81.8	31%	0.306	43%	0.433	S	S	.	.	B	Isolated β-bridge	trans	-78.1	145.7	170.1	0	0	0	0	0	110.5	G282	G282-A289 WeakPolarHBondContact O-CA 3.31Å
290	K	76.8	Confident	76.3	Confident	89 Å²	89	72.1 Å²	72.1	39%	0.387	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-89.6	166.1	166.3	72.4	178.8	-167.9	-163.6	0	110.6	S281 G282 M292	S281-K290 WeakPolarHBondContact O-CE 3.21Å; S281-K290 PolarHBondContact O-NZ 2.97Å; G282-K290 PolarHBondContact O-N 3.15Å; K290-M292 HydrophobicContact CG-SD 4.47Å
291	E	76.1	Confident	76.7	Confident	131 Å²	131	70.6 Å²	70.6	61%	0.612	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-70.1	128.9	171.6	-164.3	166.8	172.3	0	0	109.5	K323	E291-K323 IonicContact OE2-NZ 3.63Å; E291-K323 PolarHBondContact OE2-NZ 3.14Å
292	M	81.3	Confident	77.5	Confident	21 Å²	21	75.2 Å²	75.2	10%	0.103	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-87.2	162.5	-174.1	-60.2	-57.9	-70.5	0	0	112	T258 E280 G282 K290 F296 I297	T258-M292 HydrophobicContact CG2-CG 4.11Å; E280-M292 HydrophobicContact CB-CE 3.79Å; E280-M292 HydrophobicContact CG-CE 3.73Å; G282-M292 WeakPolarHBondContact CA-SD 3.45Å; K290-M292 HydrophobicContact CG-SD 4.47Å; M292-F296 HydrophobicContact CB-CB 4.11Å; M292-F296 HydrophobicContact CB-CD1 3.65Å; M292-F296 HydrophobicContact CB-CE1 4.42Å; M292-F296 HydrophobicContact CB-CG 4.07Å; M292-F296 HydrophobicContact CE-CB 4.37Å; M292-F296 HydrophobicContact CE-CD1 3.74Å; M292-F296 HydrophobicContact CE-CD2 3.62Å; M292-F296 HydrophobicContact CE-CE1 3.86Å; M292-F296 HydrophobicContact CE-CE2 3.73Å; M292-F296 HydrophobicContact CE-CG 3.62Å; M292-F296 HydrophobicContact CE-CZ 3.84Å; M292-F296 HydrophobicContact CG-CD1 3.72Å; M292-F296 HydrophobicContact CG-CE1 3.98Å; M292-F296 HydrophobicContact CG-CG 4.38Å; M292-I297 HydrophobicContact CB-CG1 4.26Å
293	S	84.1	Confident	78.7	Confident	33 Å²	33	76.6 Å²	76.6	23%	0.231	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-60.5	157	172.6	66.5	0	0	0	0	112.3	E280 E295 F296 I297	E280-S293 VanDerWaalsContact OE2-CB 3.23Å; E280-S293 WeakPolarHBondContact OE2-CB 3.42Å; E280-S293 PolarHBondContact OE2-N 3.41Å; E280-S293 PolarHBondContact OE2-OG 2.63Å; S293-E295 PolarHBondContact O-N 3.26Å; S293-F296 PolarHBondContact O-N 3.46Å; S293-F296 WeakPolarHBondContact OG-CB 3.49Å; S293-F296 PolarHBondContact OG-N 3.43Å; S293-I297 WeakPolarHBondContact O-CG1 3.42Å; S293-I297 PolarHBondContact O-N 3.18Å
294	K	84.2	Confident	79.8	Confident	175 Å²	175	71.2 Å²	71.2	76%	0.761	38%	0.378	S	S	*	.	H	α-helix	trans	-63.4	-36.8	179.5	-71.8	-173.8	178.5	-179.4	0	111.5	F296 I297 E298	K294-F296 VanDerWaalsContact C-N 3.34Å; K294-I297 PolarHBondContact O-N 3.23Å; K294-E298 PolarHBondContact O-N 2.93Å
295	E	84.1	Confident	81.1	Confident	122 Å²	122	70.9 Å²	70.9	57%	0.57	37%	0.372	S	S	*	.	H	α-helix	trans	-64.5	-39.6	178	-62.1	73	-162.2	0	0	111	L278 S293 A299	L278-E295 HydrophobicContact CD2-CB 4.47Å; S293-E295 PolarHBondContact O-N 3.26Å; E295-A299 WeakPolarHBondContact O-CB 3.37Å; E295-A299 PolarHBondContact O-N 2.95Å; E295-A299 VanDerWaalsContact O-N 3.12Å
296	F	86	Confident	82.7	Confident	9 Å²	9	69.4 Å²	69.4	4%	0.039	36%	0.363	C	S	.	.	H	α-helix	trans	-65.3	-46.6	173.9	-173.9	-83.1	0	0	0	111.4	F256 T258 V276 L278 E280 M292 S293 K294 E298 A299 E300	F256-F296 HydrophobicContact CZ-CE1 4.35Å; F256-F296 HydrophobicContact CZ-CZ 4.19Å; T258-F296 HydrophobicContact CG2-CE1 3.77Å; T258-F296 HydrophobicContact CG2-CZ 4.14Å; V276-F296 HydrophobicContact CB-CE2 4.36Å; V276-F296 HydrophobicContact CG2-CZ 4.44Å; L278-F296 HydrophobicContact CB-CD2 4.47Å; L278-F296 HydrophobicContact CD2-CB 3.93Å; L278-F296 HydrophobicContact CD2-CD2 4.17Å; E280-F296 HydrophobicContact CB-CD2 4.02Å; M292-F296 HydrophobicContact CB-CB 4.11Å; M292-F296 HydrophobicContact CB-CD1 3.65Å; M292-F296 HydrophobicContact CB-CE1 4.42Å; M292-F296 HydrophobicContact CB-CG 4.07Å; M292-F296 HydrophobicContact CE-CB 4.37Å; M292-F296 HydrophobicContact CE-CD1 3.74Å; M292-F296 HydrophobicContact CE-CD2 3.62Å; M292-F296 HydrophobicContact CE-CE1 3.86Å; M292-F296 HydrophobicContact CE-CE2 3.73Å; M292-F296 HydrophobicContact CE-CG 3.62Å; M292-F296 HydrophobicContact CE-CZ 3.84Å; M292-F296 HydrophobicContact CG-CD1 3.72Å; M292-F296 HydrophobicContact CG-CE1 3.98Å; M292-F296 HydrophobicContact CG-CG 4.38Å; S293-F296 PolarHBondContact O-N 3.46Å; S293-F296 WeakPolarHBondContact OG-CB 3.49Å; S293-F296 PolarHBondContact OG-N 3.43Å; K294-F296 VanDerWaalsContact C-N 3.34Å; F296-E298 VanDerWaalsContact C-N 3.3Å; F296-E298 PolarHBondContact O-N 3.42Å; F296-A299 PolarHBondContact O-N 3.2Å; F296-E300 HydrophobicContact CD1-CB 4.46Å; F296-E300 HydrophobicContact CE1-CB 4.35Å; F296-E300 VanDerWaalsContact O-CB 3.28Å; F296-E300 WeakPolarHBondContact O-CB 3.48Å; F296-E300 PolarHBondContact O-N 2.91Å
297	I	84.5	Confident	84.3	Confident	63 Å²	63	67.7 Å²	67.7	32%	0.323	34%	0.339	S	S	.	.	H	α-helix	trans	-61.5	-39.6	178.5	-65.8	169.2	0	0	0	110.7	M292 S293 K294 E300 M301	M292-I297 HydrophobicContact CB-CG1 4.26Å; S293-I297 WeakPolarHBondContact O-CG1 3.42Å; S293-I297 PolarHBondContact O-N 3.18Å; K294-I297 PolarHBondContact O-N 3.23Å; I297-E300 PolarHBondContact O-N 2.76Å; I297-M301 HydrophobicContact CG2-CG 4.24Å; I297-M301 VanDerWaalsContact O-CB 3.26Å; I297-M301 WeakPolarHBondContact O-CB 3.45Å; I297-M301 WeakPolarHBondContact O-CG 3.4Å; I297-M301 PolarHBondContact O-N 2.61Å
298	E	86.1	Confident	85.8	Confident	150 Å²	150	65.4 Å²	65.4	70%	0.701	32%	0.315	S	S	*	.	H	α-helix	trans	-64.6	-41.6	176.8	-172.8	174.4	-176.6	0	0	112.1	K294 F296 M301 K302	K294-E298 PolarHBondContact O-N 2.93Å; F296-E298 VanDerWaalsContact C-N 3.3Å; F296-E298 PolarHBondContact O-N 3.42Å; E298-M301 PolarHBondContact O-N 3.47Å; E298-K302 WeakPolarHBondContact O-CB 3.49Å; E298-K302 PolarHBondContact O-N 3.42Å
299	A	88.1	Confident	87.1	Confident	30 Å²	30	67.1 Å²	67.1	25%	0.248	33%	0.326	C	S	.	.	H	α-helix	trans	-68.9	-39.2	176.4	0	0	0	0	0	112.5	V276 E295 F296 K302 L303	V276-A299 HydrophobicContact CG1-CB 3.39Å; E295-A299 WeakPolarHBondContact O-CB 3.37Å; E295-A299 PolarHBondContact O-N 2.95Å; E295-A299 VanDerWaalsContact O-N 3.12Å; F296-A299 PolarHBondContact O-N 3.2Å; A299-K302 PolarHBondContact O-N 3.32Å; A299-L303 PolarHBondContact O-N 3.47Å
300	E	89.4	Confident	88.2	Confident	12 Å²	12	67.8 Å²	67.8	6%	0.056	33%	0.325	C	S	.	.	H	α-helix	trans	-59.6	-48.9	171.8	178	-176.8	-163.2	0	0	111	F256 V276 F296 I297 K302 L303 F304	F256-E300 HydrophobicContact CE1-CG 3.88Å; F256-E300 WeakPolarHBondContact CE1-OE1 3.4Å; F256-E300 HydrophobicContact CZ-CG 4.14Å; V276-E300 HydrophobicContact CG2-CB 4.37Å; F296-E300 HydrophobicContact CD1-CB 4.46Å; F296-E300 HydrophobicContact CE1-CB 4.35Å; F296-E300 VanDerWaalsContact O-CB 3.28Å; F296-E300 WeakPolarHBondContact O-CB 3.48Å; F296-E300 PolarHBondContact O-N 2.91Å; I297-E300 PolarHBondContact O-N 2.76Å; E300-K302 VanDerWaalsContact C-N 3.31Å; E300-K302 PolarHBondContact O-N 2.79Å; E300-L303 WeakPolarHBondContact O-CB 3.4Å; E300-L303 PolarHBondContact O-N 3.15Å; E300-L303 VanDerWaalsContact O-N 3.13Å; E300-F304 HydrophobicContact CG-CD2 4.04Å; E300-F304 HydrophobicContact CG-CE1 4.07Å; E300-F304 HydrophobicContact CG-CE2 3.34Å; E300-F304 HydrophobicContact CG-CZ 3.35Å; E300-F304 WeakPolarHBondContact O-CG 3.47Å; E300-F304 PolarHBondContact O-N 3.18Å; E300-F304 WeakPolarHBondContact OE1-CE2 3.35Å; E300-F304 VanDerWaalsContact OE1-CZ 3.28Å; E300-F304 WeakPolarHBondContact OE1-CZ 3.48Å
301	M	88.2	Confident	89.2	Confident	27 Å²	27	63.6 Å²	63.6	13%	0.133	31%	0.306	C	S	.	.	H	α-helix	trans	-59.5	-39.8	175.9	-76.6	-67	-138.4	0	0	112.5	I297 E298 F304 A305 V327 L328 R330 M333	I297-M301 HydrophobicContact CG2-CG 4.24Å; I297-M301 VanDerWaalsContact O-CB 3.26Å; I297-M301 WeakPolarHBondContact O-CB 3.45Å; I297-M301 WeakPolarHBondContact O-CG 3.4Å; I297-M301 PolarHBondContact O-N 2.61Å; E298-M301 PolarHBondContact O-N 3.47Å; M301-F304 PolarHBondContact O-N 3.02Å; M301-A305 WeakPolarHBondContact O-CB 3.37Å; M301-A305 PolarHBondContact O-N 2.6Å; M301-V327 WeakPolarHBondContact CE-O 3.39Å; M301-L328 VanDerWaalsContact SD-C 3.57Å; M301-R330 HydrophobicContact CE-CG 4.16Å; M301-M333 HydrophobicContact CB-CE 4Å; M301-M333 HydrophobicContact CG-CE 4.48Å; M301-M333 HydrophobicContact SD-CE 3.86Å; M301-M333 HydrophobicContact SD-SD 4.2Å
302	K	91.6	Very high	90.2	Very high	163 Å²	163	57.5 Å²	57.5	71%	0.709	28%	0.278	S	S	*	.	H	α-helix	trans	-65.2	-40.3	175.6	-174.9	-179.3	179.3	-176.9	0	111.9	E298 A299 E300 K306	E298-K302 WeakPolarHBondContact O-CB 3.49Å; E298-K302 PolarHBondContact O-N 3.42Å; A299-K302 PolarHBondContact O-N 3.32Å; E300-K302 VanDerWaalsContact C-N 3.31Å; E300-K302 PolarHBondContact O-N 2.79Å; K302-K306 PolarHBondContact O-N 3Å
303	L	93.3	Very high	91.1	Very high	30 Å²	30	56.6 Å²	56.6	16%	0.157	27%	0.273	C	S	.	.	H	α-helix	trans	-62	-47.4	173.9	172.7	65.6	0	0	0	110.7	F256 L274 V276 A299 E300 K306 Q307	F256-L303 HydrophobicContact CD2-CD2 4.04Å; F256-L303 HydrophobicContact CE2-CD2 4.17Å; L274-L303 HydrophobicContact CB-CD2 4.23Å; V276-L303 HydrophobicContact CG2-CD2 3.81Å; A299-L303 PolarHBondContact O-N 3.47Å; E300-L303 WeakPolarHBondContact O-CB 3.4Å; E300-L303 PolarHBondContact O-N 3.15Å; E300-L303 VanDerWaalsContact O-N 3.13Å; L303-K306 WeakPolarHBondContact O-CB 3.47Å; L303-K306 PolarHBondContact O-N 2.91Å; L303-Q307 HydrophobicContact CD1-CG 4.42Å; L303-Q307 WeakPolarHBondContact O-CG 3.46Å; L303-Q307 PolarHBondContact O-N 2.8Å
304	F	94.2	Very high	91.7	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.2	-44.4	179.4	-65.7	-14.3	0	0	0	112.4	I233 F256 E300 M301 K306 Q307 C308 L328 F329	I233-F304 HydrophobicContact CD1-CD1 3.92Å; I233-F304 HydrophobicContact CD1-CE1 3.4Å; I233-F304 HydrophobicContact CD1-CE2 4.45Å; I233-F304 HydrophobicContact CD1-CZ 3.71Å; I233-F304 HydrophobicContact CG1-CE1 4.41Å; I233-F304 HydrophobicContact CG1-CZ 4.33Å; I233-F304 HydrophobicContact CG2-CE2 4.2Å; I233-F304 HydrophobicContact CG2-CZ 3.9Å; F256-F304 HydrophobicContact CB-CE1 4.13Å; F256-F304 AromaticContact CD1-CE1 3.64Å; F256-F304 HydrophobicContact CD1-CE1 3.64Å; F256-F304 AromaticContact CD1-CZ 3.44Å; F256-F304 HydrophobicContact CD1-CZ 3.44Å; F256-F304 VanDerWaalsContact CD1-CZ 3.44Å; F256-F304 HydrophobicContact CE1-CE1 4.2Å; F256-F304 AromaticContact CE1-CZ 3.79Å; F256-F304 HydrophobicContact CE1-CZ 3.79Å; F256-F304 AromaticContact CG-CE1 3.81Å; F256-F304 HydrophobicContact CG-CE1 3.81Å; F256-F304 HydrophobicContact CG-CZ 4.11Å; E300-F304 HydrophobicContact CG-CD2 4.04Å; E300-F304 HydrophobicContact CG-CE1 4.07Å; E300-F304 HydrophobicContact CG-CE2 3.34Å; E300-F304 HydrophobicContact CG-CZ 3.35Å; E300-F304 WeakPolarHBondContact O-CG 3.47Å; E300-F304 PolarHBondContact O-N 3.18Å; E300-F304 WeakPolarHBondContact OE1-CE2 3.35Å; E300-F304 VanDerWaalsContact OE1-CZ 3.28Å; E300-F304 WeakPolarHBondContact OE1-CZ 3.48Å; M301-F304 PolarHBondContact O-N 3.02Å; F304-K306 VanDerWaalsContact C-N 3.26Å; F304-K306 PolarHBondContact O-N 3.28Å; F304-Q307 PolarHBondContact O-N 2.93Å; F304-C308 PolarHBondContact O-N 3.31Å; F304-C308 PolarHBondContact O-SG 2.88Å; F304-L328 HydrophobicContact CD2-CB 4.25Å; F304-L328 HydrophobicContact CE2-CB 4.04Å; F304-L328 HydrophobicContact CE2-CD1 4.25Å; F304-L328 HydrophobicContact CE2-CD2 4.5Å; F304-L328 HydrophobicContact CE2-CG 4.49Å; F304-F329 HydrophobicContact CB-CD1 4.41Å; F304-F329 HydrophobicContact CB-CE1 3.72Å; F304-F329 HydrophobicContact CB-CZ 4.04Å; F304-F329 HydrophobicContact CD2-CE1 4.44Å; F304-F329 HydrophobicContact CD2-CE2 4.32Å; F304-F329 HydrophobicContact CD2-CZ 4.04Å; F304-F329 HydrophobicContact CG-CE1 4.17Å; F304-F329 AromaticContact CG-CZ 3.96Å; F304-F329 HydrophobicContact CG-CZ 3.96Å
305	A	92.6	Very high	92.4	Very high	22 Å²	22	46.7 Å²	46.7	18%	0.182	23%	0.226	C	C	.	.	H	α-helix	trans	-58.1	-38.1	175.2	0	0	0	0	0	112.5	M301 M333	M301-A305 WeakPolarHBondContact O-CB 3.37Å; M301-A305 PolarHBondContact O-N 2.6Å; A305-M333 HydrophobicContact CB-CE 4.26Å; A305-M333 HydrophobicContact CB-CG 4.04Å; A305-M333 HydrophobicContact CB-SD 4.28Å
306	K	94.1	Very high	93	Very high	153 Å²	153	40.9 Å²	40.9	67%	0.665	20%	0.199	S	C	*	.	H	α-helix	trans	-67.6	-40.3	174.4	-176.4	179.2	173.9	-176.9	0	111.9	K302 L303 F304	K302-K306 PolarHBondContact O-N 3Å; L303-K306 WeakPolarHBondContact O-CB 3.47Å; L303-K306 PolarHBondContact O-N 2.91Å; F304-K306 VanDerWaalsContact C-N 3.26Å; F304-K306 PolarHBondContact O-N 3.28Å
307	Q	95.2	Very high	93.4	Very high	24 Å²	24	41.4 Å²	41.4	11%	0.112	20%	0.203	C	C	.	.	H	α-helix	trans	-69.5	-37.8	178.1	-67.1	-63.9	-31.6	0	0	112.4	L231 L274 L303 F304 Q309 D310 V311	L231-Q307 HydrophobicContact CD2-CB 3.85Å; L274-Q307 HydrophobicContact CD1-CG 3.93Å; L303-Q307 HydrophobicContact CD1-CG 4.42Å; L303-Q307 WeakPolarHBondContact O-CG 3.46Å; L303-Q307 PolarHBondContact O-N 2.8Å; F304-Q307 PolarHBondContact O-N 2.93Å; Q307-Q309 PolarHBondContact O-N 3.39Å; Q307-Q309 VanDerWaalsContact O-N 3.09Å; Q307-D310 PolarHBondContact O-N 2.92Å; Q307-V311 HydrophobicContact CB-CG1 4.49Å; Q307-V311 WeakPolarHBondContact O-CG2 3.37Å; Q307-V311 PolarHBondContact O-N 2.97Å
308	C	93.8	Very high	93.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-52.8	-31.6	178.7	-75.7	0	0	0	0	113.8	F304 D310 F329 M337	F304-C308 PolarHBondContact O-N 3.31Å; F304-C308 PolarHBondContact O-SG 2.88Å; C308-D310 VanDerWaalsContact C-N 3.32Å; C308-D310 PolarHBondContact O-N 2.87Å; C308-F329 VanDerWaalsContact SG-CE1 3.51Å; C308-M337 HydrophobicContact CB-CG 4.18Å; C308-M337 WeakPolarHBondContact O-CG 3.29Å
309	Q	93.9	Very high	93.5	Very high	119 Å²	119	36.8 Å²	36.8	56%	0.556	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-26.8	179.3	-63	176.5	19.3	0	0	113.1	Q307 L336	Q307-Q309 PolarHBondContact O-N 3.39Å; Q307-Q309 VanDerWaalsContact O-N 3.09Å; Q309-L336 HydrophobicContact CG-CB 4.24Å; Q309-L336 HydrophobicContact CG-CD1 4.45Å
310	D	95.3	Very high	92.9	Very high	51 Å²	51	37.9 Å²	37.9	27%	0.273	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-36.1	-173.2	-174.2	38.4	0	0	0	113.2	K229 R254 Q307 C308 K338	K229-D310 WeakPolarHBondContact CD-OD2 3.35Å; K229-D310 IonicContact NZ-OD1 2.6Å; K229-D310 PolarHBondContact NZ-OD1 2.84Å; K229-D310 IonicContact NZ-OD2 3.13Å; K229-D310 PolarHBondContact NZ-OD2 2.84Å; R254-D310 IonicContact CZ-OD2 2.65Å; R254-D310 IonicContact NH1-OD2 3.49Å; R254-D310 PolarHBondContact NH1-OD2 2.87Å; R254-D310 IonicContact NH2-OD2 3.04Å; R254-D310 PolarHBondContact NH2-OD2 2.68Å; Q307-D310 PolarHBondContact O-N 2.92Å; C308-D310 VanDerWaalsContact C-N 3.32Å; C308-D310 PolarHBondContact O-N 2.87Å; D310-K338 PolarHBondContact O-NZ 3.43Å
311	V	97.5	Very high	91.9	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.			trans	-79.4	151.1	-173.1	-56.1	0	0	0	0	112.2	K229 L231 Q307 I314 M337	K229-V311 HydrophobicContact CB-CB 4.38Å; K229-V311 HydrophobicContact CB-CG1 4.36Å; L231-V311 HydrophobicContact CB-CB 4.36Å; L231-V311 HydrophobicContact CB-CG1 4.16Å; L231-V311 HydrophobicContact CB-CG2 4.13Å; Q307-V311 HydrophobicContact CB-CG1 4.49Å; Q307-V311 WeakPolarHBondContact O-CG2 3.37Å; Q307-V311 PolarHBondContact O-N 2.97Å; V311-I314 HydrophobicContact CG2-CD1 4.09Å; V311-I314 HydrophobicContact CG2-CG1 3.73Å; V311-M337 HydrophobicContact CG2-CE 4.24Å
312	D	97.9	Very high	90.9	Very high	4 Å²	4	43 Å²	43	2%	0.021	24%	0.236	C	C	.	.	S	Bend	trans	-99.5	-27.2	-178.4	-49.9	-64.7	0	0	0	111.7	F211 R213 K229 K338 S341 V342	F211-D312 HydrophobicContact CE1-CB 4.47Å; F211-D312 HydrophobicContact CE2-CB 3.73Å; F211-D312 HydrophobicContact CZ-CB 3.53Å; R213-D312 IonicContact CZ-OD1 3.65Å; R213-D312 IonicContact NH1-OD1 2.84Å; R213-D312 VanDerWaalsContact NH2-CG 3.34Å; R213-D312 IonicContact NH2-OD1 3.24Å; R213-D312 PolarHBondContact NH2-OD1 2.99Å; K229-D312 PolarHBondContact N-OD2 2.87Å; K229-D312 PolarHBondContact O-N 3.26Å; D312-K338 IonicContact OD1-NZ 3.96Å; D312-K338 PolarHBondContact OD1-NZ 2.96Å; D312-S341 VanDerWaalsContact O-CA 3.25Å; D312-S341 WeakPolarHBondContact O-CA 3.49Å; D312-S341 WeakPolarHBondContact O-CB 3.43Å; D312-S341 PolarHBondContact O-OG 2.99Å; D312-V342 PolarHBondContact O-N 3.46Å; D312-V342 VanDerWaalsContact O-N 3.09Å
313	I	98.5	Very high	90.2	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	135.1	-178.6	-57.8	174	0	0	0	109.9	A207 F211 F215 K229 V230 L231 I315 V342	A207-I313 HydrophobicContact CB-CD1 4.15Å; A207-I313 HydrophobicContact CB-CG2 3.84Å; F211-I313 HydrophobicContact CB-CD1 4.22Å; F211-I313 HydrophobicContact CD1-CD1 4.17Å; F211-I313 HydrophobicContact CD2-CG1 4.39Å; F211-I313 HydrophobicContact CG-CD1 4.07Å; F211-I313 HydrophobicContact CG-CG1 4.43Å; F215-I313 HydrophobicContact CE1-CD1 4.18Å; F215-I313 HydrophobicContact CE2-CD1 3.38Å; F215-I313 HydrophobicContact CZ-CD1 3.19Å; K229-I313 PolarHBondContact O-N 3Å; K229-I313 VanDerWaalsContact O-N 3.13Å; V230-I313 WeakPolarHBondContact CA-O 3.49Å; V230-I313 HydrophobicContact CG1-CB 4.29Å; V230-I313 HydrophobicContact CG1-CG2 4.18Å; V230-I313 HydrophobicContact CG2-CB 4.19Å; V230-I313 HydrophobicContact CG2-CD1 4.36Å; L231-I313 PolarHBondContact N-O 2.94Å; I313-I315 HydrophobicContact CG2-CG1 4.16Å; I313-V342 VanDerWaalsContact CA-O 3.23Å; I313-V342 WeakPolarHBondContact CA-O 3.34Å; I313-V342 HydrophobicContact CG1-CB 4.38Å
314	I	98.3	Very high	89.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129	172.3	-56.8	177.5	0	0	0	109	L231 V311 T316 F329 M337 V342 V343 V344	L231-I314 HydrophobicContact CB-CG1 4.31Å; L231-I314 HydrophobicContact CD2-CG1 4.41Å; L231-I314 WeakPolarHBondContact O-CA 3.34Å; V311-I314 HydrophobicContact CG2-CD1 4.09Å; V311-I314 HydrophobicContact CG2-CG1 3.73Å; I314-T316 HydrophobicContact CG2-CG2 3.84Å; I314-F329 HydrophobicContact CD1-CD1 4.31Å; I314-F329 HydrophobicContact CD1-CE1 3.86Å; I314-F329 HydrophobicContact CD1-CZ 4.36Å; I314-F329 HydrophobicContact CG2-CE1 4.36Å; I314-F329 HydrophobicContact CG2-CE2 4.05Å; I314-F329 HydrophobicContact CG2-CZ 3.84Å; I314-M337 HydrophobicContact CD1-CE 3.69Å; I314-M337 HydrophobicContact CD1-SD 3.59Å; I314-M337 VanDerWaalsContact CD1-SD 3.59Å; I314-M337 HydrophobicContact CG1-CE 3.7Å; I314-M337 HydrophobicContact CG1-SD 4.19Å; I314-V342 PolarHBondContact N-O 2.95Å; I314-V343 HydrophobicContact CB-CG1 4.14Å; I314-V343 CarbonylContact O-C 3.23Å; I314-V343 WeakPolarHBondContact O-CA 3.39Å; I314-V344 PolarHBondContact O-N 3.39Å
315	I	98.1	Very high	89.2	Confident	1 Å²	1	48 Å²	48	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	116.5	173	-56.5	178.5	0	0	0	108	A203 V204 V230 L231 I232 I233 I313 T317 V344 L346	A203-I315 HydrophobicContact CB-CD1 4.3Å; A203-I315 HydrophobicContact CB-CG2 4.19Å; V204-I315 HydrophobicContact CG2-CD1 3.6Å; V230-I315 HydrophobicContact CG1-CD1 4.28Å; L231-I315 PolarHBondContact O-N 3.04Å; I232-I315 WeakPolarHBondContact CA-O 3.29Å; I232-I315 HydrophobicContact CG1-CB 4.49Å; I233-I315 PolarHBondContact N-O 3.27Å; I313-I315 HydrophobicContact CG2-CG1 4.16Å; I315-T317 HydrophobicContact CG2-CG2 4.22Å; I315-V344 WeakPolarHBondContact CA-O 3.31Å; I315-V344 HydrophobicContact CG1-CB 4.28Å; I315-V344 HydrophobicContact CG1-CG2 4.45Å; I315-L346 HydrophobicContact CG2-CD1 4.23Å; I315-L346 HydrophobicContact CG2-CG 4.26Å
316	T	96.8	Very high	89	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.4	-178.8	60.6	0	0	0	0	111.1	I233 I314 F329 V344 D345 L346 N353 I354	I233-T316 HydrophobicContact CB-CG2 4.37Å; I233-T316 HydrophobicContact CG1-CG2 4.44Å; I314-T316 HydrophobicContact CG2-CG2 3.84Å; T316-F329 HydrophobicContact CG2-CD2 3.77Å; T316-F329 HydrophobicContact CG2-CE2 3.5Å; T316-F329 VanDerWaalsContact CG2-CE2 3.5Å; T316-V344 PolarHBondContact N-O 2.9Å; T316-D345 WeakPolarHBondContact OG1-CA 3.38Å; T316-D345 PolarHBondContact OG1-OD1 3.37Å; T316-L346 VanDerWaalsContact O-CB 3.27Å; T316-L346 WeakPolarHBondContact O-CB 3.46Å; T316-L346 PolarHBondContact O-N 3.38Å; T316-N353 WeakPolarHBondContact CB-OD1 3.45Å; T316-N353 HydrophobicContact CG2-CB 4.13Å; T316-N353 PolarHBondContact OG1-OD1 3.11Å; T316-I354 HydrophobicContact CG2-CD1 4.36Å; T316-I354 HydrophobicContact CG2-CG1 4.24Å
317	T	94.3	Very high	88.8	Confident	20 Å²	20	45.6 Å²	45.6	12%	0.123	26%	0.255	C	S	.	.			trans	-134	16.7	-177.7	88.1	0	0	0	0	112.3	I233 G234 A238 I315 L319 L346	I233-T317 PolarHBondContact O-N 3.24Å; I233-T317 PolarHBondContact O-OG1 3.48Å; G234-T317 PolarHBondContact O-OG1 3.48Å; A238-T317 HydrophobicContact CB-CG2 4.31Å; I315-T317 HydrophobicContact CG2-CG2 4.22Å; T317-L319 PolarHBondContact O-N 3.33Å; T317-L319 VanDerWaalsContact O-N 3.12Å; T317-L346 HydrophobicContact CG2-CB 4.39Å; T317-L346 HydrophobicContact CG2-CD1 3.63Å; T317-L346 HydrophobicContact CG2-CG 4.18Å
318	A	89.2	Confident	88.6	Confident	21 Å²	21	44.9 Å²	44.9	17%	0.174	25%	0.252	C	S	.	.			trans	-75.2	105.3	-175.9	0	0	0	0	0	109.6	P326 L328 N353	A318-P326 HydrophobicContact CB-CG 4.25Å; A318-L328 HydrophobicContact CB-CD1 3.53Å; A318-N353 PolarHBondContact N-OD1 3.47Å; A318-N353 VanDerWaalsContact N-OD1 3.16Å; A318-N353 PolarHBondContact O-ND2 3.01Å; A318-N353 PolarHBondContact O-OD1 2.89Å
319	L	83.9	Confident	88.6	Confident	95 Å²	95	44.9 Å²	44.9	50%	0.497	25%	0.252	S	S	.	.			trans	-138.4	126.8	-177.1	-176.3	64.7	0	0	0	110.5	T317 A325 A350	T317-L319 PolarHBondContact O-N 3.33Å; T317-L319 VanDerWaalsContact O-N 3.12Å; L319-A325 HydrophobicContact CD1-CB 4.32Å; L319-A350 HydrophobicContact CD1-CB 3.38Å
320	I	75.3	Confident	88.6	Confident	52 Å²	52	44.7 Å²	44.7	27%	0.267	25%	0.246	S	C	.	.			trans	-105.8	121.4	175	-58	176.4	0	0	0	107.9	G322 K323	I320-G322 PolarHBondContact O-N 3.03Å; I320-K323 HydrophobicContact CB-CB 4.36Å; I320-K323 HydrophobicContact CG2-CB 4.38Å; I320-K323 HydrophobicContact CG2-CD 4.28Å; I320-K323 PolarHBondContact O-N 3.45Å
321	P	67.2	Low	88.6	Confident	79 Å²	79	46.8 Å²	46.8	51%	0.513	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	133.2	179.5	-26.3	34	0	0	0	112.6	Y288 K323	Y288-P321 HydrophobicContact CD1-CG 4.04Å; Y288-P321 HydrophobicContact CE1-CG 3.55Å; P321-K323 PolarHBondContact O-N 2.92Å
322	G	68	Low	88.4	Confident	68 Å²	68	50.7 Å²	50.7	70%	0.701	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	-4	177.2	0	0	0	0	0	115.9	I320	I320-G322 PolarHBondContact O-N 3.03Å
323	K	77	Confident	88.2	Confident	112 Å²	112	50.8 Å²	50.8	49%	0.487	27%	0.274	S	S	.	.	S	Bend	trans	-115.6	162.6	174.4	-71.3	-173	173.7	-178.9	0	110.9	E291 I320 P321	E291-K323 IonicContact OE2-NZ 3.63Å; E291-K323 PolarHBondContact OE2-NZ 3.14Å; I320-K323 HydrophobicContact CB-CB 4.36Å; I320-K323 HydrophobicContact CG2-CB 4.38Å; I320-K323 HydrophobicContact CG2-CD 4.28Å; I320-K323 PolarHBondContact O-N 3.45Å; P321-K323 PolarHBondContact O-N 2.92Å
324	K	80.6	Confident	88	Confident	177 Å²	177	50.8 Å²	50.8	77%	0.77	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-64.4	146.2	166.7	-73.7	-173.1	175.5	-176.5	0	109.8	A350	K324-A350 CarbonylContact C-O 3.59Å; K324-A350 VanDerWaalsContact CA-O 3.31Å; K324-A350 WeakPolarHBondContact CA-O 3.16Å
325	A	86.1	Confident	87.8	Confident	9 Å²	9	53.9 Å²	53.9	7%	0.074	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-59.3	136.7	173	0	0	0	0	0	110.1	L319 A347 A350	L319-A325 HydrophobicContact CD1-CB 4.32Å; A325-A347 HydrophobicContact CB-CB 3.67Å; A325-A350 PolarHBondContact N-O 2.97Å
326	P	87.2	Confident	87.7	Confident	48 Å²	48	58.1 Å²	58.1	31%	0.312	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-69.1	136.5	176.7	28.5	-33.8	0	0	0	109.8	A318 L328 N353	A318-P326 HydrophobicContact CB-CG 4.25Å; P326-L328 HydrophobicContact CB-CD2 4.1Å; P326-L328 HydrophobicContact CB-CG 4.39Å; P326-L328 HydrophobicContact CG-CD1 4.44Å; P326-L328 HydrophobicContact CG-CD2 4.25Å; P326-L328 HydrophobicContact CG-CG 4.25Å; P326-L328 PolarHBondContact O-N 3.17Å; P326-N353 WeakPolarHBondContact O-CA 3.46Å; P326-N353 PolarHBondContact O-ND2 3.3Å
327	V	90.6	Very high	87.6	Confident	76 Å²	76	58.8 Å²	58.8	46%	0.461	31%	0.314	S	S	.	.			trans	-77.7	108.2	172.3	-179.2	0	0	0	0	108.1	M301 E355	M301-V327 WeakPolarHBondContact CE-O 3.39Å; V327-E355 HydrophobicContact CG1-CB 4.06Å
328	L	91	Very high	87.7	Confident	9 Å²	9	61.5 Å²	61.5	5%	0.047	32%	0.324	C	S	.	.			trans	-106.9	-14.5	-176.7	-59.6	179.3	0	0	0	112.7	I233 M301 F304 A318 P326 N353	I233-L328 HydrophobicContact CG2-CD1 3.64Å; M301-L328 VanDerWaalsContact SD-C 3.57Å; F304-L328 HydrophobicContact CD2-CB 4.25Å; F304-L328 HydrophobicContact CE2-CB 4.04Å; F304-L328 HydrophobicContact CE2-CD1 4.25Å; F304-L328 HydrophobicContact CE2-CD2 4.5Å; F304-L328 HydrophobicContact CE2-CG 4.49Å; A318-L328 HydrophobicContact CB-CD1 3.53Å; P326-L328 HydrophobicContact CB-CD2 4.1Å; P326-L328 HydrophobicContact CB-CG 4.39Å; P326-L328 HydrophobicContact CG-CD1 4.44Å; P326-L328 HydrophobicContact CG-CD2 4.25Å; P326-L328 HydrophobicContact CG-CG 4.25Å; P326-L328 PolarHBondContact O-N 3.17Å; L328-N353 PolarHBondContact N-O 3.48Å
329	F	94.2	Very high	88	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-128.9	110.9	174.9	-65.5	-89.8	0	0	0	109.3	L231 I233 F304 C308 I314 T316 I334 N353 I354 E355	L231-F329 HydrophobicContact CD2-CZ 4.29Å; I233-F329 HydrophobicContact CD1-CZ 4.33Å; I233-F329 HydrophobicContact CG1-CE2 3.78Å; I233-F329 HydrophobicContact CG1-CZ 3.77Å; F304-F329 HydrophobicContact CB-CD1 4.41Å; F304-F329 HydrophobicContact CB-CE1 3.72Å; F304-F329 HydrophobicContact CB-CZ 4.04Å; F304-F329 HydrophobicContact CD2-CE1 4.44Å; F304-F329 HydrophobicContact CD2-CE2 4.32Å; F304-F329 HydrophobicContact CD2-CZ 4.04Å; F304-F329 HydrophobicContact CG-CE1 4.17Å; F304-F329 AromaticContact CG-CZ 3.96Å; F304-F329 HydrophobicContact CG-CZ 3.96Å; C308-F329 VanDerWaalsContact SG-CE1 3.51Å; I314-F329 HydrophobicContact CD1-CD1 4.31Å; I314-F329 HydrophobicContact CD1-CE1 3.86Å; I314-F329 HydrophobicContact CD1-CZ 4.36Å; I314-F329 HydrophobicContact CG2-CE1 4.36Å; I314-F329 HydrophobicContact CG2-CE2 4.05Å; I314-F329 HydrophobicContact CG2-CZ 3.84Å; T316-F329 HydrophobicContact CG2-CD2 3.77Å; T316-F329 HydrophobicContact CG2-CE2 3.5Å; T316-F329 VanDerWaalsContact CG2-CE2 3.5Å; F329-I334 HydrophobicContact CB-CD1 3.74Å; F329-I334 HydrophobicContact CB-CG1 4.08Å; F329-I334 HydrophobicContact CD1-CD1 4.17Å; F329-I334 HydrophobicContact CG-CD1 4.15Å; F329-N353 PolarHBondContact N-O 2.73Å; F329-N353 VanDerWaalsContact N-O 3.11Å; F329-I354 HydrophobicContact CB-CB 4.47Å; F329-I354 HydrophobicContact CB-CG1 4.22Å; F329-I354 HydrophobicContact CB-CG2 4.21Å; F329-I354 HydrophobicContact CD2-CG1 4.33Å; F329-E355 PolarHBondContact O-N 3.1Å
330	R	94.2	Very high	88.5	Confident	116 Å²	116	65.6 Å²	65.6	44%	0.438	35%	0.346	S	S	.	.			trans	-77.5	161.6	173.5	-63.9	-167.1	-49.7	-140.6	1	110.9	M301 D332 M333 I334 E355	M301-R330 HydrophobicContact CE-CG 4.16Å; R330-D332 VanDerWaalsContact C-N 3.27Å; R330-D332 WeakPolarHBondContact CB-OD1 3.38Å; R330-D332 IonicContact CZ-OD1 3.86Å; R330-D332 IonicContact CZ-OD2 2.71Å; R330-D332 IonicContact NE-OD1 2.7Å; R330-D332 PolarHBondContact NE-OD1 3.06Å; R330-D332 IonicContact NE-OD2 2.83Å; R330-D332 IonicContact NH2-OD1 2.68Å; R330-D332 IonicContact NH2-OD2 3.89Å; R330-D332 PolarHBondContact NH2-OD2 3.35Å; R330-D332 PolarHBondContact O-N 3.02Å; R330-M333 HydrophobicContact CB-CG 4.41Å; R330-M333 HydrophobicContact CB-SD 4.41Å; R330-M333 HydrophobicContact CG-CE 4.43Å; R330-M333 WeakPolarHBondContact O-CB 3.24Å; R330-M333 PolarHBondContact O-N 2.99Å; R330-I334 PolarHBondContact O-N 3.37Å; R330-E355 WeakPolarHBondContact CA-OE2 3.42Å
331	K	94.1	Very high	89.5	Confident	95 Å²	95	63.1 Å²	63.1	41%	0.413	33%	0.333	S	S	.	.	H	α-helix	trans	-54.8	-41	178.1	-176.9	176.8	179.3	-179.4	0	112.8	M333 I334 E335 E355 T356	K331-M333 VanDerWaalsContact C-N 3.28Å; K331-M333 PolarHBondContact O-N 3.01Å; K331-I334 PolarHBondContact O-N 2.76Å; K331-E335 WeakPolarHBondContact CE-OE1 3.39Å; K331-E335 HydrophobicContact CG-CG 4.46Å; K331-E335 WeakPolarHBondContact CG-OE1 3.41Å; K331-E335 VanDerWaalsContact O-CG 3.24Å; K331-E335 WeakPolarHBondContact O-CG 3.45Å; K331-E335 PolarHBondContact O-N 3.47Å; K331-E355 PolarHBondContact N-OE2 3.08Å; K331-T356 HydrophobicContact CB-CG2 4.09Å; K331-T356 HydrophobicContact CD-CG2 4.37Å; K331-T356 HydrophobicContact CG-CG2 3.88Å
332	D	93.8	Very high	91	Very high	82 Å²	82	59.4 Å²	59.4	44%	0.439	31%	0.309	S	S	.	.	H	α-helix	trans	-62.4	-33.9	177.9	61	-40.5	0	0	0	112.5	R330 L336	R330-D332 VanDerWaalsContact C-N 3.27Å; R330-D332 WeakPolarHBondContact CB-OD1 3.38Å; R330-D332 IonicContact CZ-OD1 3.86Å; R330-D332 IonicContact CZ-OD2 2.71Å; R330-D332 IonicContact NE-OD1 2.7Å; R330-D332 PolarHBondContact NE-OD1 3.06Å; R330-D332 IonicContact NE-OD2 2.83Å; R330-D332 IonicContact NH2-OD1 2.68Å; R330-D332 IonicContact NH2-OD2 3.89Å; R330-D332 PolarHBondContact NH2-OD2 3.35Å; R330-D332 PolarHBondContact O-N 3.02Å; D332-L336 WeakPolarHBondContact O-CG 3.49Å
333	M	94.1	Very high	92.4	Very high	6 Å²	6	56.2 Å²	56.2	3%	0.03	28%	0.276	C	S	.	.	H	α-helix	trans	-74.3	-42.8	179.5	-59.7	174.6	-177.9	0	0	112.5	M301 A305 R330 K331 E335 L336	M301-M333 HydrophobicContact CB-CE 4Å; M301-M333 HydrophobicContact CG-CE 4.48Å; M301-M333 HydrophobicContact SD-CE 3.86Å; M301-M333 HydrophobicContact SD-SD 4.2Å; A305-M333 HydrophobicContact CB-CE 4.26Å; A305-M333 HydrophobicContact CB-CG 4.04Å; A305-M333 HydrophobicContact CB-SD 4.28Å; R330-M333 HydrophobicContact CB-CG 4.41Å; R330-M333 HydrophobicContact CB-SD 4.41Å; R330-M333 HydrophobicContact CG-CE 4.43Å; R330-M333 WeakPolarHBondContact O-CB 3.24Å; R330-M333 PolarHBondContact O-N 2.99Å; K331-M333 VanDerWaalsContact C-N 3.28Å; K331-M333 PolarHBondContact O-N 3.01Å; M333-E335 VanDerWaalsContact C-N 3.3Å; M333-E335 PolarHBondContact O-N 2.73Å; M333-L336 WeakPolarHBondContact O-CB 3.45Å; M333-L336 PolarHBondContact O-N 3.36Å
334	I	94.8	Very high	93.4	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-65.5	-36.9	179.4	-63.7	-59.2	0	0	0	111.2	F329 R330 K331 L336 M337 V343 I354 V368	F329-I334 HydrophobicContact CB-CD1 3.74Å; F329-I334 HydrophobicContact CB-CG1 4.08Å; F329-I334 HydrophobicContact CD1-CD1 4.17Å; F329-I334 HydrophobicContact CG-CD1 4.15Å; R330-I334 PolarHBondContact O-N 3.37Å; K331-I334 PolarHBondContact O-N 2.76Å; I334-L336 PolarHBondContact O-N 2.95Å; I334-M337 HydrophobicContact CD1-SD 4.41Å; I334-M337 WeakPolarHBondContact O-CB 3.38Å; I334-M337 WeakPolarHBondContact O-CG 3.34Å; I334-M337 PolarHBondContact O-N 3.04Å; I334-M337 VanDerWaalsContact O-N 3.1Å; I334-V343 HydrophobicContact CD1-CG1 4.26Å; I334-I354 HydrophobicContact CD1-CG2 3.83Å; I334-I354 HydrophobicContact CG1-CG2 3.61Å; I334-V368 HydrophobicContact CG2-CB 4.49Å; I334-V368 HydrophobicContact CG2-CG1 4.25Å
335	E	94.3	Very high	94.2	Very high	65 Å²	65	42.5 Å²	42.5	30%	0.304	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-10.1	178.3	-67.3	-178.6	175.9	0	0	113.5	K331 M333 H365 K366	K331-E335 WeakPolarHBondContact CE-OE1 3.39Å; K331-E335 HydrophobicContact CG-CG 4.46Å; K331-E335 WeakPolarHBondContact CG-OE1 3.41Å; K331-E335 VanDerWaalsContact O-CG 3.24Å; K331-E335 WeakPolarHBondContact O-CG 3.45Å; K331-E335 PolarHBondContact O-N 3.47Å; M333-E335 VanDerWaalsContact C-N 3.3Å; M333-E335 PolarHBondContact O-N 2.73Å; E335-H365 IonicContact OE1-CD2 3.57Å; E335-H365 IonicContact OE1-CE1 2.6Å; E335-H365 IonicContact OE1-NE2 2.86Å; E335-H365 PolarHBondContact OE1-NE2 2.74Å; E335-K366 HydrophobicContact CG-CD 3.95Å; E335-K366 WeakPolarHBondContact OE1-CD 3.46Å; E335-K366 VanDerWaalsContact OE1-CE 3.28Å; E335-K366 WeakPolarHBondContact OE1-CE 3.39Å; E335-K366 IonicContact OE1-NZ 3.08Å; E335-K366 PolarHBondContact OE1-NZ 3.37Å; E335-K366 VanDerWaalsContact OE1-NZ 3.08Å; E335-K366 IonicContact OE2-NZ 2.69Å; E335-K366 PolarHBondContact OE2-NZ 3.34Å
336	L	94.2	Very high	94.6	Very high	89 Å²	89	43.8 Å²	43.8	47%	0.466	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-12.4	171.1	-65.5	170.2	0	0	0	113.5	Q309 D332 M333 I334	Q309-L336 HydrophobicContact CG-CB 4.24Å; Q309-L336 HydrophobicContact CG-CD1 4.45Å; D332-L336 WeakPolarHBondContact O-CG 3.49Å; M333-L336 WeakPolarHBondContact O-CB 3.45Å; M333-L336 PolarHBondContact O-N 3.36Å; I334-L336 PolarHBondContact O-N 2.95Å
337	M	96.3	Very high	94.9	Very high	14 Å²	14	41.6 Å²	41.6	7%	0.069	21%	0.208	C	C	.	.	S	Bend	trans	-68.5	153.9	179.8	-64.3	-170.6	76.8	0	0	111.3	C308 V311 I314 I334 V343 V368	C308-M337 HydrophobicContact CB-CG 4.18Å; C308-M337 WeakPolarHBondContact O-CG 3.29Å; V311-M337 HydrophobicContact CG2-CE 4.24Å; I314-M337 HydrophobicContact CD1-CE 3.69Å; I314-M337 HydrophobicContact CD1-SD 3.59Å; I314-M337 VanDerWaalsContact CD1-SD 3.59Å; I314-M337 HydrophobicContact CG1-CE 3.7Å; I314-M337 HydrophobicContact CG1-SD 4.19Å; I334-M337 HydrophobicContact CD1-SD 4.41Å; I334-M337 WeakPolarHBondContact O-CB 3.38Å; I334-M337 WeakPolarHBondContact O-CG 3.34Å; I334-M337 PolarHBondContact O-N 3.04Å; I334-M337 VanDerWaalsContact O-N 3.1Å; M337-V343 HydrophobicContact CE-CG1 4.21Å; M337-V343 HydrophobicContact SD-CG1 3.57Å; M337-V343 VanDerWaalsContact SD-CG1 3.57Å; M337-V368 HydrophobicContact CB-CG2 4Å; M337-V368 HydrophobicContact SD-CG1 4.39Å
338	K	95.3	Very high	95	Very high	77 Å²	77	38.1 Å²	38.1	34%	0.335	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-59.3	145.6	173.8	-57.7	171.8	-158.4	153.9	0	110.7	D310 D312 G340 S341	D310-K338 PolarHBondContact O-NZ 3.43Å; D312-K338 IonicContact OD1-NZ 3.96Å; D312-K338 PolarHBondContact OD1-NZ 2.96Å; K338-G340 PolarHBondContact O-N 3.27Å; K338-S341 WeakPolarHBondContact O-CB 3.35Å; K338-S341 PolarHBondContact O-N 2.81Å; K338-S341 VanDerWaalsContact O-N 3.14Å; K338-S341 PolarHBondContact O-OG 3.4Å
339	E	95.4	Very high	94.7	Very high	169 Å²	169	43.4 Å²	43.4	79%	0.79	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	137.5	170.3	-176.9	169.6	-167.6	0	0	110.6	S341	E339-S341 VanDerWaalsContact C-N 3.33Å
340	G	93.9	Very high	94.2	Very high	34 Å²	34	45 Å²	45	35%	0.351	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	85	-0.6	-173.6	0	0	0	0	0	114.7	F211 K338 G367	F211-G340 WeakPolarHBondContact CD2-O 3.31Å; K338-G340 PolarHBondContact O-N 3.27Å; G340-G367 WeakPolarHBondContact CA-O 3.43Å; G340-G367 PolarHBondContact N-O 3.27Å
341	S	97.9	Very high	93.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.229	C	C	.	.			trans	-64.5	157.8	171.6	-71.5	0	0	0	0	112.4	D312 K338 E339 V368 T369	D312-S341 VanDerWaalsContact O-CA 3.25Å; D312-S341 WeakPolarHBondContact O-CA 3.49Å; D312-S341 WeakPolarHBondContact O-CB 3.43Å; D312-S341 PolarHBondContact O-OG 2.99Å; K338-S341 WeakPolarHBondContact O-CB 3.35Å; K338-S341 PolarHBondContact O-N 2.81Å; K338-S341 VanDerWaalsContact O-N 3.14Å; K338-S341 PolarHBondContact O-OG 3.4Å; E339-S341 VanDerWaalsContact C-N 3.33Å; S341-V368 WeakPolarHBondContact O-CA 3.47Å; S341-T369 PolarHBondContact O-N 3.16Å
342	V	98.3	Very high	93.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	134.2	-179.5	-175.3	0	0	0	0	110.5	A207 H210 F211 D312 I313 I314 V344 T369 I371	A207-V342 HydrophobicContact CB-CG1 4.3Å; H210-V342 HydrophobicContact CB-CG2 4.24Å; F211-V342 HydrophobicContact CB-CG2 3.92Å; F211-V342 HydrophobicContact CD2-CG2 4.25Å; D312-V342 PolarHBondContact O-N 3.46Å; D312-V342 VanDerWaalsContact O-N 3.09Å; I313-V342 VanDerWaalsContact CA-O 3.23Å; I313-V342 WeakPolarHBondContact CA-O 3.34Å; I313-V342 HydrophobicContact CG1-CB 4.38Å; I314-V342 PolarHBondContact N-O 2.95Å; V342-V344 HydrophobicContact CG1-CG2 4.15Å; V342-T369 WeakPolarHBondContact CA-O 3.19Å; V342-I371 HydrophobicContact CG1-CD1 3.84Å; V342-I371 HydrophobicContact CG1-CG1 4.17Å
343	V	97.9	Very high	93.6	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.012	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	131.5	172.3	-58.1	0	0	0	0	110.1	I314 I334 M337 I354 V368 T369 H370 I371	I314-V343 HydrophobicContact CB-CG1 4.14Å; I314-V343 CarbonylContact O-C 3.23Å; I314-V343 WeakPolarHBondContact O-CA 3.39Å; I334-V343 HydrophobicContact CD1-CG1 4.26Å; M337-V343 HydrophobicContact CE-CG1 4.21Å; M337-V343 HydrophobicContact SD-CG1 3.57Å; M337-V343 VanDerWaalsContact SD-CG1 3.57Å; V343-I354 HydrophobicContact CB-CD1 3.73Å; V343-I354 HydrophobicContact CG2-CD1 3.88Å; V343-V368 HydrophobicContact CG1-CG1 3.9Å; V343-V368 HydrophobicContact CG2-CG1 4.2Å; V343-T369 PolarHBondContact N-O 2.99Å; V343-H370 HydrophobicContact CG2-CB 4.12Å; V343-H370 VanDerWaalsContact CG2-CD2 3.44Å; V343-H370 WeakPolarHBondContact CG2-CD2 3.49Å; V343-I371 PolarHBondContact O-N 3.47Å
344	V	98	Very high	93.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	117	-179	-169.1	0	0	0	0	109.1	A203 A207 I314 I315 T316 V342 L346 I371	A203-V344 HydrophobicContact CB-CG1 3.87Å; A207-V344 HydrophobicContact CB-CG2 4.03Å; I314-V344 PolarHBondContact O-N 3.39Å; I315-V344 WeakPolarHBondContact CA-O 3.31Å; I315-V344 HydrophobicContact CG1-CB 4.28Å; I315-V344 HydrophobicContact CG1-CG2 4.45Å; T316-V344 PolarHBondContact N-O 2.9Å; V342-V344 HydrophobicContact CG1-CG2 4.15Å; V344-L346 HydrophobicContact CG1-CD2 4.06Å; V344-I371 HydrophobicContact CB-CB 4.47Å; V344-I371 HydrophobicContact CG1-CB 4.21Å; V344-I371 HydrophobicContact CG1-CG2 4.24Å; V344-I371 HydrophobicContact CG2-CB 4.19Å; V344-I371 HydrophobicContact CG2-CD1 4.13Å; V344-I371 HydrophobicContact CG2-CG1 4.43Å
345	D	97.3	Very high	93.6	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	99.5	-176.6	-168.2	-11.7	0	0	0	110.7	T316 A347 G352 N353 I354 T357 I371	T316-D345 WeakPolarHBondContact OG1-CA 3.38Å; T316-D345 PolarHBondContact OG1-OD1 3.37Å; D345-A347 PolarHBondContact O-N 2.85Å; D345-A347 PolarHBondContact OD1-N 3.49Å; D345-G352 WeakPolarHBondContact OD2-CA 3Å; D345-N353 PolarHBondContact OD1-N 2.97Å; D345-N353 PolarHBondContact OD2-N 3.42Å; D345-I354 HydrophobicContact CB-CD1 4.28Å; D345-I354 HydrophobicContact CB-CG1 4.49Å; D345-I354 PolarHBondContact OD2-N 3.19Å; D345-T357 HydrophobicContact CB-CG2 4.18Å; D345-T357 WeakPolarHBondContact CB-OG1 3.5Å; D345-T357 WeakPolarHBondContact OD2-CB 3.44Å; D345-T357 PolarHBondContact OD2-OG1 3.12Å; D345-I371 PolarHBondContact N-O 3.33Å
346	L	94.9	Very high	93.7	Very high	36 Å²	36	36.5 Å²	36.5	19%	0.188	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-11.3	178.6	-56.8	-168.2	0	0	0	112.9	A203 A238 I315 T316 T317 V344 L376	A203-L346 HydrophobicContact CB-CD1 4.36Å; A203-L346 HydrophobicContact CB-CD2 3.87Å; A238-L346 HydrophobicContact CB-CD1 3.86Å; I315-L346 HydrophobicContact CG2-CD1 4.23Å; I315-L346 HydrophobicContact CG2-CG 4.26Å; T316-L346 VanDerWaalsContact O-CB 3.27Å; T316-L346 WeakPolarHBondContact O-CB 3.46Å; T316-L346 PolarHBondContact O-N 3.38Å; T317-L346 HydrophobicContact CG2-CB 4.39Å; T317-L346 HydrophobicContact CG2-CD1 3.63Å; T317-L346 HydrophobicContact CG2-CG 4.18Å; V344-L346 HydrophobicContact CG1-CD2 4.06Å; L346-L376 HydrophobicContact CD2-CD1 3.12Å
347	A	93	Very high	93.7	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.008	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	8.2	179.6	0	0	0	0	0	112.9	A325 D345 E349 A350 G351 G352 N353	A325-A347 HydrophobicContact CB-CB 3.67Å; D345-A347 PolarHBondContact O-N 2.85Å; D345-A347 PolarHBondContact OD1-N 3.49Å; A347-E349 PolarHBondContact O-N 3.42Å; A347-E349 VanDerWaalsContact O-N 3.14Å; A347-A350 PolarHBondContact O-N 2.71Å; A347-G351 PolarHBondContact O-N 3.08Å; A347-G352 WeakPolarHBondContact O-CA 3.29Å; A347-G352 PolarHBondContact O-N 3.2Å; A347-N353 VanDerWaalsContact CB-OD1 3.3Å; A347-N353 WeakPolarHBondContact CB-OD1 3.5Å
348	A	91.6	Very high	93.6	Very high	3 Å²	3	37.1 Å²	37.1	3%	0.025	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-55	-32.7	-175.9	0	0	0	0	0	114.1	A350 G351 T357 G372 T374	A348-A350 VanDerWaalsContact C-N 3.27Å; A348-A350 PolarHBondContact O-N 2.98Å; A348-G351 PolarHBondContact O-N 3.17Å; A348-T357 HydrophobicContact CB-CG2 3.84Å; A348-G372 WeakPolarHBondContact CB-O 3.34Å; A348-T374 HydrophobicContact CB-CG2 4.05Å
349	E	85.4	Confident	93.5	Very high	121 Å²	121	37.2 Å²	37.2	57%	0.565	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-65.5	-29.8	178.4	-172.7	172.7	-160.7	0	0	112.5	R129 A347 T374	R129-E349 IonicContact NH2-OE1 3.47Å; A347-E349 PolarHBondContact O-N 3.42Å; A347-E349 VanDerWaalsContact O-N 3.14Å; E349-T374 HydrophobicContact CB-CG2 4.09Å
350	A	82.9	Confident	93.3	Very high	33 Å²	33	30.9 Å²	30.9	27%	0.273	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-105.1	20.5	-178.1	0	0	0	0	0	113.4	L319 K324 A325 A347 A348	L319-A350 HydrophobicContact CD1-CB 3.38Å; K324-A350 CarbonylContact C-O 3.59Å; K324-A350 VanDerWaalsContact CA-O 3.31Å; K324-A350 WeakPolarHBondContact CA-O 3.16Å; A325-A350 PolarHBondContact N-O 2.97Å; A347-A350 PolarHBondContact O-N 2.71Å; A348-A350 VanDerWaalsContact C-N 3.27Å; A348-A350 PolarHBondContact O-N 2.98Å
351	G	84.8	Confident	93.2	Very high	51 Å²	51	34 Å²	34	53%	0.526	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	114.3	-20.8	177.8	0	0	0	0	0	114.9	A347 A348	A347-G351 PolarHBondContact O-N 3.08Å; A348-G351 PolarHBondContact O-N 3.17Å
352	G	90.9	Very high	93.1	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.01	21%	0.212	C	C	.	.			trans	84.9	149.4	179.8	0	0	0	0	0	114.5	D345 A347	D345-G352 WeakPolarHBondContact OD2-CA 3Å; A347-G352 WeakPolarHBondContact O-CA 3.29Å; A347-G352 PolarHBondContact O-N 3.2Å
353	N	94.6	Very high	93	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	-87.8	-15.3	173	-61.3	132.4	0	0	0	113.3	T316 A318 P326 L328 F329 D345 A347	T316-N353 WeakPolarHBondContact CB-OD1 3.45Å; T316-N353 HydrophobicContact CG2-CB 4.13Å; T316-N353 PolarHBondContact OG1-OD1 3.11Å; A318-N353 PolarHBondContact N-OD1 3.47Å; A318-N353 VanDerWaalsContact N-OD1 3.16Å; A318-N353 PolarHBondContact O-ND2 3.01Å; A318-N353 PolarHBondContact O-OD1 2.89Å; P326-N353 WeakPolarHBondContact O-CA 3.46Å; P326-N353 PolarHBondContact O-ND2 3.3Å; L328-N353 PolarHBondContact N-O 3.48Å; F329-N353 PolarHBondContact N-O 2.73Å; F329-N353 VanDerWaalsContact N-O 3.11Å; D345-N353 PolarHBondContact OD1-N 2.97Å; D345-N353 PolarHBondContact OD2-N 3.42Å; A347-N353 VanDerWaalsContact CB-OD1 3.3Å; A347-N353 WeakPolarHBondContact CB-OD1 3.5Å
354	I	95.1	Very high	92.9	Very high	3 Å²	3	43 Å²	43	2%	0.015	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-110.8	126.6	-176.5	-50	177.4	0	0	0	108.7	T316 F329 I334 V343 D345 T356 T357	T316-I354 HydrophobicContact CG2-CD1 4.36Å; T316-I354 HydrophobicContact CG2-CG1 4.24Å; F329-I354 HydrophobicContact CB-CB 4.47Å; F329-I354 HydrophobicContact CB-CG1 4.22Å; F329-I354 HydrophobicContact CB-CG2 4.21Å; F329-I354 HydrophobicContact CD2-CG1 4.33Å; I334-I354 HydrophobicContact CD1-CG2 3.83Å; I334-I354 HydrophobicContact CG1-CG2 3.61Å; V343-I354 HydrophobicContact CB-CD1 3.73Å; V343-I354 HydrophobicContact CG2-CD1 3.88Å; D345-I354 HydrophobicContact CB-CD1 4.28Å; D345-I354 HydrophobicContact CB-CG1 4.49Å; D345-I354 PolarHBondContact OD2-N 3.19Å; I354-T356 WeakPolarHBondContact CG2-OG1 3.3Å; I354-T356 PolarHBondContact O-N 3.13Å; I354-T356 VanDerWaalsContact O-N 3.13Å; I354-T357 WeakPolarHBondContact CB-OG1 3.41Å; I354-T357 VanDerWaalsContact O-CB 3.31Å; I354-T357 WeakPolarHBondContact O-CB 3.18Å; I354-T357 PolarHBondContact O-N 3.35Å; I354-T357 PolarHBondContact O-OG1 3.39Å
355	E	94.6	Very high	92.7	Very high	116 Å²	116	44.7 Å²	44.7	54%	0.542	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-30.4	-176.1	-172.2	-179.2	-174.7	0	0	112.9	V327 F329 R330 K331	V327-E355 HydrophobicContact CG1-CB 4.06Å; F329-E355 PolarHBondContact O-N 3.1Å; R330-E355 WeakPolarHBondContact CA-OE2 3.42Å; K331-E355 PolarHBondContact N-OE2 3.08Å
356	T	94.9	Very high	92.4	Very high	15 Å²	15	51.7 Å²	51.7	9%	0.092	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	5.4	177.9	48.3	0	0	0	0	113.4	K331 I354 K358 Y363 H370	K331-T356 HydrophobicContact CB-CG2 4.09Å; K331-T356 HydrophobicContact CD-CG2 4.37Å; K331-T356 HydrophobicContact CG-CG2 3.88Å; I354-T356 WeakPolarHBondContact CG2-OG1 3.3Å; I354-T356 PolarHBondContact O-N 3.13Å; I354-T356 VanDerWaalsContact O-N 3.13Å; T356-K358 PolarHBondContact O-N 3.19Å; T356-Y363 PolarHBondContact O-OH 2.93Å; T356-H370 PolarHBondContact OG1-CD2 3.4Å; T356-H370 PolarHBondContact OG1-NE2 3.17Å
357	T	95.3	Very high	92.3	Very high	21 Å²	21	50.8 Å²	50.8	13%	0.129	28%	0.284	C	S	.	.			trans	-66.2	130.2	177.1	-71.8	0	0	0	0	111.2	D345 A348 I354	D345-T357 HydrophobicContact CB-CG2 4.18Å; D345-T357 WeakPolarHBondContact CB-OG1 3.5Å; D345-T357 WeakPolarHBondContact OD2-CB 3.44Å; D345-T357 PolarHBondContact OD2-OG1 3.12Å; A348-T357 HydrophobicContact CB-CG2 3.84Å; I354-T357 WeakPolarHBondContact CB-OG1 3.41Å; I354-T357 VanDerWaalsContact O-CB 3.31Å; I354-T357 WeakPolarHBondContact O-CB 3.18Å; I354-T357 PolarHBondContact O-N 3.35Å; I354-T357 PolarHBondContact O-OG1 3.39Å
358	K	94.6	Very high	92.5	Very high	95 Å²	95	50.8 Å²	50.8	41%	0.413	28%	0.284	S	S	.	.			trans	-106.3	104.9	166.3	-67.6	-176.9	-174.6	177.5	0	108.6	T356 G360 E361 Y363	T356-K358 PolarHBondContact O-N 3.19Å; K358-G360 PolarHBondContact O-N 2.88Å; K358-E361 HydrophobicContact CB-CB 4.02Å; K358-E361 HydrophobicContact CB-CG 4.4Å; K358-E361 VanDerWaalsContact CD-OE2 3.22Å; K358-E361 WeakPolarHBondContact CD-OE2 3.19Å; K358-E361 PolarHBondContact O-N 3.42Å; K358-E361 VanDerWaalsContact O-N 3.11Å; K358-Y363 HydrophobicContact CB-CD1 4.2Å; K358-Y363 HydrophobicContact CB-CE1 3.88Å; K358-Y363 HydrophobicContact CD-CD1 3.93Å; K358-Y363 HydrophobicContact CD-CE1 3.71Å; K358-Y363 HydrophobicContact CD-CE2 4.46Å; K358-Y363 HydrophobicContact CD-CG 4.41Å; K358-Y363 HydrophobicContact CG-CD1 4.22Å; K358-Y363 HydrophobicContact CG-CE1 3.63Å
359	P	92.6	Very high	92.8	Very high	79 Å²	79	51.5 Å²	51.5	51%	0.513	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	130	-176.1	-26.6	35.3	0	0	0	112.3	E361 T374	P359-E361 VanDerWaalsContact C-N 3.32Å; P359-T374 HydrophobicContact CB-CG2 3.99Å
360	G	90.1	Very high	93.4	Very high	36 Å²	36	45.9 Å²	45.9	37%	0.371	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	-10.4	-179	0	0	0	0	0	115.2	K358 G372 Y373	K358-G360 PolarHBondContact O-N 2.88Å; G360-G372 PolarHBondContact N-O 2.9Å; G360-Y373 WeakPolarHBondContact O-CD1 3.46Å
361	E	92.8	Very high	94	Very high	101 Å²	101	44.4 Å²	44.4	47%	0.472	25%	0.249	S	C	.	.			trans	-105.5	152.2	-175.6	-65.5	-177.4	-164.8	0	0	112.9	K358 P359 G372	K358-E361 HydrophobicContact CB-CB 4.02Å; K358-E361 HydrophobicContact CB-CG 4.4Å; K358-E361 VanDerWaalsContact CD-OE2 3.22Å; K358-E361 WeakPolarHBondContact CD-OE2 3.19Å; K358-E361 PolarHBondContact O-N 3.42Å; K358-E361 VanDerWaalsContact O-N 3.11Å; P359-E361 VanDerWaalsContact C-N 3.32Å; E361-G372 PolarHBondContact O-N 2.96Å
362	L	94.8	Very high	94.6	Very high	55 Å²	55	42.1 Å²	42.1	29%	0.288	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	121.6	161.5	-178.2	156.7	0	0	0	107.5	H210 T369 H370 I371 Y373	H210-L362 VanDerWaalsContact CE1-CD1 3.48Å; H210-L362 WeakPolarHBondContact CE1-CD1 3.12Å; H210-L362 WeakPolarHBondContact NE2-CD1 3.42Å; L362-T369 HydrophobicContact CD2-CG2 4.08Å; L362-T369 HydrophobicContact CG-CG2 4.27Å; L362-H370 VanDerWaalsContact CA-O 3.31Å; L362-H370 WeakPolarHBondContact CA-O 3.1Å; L362-I371 HydrophobicContact CD1-CD1 4.29Å; L362-I371 HydrophobicContact CD1-CG1 3.98Å; L362-I371 HydrophobicContact CG-CG1 4.35Å; L362-Y373 HydrophobicContact CB-CE1 4.05Å; L362-Y373 HydrophobicContact CB-CE2 4.43Å; L362-Y373 VanDerWaalsContact CB-OH 3.32Å; L362-Y373 WeakPolarHBondContact CB-OH 3.34Å; L362-Y373 HydrophobicContact CD1-CE2 4.21Å
363	Y	97.2	Very high	94.7	Very high	41 Å²	41	43.9 Å²	43.9	16%	0.161	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	161.2	-178.7	82.2	-78.9	0	0	0	111.6	T356 K358 H365 H370	T356-Y363 PolarHBondContact O-OH 2.93Å; K358-Y363 HydrophobicContact CB-CD1 4.2Å; K358-Y363 HydrophobicContact CB-CE1 3.88Å; K358-Y363 HydrophobicContact CD-CD1 3.93Å; K358-Y363 HydrophobicContact CD-CE1 3.71Å; K358-Y363 HydrophobicContact CD-CE2 4.46Å; K358-Y363 HydrophobicContact CD-CG 4.41Å; K358-Y363 HydrophobicContact CG-CD1 4.22Å; K358-Y363 HydrophobicContact CG-CE1 3.63Å; Y363-H365 HydrophobicContact CD2-CB 4.48Å; Y363-H365 HydrophobicContact CE2-CB 3.74Å; Y363-H370 HydrophobicContact CD1-CB 4.03Å; Y363-H370 HydrophobicContact CE1-CB 3.8Å; Y363-H370 PolarHBondContact N-O 3.5Å; Y363-H370 VanDerWaalsContact N-O 3.16Å; Y363-H370 PolarHBondContact O-N 3.44Å
364	V	96.1	Very high	94.6	Very high	95 Å²	95	46.8 Å²	46.8	58%	0.576	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101	125.2	178.4	-178.7	0	0	0	0	109
365	H	93.6	Very high	94.4	Very high	34 Å²	34	48.2 Å²	48.2	16%	0.157	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	112.2	173.4	-178.4	69.7	0	0	0	108.9	E335 Y363 G367 V368	E335-H365 IonicContact OE1-CD2 3.57Å; E335-H365 IonicContact OE1-CE1 2.6Å; E335-H365 IonicContact OE1-NE2 2.86Å; E335-H365 PolarHBondContact OE1-NE2 2.74Å; Y363-H365 HydrophobicContact CD2-CB 4.48Å; Y363-H365 HydrophobicContact CE2-CB 3.74Å; H365-G367 VanDerWaalsContact C-N 3.25Å; H365-G367 PolarHBondContact O-N 3.33Å; H365-G367 VanDerWaalsContact O-N 3.15Å; H365-V368 PolarHBondContact N-O 2.76Å; H365-V368 PolarHBondContact O-N 3.22Å
366	K	91.8	Very high	94.3	Very high	148 Å²	148	43 Å²	43	64%	0.643	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.1	46.2	-179.8	-63.3	-169.8	-179.1	176.2	0	114	E335 V368	E335-K366 HydrophobicContact CG-CD 3.95Å; E335-K366 WeakPolarHBondContact OE1-CD 3.46Å; E335-K366 VanDerWaalsContact OE1-CE 3.28Å; E335-K366 WeakPolarHBondContact OE1-CE 3.39Å; E335-K366 IonicContact OE1-NZ 3.08Å; E335-K366 PolarHBondContact OE1-NZ 3.37Å; E335-K366 VanDerWaalsContact OE1-NZ 3.08Å; E335-K366 IonicContact OE2-NZ 2.69Å; E335-K366 PolarHBondContact OE2-NZ 3.34Å; K366-V368 VanDerWaalsContact C-N 3.32Å; K366-V368 PolarHBondContact O-N 3.33Å
367	G	91	Very high	94.2	Very high	17 Å²	17	43.2 Å²	43.2	18%	0.175	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.8	-7.1	178.3	0	0	0	0	0	115.6	G340 H365	G340-G367 WeakPolarHBondContact CA-O 3.43Å; G340-G367 PolarHBondContact N-O 3.27Å; H365-G367 VanDerWaalsContact C-N 3.25Å; H365-G367 PolarHBondContact O-N 3.33Å; H365-G367 VanDerWaalsContact O-N 3.15Å
368	V	97.1	Very high	94.2	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.012	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	124.7	174.8	-177.1	0	0	0	0	110	I334 M337 S341 V343 H365 K366 H370	I334-V368 HydrophobicContact CG2-CB 4.49Å; I334-V368 HydrophobicContact CG2-CG1 4.25Å; M337-V368 HydrophobicContact CB-CG2 4Å; M337-V368 HydrophobicContact SD-CG1 4.39Å; S341-V368 WeakPolarHBondContact O-CA 3.47Å; V343-V368 HydrophobicContact CG1-CG1 3.9Å; V343-V368 HydrophobicContact CG2-CG1 4.2Å; H365-V368 PolarHBondContact N-O 2.76Å; H365-V368 PolarHBondContact O-N 3.22Å; K366-V368 VanDerWaalsContact C-N 3.32Å; K366-V368 PolarHBondContact O-N 3.33Å; V368-H370 PolarHBondContact O-ND1 2.8Å; V368-H370 VanDerWaalsContact O-ND1 3.08Å
369	T	97.9	Very high	94.2	Very high	18 Å²	18	41.8 Å²	41.8	11%	0.11	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	120.4	178.7	-57.7	0	0	0	0	110	H210 S341 V342 V343 L362 I371	H210-T369 HydrophobicContact CB-CG2 4.3Å; S341-T369 PolarHBondContact O-N 3.16Å; V342-T369 WeakPolarHBondContact CA-O 3.19Å; V343-T369 PolarHBondContact N-O 2.99Å; L362-T369 HydrophobicContact CD2-CG2 4.08Å; L362-T369 HydrophobicContact CG-CG2 4.27Å; T369-I371 HydrophobicContact CG2-CG1 4.45Å
370	H	97.9	Very high	94.4	Very high	3 Å²	3	40.4 Å²	40.4	1%	0.014	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	126.7	177.3	-70.1	59.3	0	0	0	110.1	V343 T356 L362 Y363 V368	V343-H370 HydrophobicContact CG2-CB 4.12Å; V343-H370 VanDerWaalsContact CG2-CD2 3.44Å; V343-H370 WeakPolarHBondContact CG2-CD2 3.49Å; T356-H370 PolarHBondContact OG1-CD2 3.4Å; T356-H370 PolarHBondContact OG1-NE2 3.17Å; L362-H370 VanDerWaalsContact CA-O 3.31Å; L362-H370 WeakPolarHBondContact CA-O 3.1Å; Y363-H370 HydrophobicContact CD1-CB 4.03Å; Y363-H370 HydrophobicContact CE1-CB 3.8Å; Y363-H370 PolarHBondContact N-O 3.5Å; Y363-H370 VanDerWaalsContact N-O 3.16Å; Y363-H370 PolarHBondContact O-N 3.44Å; V368-H370 PolarHBondContact O-ND1 2.8Å; V368-H370 VanDerWaalsContact O-ND1 3.08Å
371	I	97.4	Very high	94.6	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	98.5	174.7	-52.8	-173.4	0	0	0	107.9	L206 H210 V342 V343 V344 D345 L362 T369 Y373	L206-I371 HydrophobicContact CB-CD1 4.01Å; L206-I371 HydrophobicContact CD1-CG2 4.35Å; H210-I371 HydrophobicContact CB-CD1 4.36Å; V342-I371 HydrophobicContact CG1-CD1 3.84Å; V342-I371 HydrophobicContact CG1-CG1 4.17Å; V343-I371 PolarHBondContact O-N 3.47Å; V344-I371 HydrophobicContact CB-CB 4.47Å; V344-I371 HydrophobicContact CG1-CB 4.21Å; V344-I371 HydrophobicContact CG1-CG2 4.24Å; V344-I371 HydrophobicContact CG2-CB 4.19Å; V344-I371 HydrophobicContact CG2-CD1 4.13Å; V344-I371 HydrophobicContact CG2-CG1 4.43Å; D345-I371 PolarHBondContact N-O 3.33Å; L362-I371 HydrophobicContact CD1-CD1 4.29Å; L362-I371 HydrophobicContact CD1-CG1 3.98Å; L362-I371 HydrophobicContact CG-CG1 4.35Å; T369-I371 HydrophobicContact CG2-CG1 4.45Å; I371-Y373 HydrophobicContact CG2-CD2 3.55Å; I371-Y373 HydrophobicContact CG2-CE2 3.9Å; I371-Y373 HydrophobicContact CG2-CG 4.28Å
372	G	95.5	Very high	94.8	Very high	2 Å²	2	37 Å²	37	2%	0.021	19%	0.192	C	C	.	.			trans	-107.1	24.4	-177.9	0	0	0	0	0	114.1	A348 G360 E361 T374	A348-G372 WeakPolarHBondContact CB-O 3.34Å; G360-G372 PolarHBondContact N-O 2.9Å; E361-G372 PolarHBondContact O-N 2.96Å; G372-T374 PolarHBondContact O-N 3.38Å
373	Y	94.4	Very high	94.9	Very high	39 Å²	39	38.9 Å²	38.9	15%	0.153	20%	0.199	C	C	.	.			trans	-60.7	131.5	-176.9	-64.5	-43.4	0	0	0	112.4	L206 G360 L362 I371 L376 R379	L206-Y373 HydrophobicContact CD1-CD2 4.04Å; L206-Y373 HydrophobicContact CD1-CE2 4.33Å; G360-Y373 WeakPolarHBondContact O-CD1 3.46Å; L362-Y373 HydrophobicContact CB-CE1 4.05Å; L362-Y373 HydrophobicContact CB-CE2 4.43Å; L362-Y373 VanDerWaalsContact CB-OH 3.32Å; L362-Y373 WeakPolarHBondContact CB-OH 3.34Å; L362-Y373 HydrophobicContact CD1-CE2 4.21Å; I371-Y373 HydrophobicContact CG2-CD2 3.55Å; I371-Y373 HydrophobicContact CG2-CE2 3.9Å; I371-Y373 HydrophobicContact CG2-CG 4.28Å; Y373-L376 HydrophobicContact CD2-CD2 4.27Å; Y373-R379 VanDerWaalsContact CD1-NH2 3.26Å
374	T	91.1	Very high	94.8	Very high	61 Å²	61	37 Å²	37	37%	0.374	19%	0.191	S	C	.	.	S	Bend	trans	-94.8	-0.9	178.2	53.6	0	0	0	0	113	A348 E349 P359 G372	A348-T374 HydrophobicContact CB-CG2 4.05Å; E349-T374 HydrophobicContact CB-CG2 4.09Å; P359-T374 HydrophobicContact CB-CG2 3.99Å; G372-T374 PolarHBondContact O-N 3.38Å
375	D	91.4	Very high	94.9	Very high	32 Å²	32	32.4 Å²	32.4	17%	0.171	16%	0.164	C	C	.	.			trans	-121.2	28.5	-172.8	69.6	-23.6	0	0	0	112.8	S378 R379	D375-S378 WeakPolarHBondContact O-CA 3.37Å; D375-S378 WeakPolarHBondContact O-CB 3.3Å; D375-S378 PolarHBondContact O-N 2.77Å; D375-R379 PolarHBondContact O-N 2.81Å; D375-R379 IonicContact OD1-CZ 3.81Å; D375-R379 IonicContact OD1-NE 2.95Å; D375-R379 PolarHBondContact OD1-NE 3.37Å; D375-R379 IonicContact OD1-NH2 3.01Å; D375-R379 PolarHBondContact OD1-NH2 3.05Å; D375-R379 IonicContact OD2-NE 2.63Å; D375-R379 IonicContact OD2-NH2 3.71Å; D375-R379 PolarHBondContact OD2-NH2 3.24Å
376	L	93	Very high	95	Very high	8 Å²	8	32.7 Å²	32.7	4%	0.042	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-53.2	-44.8	-171.9	-74.2	168.4	0	0	0	114.8	A199 K202 L206 L346 Y373 S378 R379	A199-L376 HydrophobicContact CB-CB 4.32Å; K202-L376 HydrophobicContact CG-CD2 4.22Å; L206-L376 HydrophobicContact CD1-CD2 3.4Å; L206-L376 VanDerWaalsContact CD1-CD2 3.4Å; L346-L376 HydrophobicContact CD2-CD1 3.12Å; Y373-L376 HydrophobicContact CD2-CD2 4.27Å; L376-S378 PolarHBondContact O-N 3.35Å; L376-R379 WeakPolarHBondContact O-CB 3.47Å; L376-R379 PolarHBondContact O-N 2.95Å
377	P	93.7	Very high	95.2	Very high	19 Å²	19	27.6 Å²	27.6	12%	0.123	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-60.7	-30.8	174.2	-24.9	35.7	0	0	0	113.9	M195 I198 A199 R379 M380 A384	M195-P377 HydrophobicContact CB-CG 4.15Å; M195-P377 HydrophobicContact SD-CB 3.76Å; M195-P377 HydrophobicContact SD-CG 4.25Å; I198-P377 HydrophobicContact CG2-CB 4.43Å; A199-P377 HydrophobicContact CB-CG 4.42Å; P377-R379 PolarHBondContact O-N 2.82Å; P377-M380 CarbonylContact O-C 3.59Å; P377-M380 VanDerWaalsContact O-C 3.31Å; P377-M380 PolarHBondContact O-N 2.9Å; P377-M380 VanDerWaalsContact O-N 3.11Å; P377-A384 HydrophobicContact CB-CB 4.29Å; P377-A384 WeakPolarHBondContact O-CB 3.31Å
378	S	95	Very high	95.5	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.014	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-64.3	-25.8	175.5	-172	0	0	0	0	112.2	N68 K70 D375 L376 M380 A381	N68-S378 PolarHBondContact O-OG 3.2Å; K70-S378 WeakPolarHBondContact CB-OG 3.41Å; K70-S378 PolarHBondContact N-OG 3.27Å; D375-S378 WeakPolarHBondContact O-CA 3.37Å; D375-S378 WeakPolarHBondContact O-CB 3.3Å; D375-S378 PolarHBondContact O-N 2.77Å; L376-S378 PolarHBondContact O-N 3.35Å; S378-M380 PolarHBondContact O-N 3.25Å; S378-A381 WeakPolarHBondContact O-CB 3.36Å; S378-A381 PolarHBondContact O-N 2.91Å
379	R	94.4	Very high	95.5	Very high	84 Å²	84	26.8 Å²	26.8	32%	0.317	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-79.1	-4.9	176.9	-58.4	174.3	-177.7	-97.8	-11.1	113.4	Y373 D375 L376 P377	Y373-R379 VanDerWaalsContact CD1-NH2 3.26Å; D375-R379 PolarHBondContact O-N 2.81Å; D375-R379 IonicContact OD1-CZ 3.81Å; D375-R379 IonicContact OD1-NE 2.95Å; D375-R379 PolarHBondContact OD1-NE 3.37Å; D375-R379 IonicContact OD1-NH2 3.01Å; D375-R379 PolarHBondContact OD1-NH2 3.05Å; D375-R379 IonicContact OD2-NE 2.63Å; D375-R379 IonicContact OD2-NH2 3.71Å; D375-R379 PolarHBondContact OD2-NH2 3.24Å; L376-R379 WeakPolarHBondContact O-CB 3.47Å; L376-R379 PolarHBondContact O-N 2.95Å; P377-R379 PolarHBondContact O-N 2.82Å
380	M	95.9	Very high	95.4	Very high	50 Å²	50	28.7 Å²	28.7	25%	0.246	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-128.8	48.5	167.8	-68.9	-173.3	67.6	0	0	109.8	I198 Y201 K202 P377 S378 T382 Q383 A384	I198-M380 HydrophobicContact CG2-CB 3.96Å; I198-M380 HydrophobicContact CG2-SD 4.28Å; Y201-M380 HydrophobicContact CD1-CE 3.8Å; Y201-M380 HydrophobicContact CD1-SD 3.65Å; Y201-M380 HydrophobicContact CE1-CE 3.72Å; Y201-M380 HydrophobicContact CE1-SD 3.96Å; K202-M380 HydrophobicContact CB-CG 4.45Å; K202-M380 HydrophobicContact CB-SD 3.89Å; K202-M380 HydrophobicContact CD-CG 3.81Å; K202-M380 HydrophobicContact CD-SD 3.81Å; K202-M380 HydrophobicContact CG-CG 4.23Å; K202-M380 HydrophobicContact CG-SD 4.22Å; P377-M380 CarbonylContact O-C 3.59Å; P377-M380 VanDerWaalsContact O-C 3.31Å; P377-M380 PolarHBondContact O-N 2.9Å; P377-M380 VanDerWaalsContact O-N 3.11Å; S378-M380 PolarHBondContact O-N 3.25Å; M380-T382 VanDerWaalsContact C-N 3.29Å; M380-T382 PolarHBondContact O-N 3.35Å; M380-T382 VanDerWaalsContact O-N 3.16Å; M380-Q383 PolarHBondContact O-N 3.3Å; M380-Q383 VanDerWaalsContact O-N 3.15Å; M380-A384 PolarHBondContact O-N 3.13Å
381	A	95.3	Very high	95.3	Very high	8 Å²	8	29 Å²	29	7%	0.066	15%	0.15	C	C	.	.	H	α-helix	trans	-53.4	-39.2	-168.3	0	0	0	0	0	114.5	K70 R71 S378 A384 S385	K70-A381 HydrophobicContact CB-CB 3.67Å; R71-A381 HydrophobicContact CG-CB 4.28Å; S378-A381 WeakPolarHBondContact O-CB 3.36Å; S378-A381 PolarHBondContact O-N 2.91Å; A381-A384 PolarHBondContact O-N 3.41Å; A381-S385 WeakPolarHBondContact O-CB 3.49Å; A381-S385 PolarHBondContact O-N 3.48Å; A381-S385 PolarHBondContact O-OG 3.44Å
382	T	96.5	Very high	95.2	Very high	58 Å²	58	28.9 Å²	28.9	36%	0.356	15%	0.15	S	C	.	.	H	α-helix	trans	-60.6	-53.4	178.5	-48	0	0	0	0	111.4	S99 F101 M380 A384 S385 T386	S99-T382 WeakPolarHBondContact O-CB 3.33Å; S99-T382 PolarHBondContact O-OG1 3.39Å; F101-T382 HydrophobicContact CE1-CG2 4.12Å; F101-T382 HydrophobicContact CE2-CG2 4.44Å; F101-T382 HydrophobicContact CZ-CG2 3.74Å; M380-T382 VanDerWaalsContact C-N 3.29Å; M380-T382 PolarHBondContact O-N 3.35Å; M380-T382 VanDerWaalsContact O-N 3.16Å; T382-A384 PolarHBondContact O-N 3.08Å; T382-S385 PolarHBondContact O-N 2.6Å; T382-T386 PolarHBondContact O-N 3.45Å; T382-T386 PolarHBondContact O-OG1 3.2Å
383	Q	96.3	Very high	95.1	Very high	94 Å²	94	29.7 Å²	29.7	44%	0.439	15%	0.153	S	C	.	.	H	α-helix	trans	-65	-41.3	179.7	-171.8	63.2	17.4	0	0	111.8	I198 M380 T386 L387	I198-Q383 HydrophobicContact CD1-CG 4.5Å; I198-Q383 HydrophobicContact CG1-CG 4.47Å; M380-Q383 PolarHBondContact O-N 3.3Å; M380-Q383 VanDerWaalsContact O-N 3.15Å; Q383-T386 PolarHBondContact O-N 3.3Å; Q383-L387 PolarHBondContact O-N 3.46Å
384	A	95.9	Very high	95.1	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.4	-43.5	177.8	0	0	0	0	0	112.2	R71 M195 I198 P377 M380 A381 T382 Y388	R71-A384 VanDerWaalsContact CD-CB 3.45Å; R71-A384 HydrophobicContact CG-CB 3.83Å; M195-A384 HydrophobicContact CE-CB 4.29Å; M195-A384 HydrophobicContact SD-CB 4.22Å; I198-A384 VanDerWaalsContact CD1-CA 3.42Å; I198-A384 HydrophobicContact CD1-CB 3.77Å; P377-A384 HydrophobicContact CB-CB 4.29Å; P377-A384 WeakPolarHBondContact O-CB 3.31Å; M380-A384 PolarHBondContact O-N 3.13Å; A381-A384 PolarHBondContact O-N 3.41Å; T382-A384 PolarHBondContact O-N 3.08Å; A384-Y388 WeakPolarHBondContact O-CB 3.39Å; A384-Y388 PolarHBondContact O-N 2.92Å
385	S	97.1	Very high	95.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.9	-41.4	177.3	-56.8	0	0	0	0	111.6	R71 V72 S99 A381 T382 S389	R71-S385 WeakPolarHBondContact CA-OG 3.48Å; V72-S385 PolarHBondContact N-OG 3.37Å; V72-S385 VanDerWaalsContact O-CB 3.29Å; V72-S385 WeakPolarHBondContact O-CB 3.36Å; V72-S385 PolarHBondContact O-OG 3.35Å; S99-S385 PolarHBondContact OG-OG 2.91Å; A381-S385 WeakPolarHBondContact O-CB 3.49Å; A381-S385 PolarHBondContact O-N 3.48Å; A381-S385 PolarHBondContact O-OG 3.44Å; T382-S385 PolarHBondContact O-N 2.6Å; S385-S389 WeakPolarHBondContact O-CB 3.3Å; S385-S389 PolarHBondContact O-N 3.44Å
386	T	96.3	Very high	95.2	Very high	39 Å²	39	28.7 Å²	28.7	24%	0.239	14%	0.143	C	C	.	.	H	α-helix	trans	-62.5	-48.9	176.3	-56.3	0	0	0	0	112	T382 Q383 S389 N390	T382-T386 PolarHBondContact O-N 3.45Å; T382-T386 PolarHBondContact O-OG1 3.2Å; Q383-T386 PolarHBondContact O-N 3.3Å; T386-S389 PolarHBondContact O-N 2.69Å; T386-N390 WeakPolarHBondContact O-CB 3.44Å; T386-N390 PolarHBondContact O-N 3.01Å; T386-N390 PolarHBondContact O-ND2 3.48Å
387	L	95.4	Very high	95	Very high	42 Å²	42	35.1 Å²	35.1	22%	0.22	17%	0.171	C	C	.	.	H	α-helix	trans	-68.1	-41.3	179.6	-69.3	-173.6	0	0	0	112.6	I198 Q383 N390 N391	I198-L387 HydrophobicContact CD1-CD1 3.98Å; I198-L387 HydrophobicContact CG1-CD1 4.25Å; Q383-L387 PolarHBondContact O-N 3.46Å; L387-N390 PolarHBondContact O-N 3.36Å; L387-N391 VanDerWaalsContact O-CG 3.24Å; L387-N391 PolarHBondContact O-N 3.24Å; L387-N391 PolarHBondContact O-OD1 3.33Å
388	Y	97.3	Very high	94.8	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-64.8	-41.1	176.6	-174.1	-113.2	0	0	0	111.6	A73 K127 V128 F154 M177 A191 A384 N390 N391 I392	A73-Y388 HydrophobicContact CB-CE1 4.26Å; K127-Y388 WeakPolarHBondContact O-CE1 3.23Å; K127-Y388 PolarHBondContact O-OH 3.42Å; V128-Y388 HydrophobicContact CB-CE1 4.24Å; V128-Y388 HydrophobicContact CG1-CE1 4.42Å; V128-Y388 HydrophobicContact CG2-CD1 4.13Å; V128-Y388 HydrophobicContact CG2-CE1 4.02Å; F154-Y388 HydrophobicContact CD2-CE2 4.32Å; F154-Y388 HydrophobicContact CE2-CD2 4.26Å; F154-Y388 AromaticContact CE2-CE2 3.74Å; F154-Y388 HydrophobicContact CE2-CE2 3.74Å; F154-Y388 HydrophobicContact CZ-CE2 4.11Å; M177-Y388 HydrophobicContact CB-CE2 4.32Å; M177-Y388 HydrophobicContact CE-CE2 4.47Å; M177-Y388 HydrophobicContact CG-CE2 4.08Å; A191-Y388 HydrophobicContact CB-CD2 3.86Å; A191-Y388 HydrophobicContact CB-CE2 3.83Å; A384-Y388 WeakPolarHBondContact O-CB 3.39Å; A384-Y388 PolarHBondContact O-N 2.92Å; Y388-N390 PolarHBondContact O-N 3.45Å; Y388-N391 WeakPolarHBondContact O-CB 3.49Å; Y388-N391 PolarHBondContact O-N 3.21Å; Y388-I392 HydrophobicContact CD1-CD1 3.61Å; Y388-I392 HydrophobicContact CE1-CD1 3.29Å; Y388-I392 HydrophobicContact CE1-CG1 4.32Å; Y388-I392 HydrophobicContact CE2-CD1 4.38Å; Y388-I392 HydrophobicContact CG-CD1 4.29Å; Y388-I392 WeakPolarHBondContact O-CG1 3.34Å; Y388-I392 PolarHBondContact O-N 3.48Å
389	S	97.3	Very high	94.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58.5	-45.9	172.2	-179.5	0	0	0	0	111.8	A73 S75 S385 T386 N391 I392 I393	A73-S389 WeakPolarHBondContact O-CA 3.46Å; S75-S389 PolarHBondContact N-OG 3.13Å; S75-S389 VanDerWaalsContact N-OG 3.13Å; S75-S389 PolarHBondContact OG-OG 3.39Å; S385-S389 WeakPolarHBondContact O-CB 3.3Å; S385-S389 PolarHBondContact O-N 3.44Å; T386-S389 PolarHBondContact O-N 2.69Å; S389-N391 VanDerWaalsContact C-N 3.31Å; S389-N391 PolarHBondContact O-N 3.28Å; S389-I392 PolarHBondContact O-N 3.43Å; S389-I393 VanDerWaalsContact O-CD1 3.23Å; S389-I393 WeakPolarHBondContact O-CD1 3.44Å; S389-I393 VanDerWaalsContact O-CG1 3.25Å; S389-I393 WeakPolarHBondContact O-CG1 3.26Å; S389-I393 PolarHBondContact O-N 3.22Å
390	N	95.6	Very high	94.3	Very high	58 Å²	58	31.9 Å²	31.9	31%	0.31	16%	0.162	S	C	.	.	H	α-helix	trans	-60.9	-40	176.1	-73.4	-18.9	0	0	0	112.3	T386 L387 Y388 I393 K394	T386-N390 WeakPolarHBondContact O-CB 3.44Å; T386-N390 PolarHBondContact O-N 3.01Å; T386-N390 PolarHBondContact O-ND2 3.48Å; L387-N390 PolarHBondContact O-N 3.36Å; Y388-N390 PolarHBondContact O-N 3.45Å; N390-I393 PolarHBondContact O-N 3.06Å; N390-K394 WeakPolarHBondContact O-CB 3.3Å; N390-K394 VanDerWaalsContact O-CG 3.29Å; N390-K394 WeakPolarHBondContact O-CG 3.37Å; N390-K394 PolarHBondContact O-N 3.39Å
391	N	96	Very high	93.7	Very high	8 Å²	8	34.4 Å²	34.4	4%	0.043	18%	0.183	C	C	.	.	H	α-helix	trans	-62.8	-47.9	177.2	-70.2	-15.8	0	0	0	111.3	M177 G188 Y189 D190 A191 S194 L387 Y388 S389 I393 K394 L395	M177-N391 HydrophobicContact CE-CB 4.18Å; G188-N391 PolarHBondContact O-OD1 3.13Å; Y189-N391 WeakPolarHBondContact CB-O 3.42Å; D190-N391 PolarHBondContact O-ND2 2.93Å; D190-N391 VanDerWaalsContact O-ND2 3.08Å; A191-N391 VanDerWaalsContact CA-ND2 3.3Å; A191-N391 WeakPolarHBondContact CA-ND2 3.16Å; S194-N391 WeakPolarHBondContact CB-ND2 3.34Å; S194-N391 PolarHBondContact OG-ND2 3.16Å; L387-N391 VanDerWaalsContact O-CG 3.24Å; L387-N391 PolarHBondContact O-N 3.24Å; L387-N391 PolarHBondContact O-OD1 3.33Å; Y388-N391 WeakPolarHBondContact O-CB 3.49Å; Y388-N391 PolarHBondContact O-N 3.21Å; S389-N391 VanDerWaalsContact C-N 3.31Å; S389-N391 PolarHBondContact O-N 3.28Å; N391-I393 VanDerWaalsContact C-N 3.34Å; N391-I393 PolarHBondContact O-N 3.41Å; N391-K394 PolarHBondContact O-N 3.32Å; N391-L395 WeakPolarHBondContact O-CB 3.37Å; N391-L395 PolarHBondContact O-N 2.95Å
392	I	95.6	Very high	93.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-59.1	-45.5	177.6	-70.7	157.9	0	0	0	111.1	L74 V126 I152 M177 Y388 S389 L395 L396	L74-I392 HydrophobicContact CD2-CG2 4.29Å; V126-I392 HydrophobicContact CG1-CD1 3.43Å; V126-I392 VanDerWaalsContact CG1-CD1 3.43Å; V126-I392 HydrophobicContact CG1-CG1 4.24Å; V126-I392 HydrophobicContact CG1-CG2 3.92Å; I152-I392 HydrophobicContact CD1-CG2 4.45Å; I152-I392 HydrophobicContact CG2-CG1 4.27Å; M177-I392 HydrophobicContact CE-CG1 4.28Å; M177-I392 HydrophobicContact SD-CG1 4.39Å; Y388-I392 HydrophobicContact CD1-CD1 3.61Å; Y388-I392 HydrophobicContact CE1-CD1 3.29Å; Y388-I392 HydrophobicContact CE1-CG1 4.32Å; Y388-I392 HydrophobicContact CE2-CD1 4.38Å; Y388-I392 HydrophobicContact CG-CD1 4.29Å; Y388-I392 WeakPolarHBondContact O-CG1 3.34Å; Y388-I392 PolarHBondContact O-N 3.48Å; S389-I392 PolarHBondContact O-N 3.43Å; I392-L395 PolarHBondContact O-N 2.97Å; I392-L396 HydrophobicContact CG2-CD1 3.86Å; I392-L396 HydrophobicContact CG2-CG 4.36Å; I392-L396 WeakPolarHBondContact O-CB 3.36Å; I392-L396 WeakPolarHBondContact O-CG 3.46Å; I392-L396 PolarHBondContact O-N 2.92Å
393	I	94.3	Very high	92.4	Very high	19 Å²	19	43 Å²	43	10%	0.097	22%	0.216	C	C	.	.	H	α-helix	trans	-66.5	-44	-177.8	-66.5	156.4	0	0	0	111.2	G78 A81 L82 S389 N390 N391 L395 L396 K397	G78-I393 WeakPolarHBondContact O-CD1 3.45Å; A81-I393 HydrophobicContact CB-CD1 4.29Å; A81-I393 HydrophobicContact CB-CG2 4.11Å; L82-I393 HydrophobicContact CD2-CG1 4.32Å; L82-I393 HydrophobicContact CG-CG1 4.33Å; S389-I393 VanDerWaalsContact O-CD1 3.23Å; S389-I393 WeakPolarHBondContact O-CD1 3.44Å; S389-I393 VanDerWaalsContact O-CG1 3.25Å; S389-I393 WeakPolarHBondContact O-CG1 3.26Å; S389-I393 PolarHBondContact O-N 3.22Å; N390-I393 PolarHBondContact O-N 3.06Å; N391-I393 VanDerWaalsContact C-N 3.34Å; N391-I393 PolarHBondContact O-N 3.41Å; I393-L395 VanDerWaalsContact C-N 3.31Å; I393-L395 PolarHBondContact O-N 3.04Å; I393-L396 PolarHBondContact O-N 3.33Å; I393-K397 VanDerWaalsContact O-CB 3.32Å; I393-K397 WeakPolarHBondContact O-CB 3.39Å; I393-K397 PolarHBondContact O-N 2.86Å
394	K	92.6	Very high	91.8	Very high	112 Å²	112	45 Å²	45	49%	0.487	23%	0.225	S	C	.	.	H	α-helix	trans	-64.5	-37.7	176.8	-74.3	175.2	177.8	-178.1	0	111.4	G188 Y189 N390 N391 A398	G188-K394 WeakPolarHBondContact O-CD 3.34Å; Y189-K394 HydrophobicContact CD1-CB 4.08Å; N390-K394 WeakPolarHBondContact O-CB 3.3Å; N390-K394 VanDerWaalsContact O-CG 3.29Å; N390-K394 WeakPolarHBondContact O-CG 3.37Å; N390-K394 PolarHBondContact O-N 3.39Å; N391-K394 PolarHBondContact O-N 3.32Å; K394-A398 WeakPolarHBondContact O-CB 3.23Å; K394-A398 PolarHBondContact O-N 3.49Å
395	L	93.5	Very high	91.4	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.5	-51.8	172.9	178.7	66.6	0	0	0	110.9	M177 Y189 N391 I392 I393 K397 A398 I399 V422 T426	M177-L395 HydrophobicContact CE-CD2 4.27Å; M177-L395 HydrophobicContact SD-CD2 3.56Å; M177-L395 VanDerWaalsContact SD-CD2 3.56Å; Y189-L395 HydrophobicContact CD2-CB 4.32Å; Y189-L395 HydrophobicContact CD2-CD1 3.85Å; Y189-L395 HydrophobicContact CE2-CD1 3.97Å; Y189-L395 HydrophobicContact CG-CB 4.19Å; Y189-L395 HydrophobicContact CG-CD1 4.49Å; N391-L395 WeakPolarHBondContact O-CB 3.37Å; N391-L395 PolarHBondContact O-N 2.95Å; I392-L395 PolarHBondContact O-N 2.97Å; I393-L395 VanDerWaalsContact C-N 3.31Å; I393-L395 PolarHBondContact O-N 3.04Å; L395-K397 VanDerWaalsContact C-N 3.29Å; L395-K397 PolarHBondContact O-N 2.92Å; L395-A398 PolarHBondContact O-N 3.36Å; L395-I399 HydrophobicContact CD1-CG2 3.79Å; L395-I399 HydrophobicContact CG-CG2 4.32Å; L395-I399 WeakPolarHBondContact O-CG1 3.34Å; L395-I399 WeakPolarHBondContact O-CG2 3.28Å; L395-I399 PolarHBondContact O-N 3.34Å; L395-V422 HydrophobicContact CD1-CG1 4.49Å; L395-T426 HydrophobicContact CD2-CG2 4.18Å
396	L	92.1	Very high	91.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.6	-40.9	179.9	-73.9	172.3	0	0	0	112.2	L82 L124 I152 I392 I393 I399 S400 F406	L82-L396 HydrophobicContact CD2-CD1 3.96Å; L124-L396 HydrophobicContact CD2-CD2 4.31Å; I152-L396 HydrophobicContact CD1-CD1 4.3Å; I152-L396 HydrophobicContact CD1-CD2 3.64Å; I152-L396 HydrophobicContact CD1-CG 4.15Å; I392-L396 HydrophobicContact CG2-CD1 3.86Å; I392-L396 HydrophobicContact CG2-CG 4.36Å; I392-L396 WeakPolarHBondContact O-CB 3.36Å; I392-L396 WeakPolarHBondContact O-CG 3.46Å; I392-L396 PolarHBondContact O-N 2.92Å; I393-L396 PolarHBondContact O-N 3.33Å; L396-I399 HydrophobicContact CD2-CD1 4.22Å; L396-S400 PolarHBondContact O-N 2.97Å; L396-F406 HydrophobicContact CD2-CE2 3.86Å; L396-F406 HydrophobicContact CD2-CZ 3.84Å
397	K	89.3	Confident	90.8	Very high	143 Å²	143	49.4 Å²	49.4	62%	0.622	24%	0.24	S	C	*	.	H	α-helix	trans	-68.5	-33.9	175.4	-172.1	176.6	-180	-177	0	112.6	I393 L395	I393-K397 VanDerWaalsContact O-CB 3.32Å; I393-K397 WeakPolarHBondContact O-CB 3.39Å; I393-K397 PolarHBondContact O-N 2.86Å; L395-K397 VanDerWaalsContact C-N 3.29Å; L395-K397 PolarHBondContact O-N 2.92Å
398	A	88.6	Confident	90.6	Very high	26 Å²	26	48.8 Å²	48.8	22%	0.215	24%	0.236	C	C	.	.	H	α-helix	trans	-73.5	-47.2	178.8	0	0	0	0	0	111.9	Y189 K394 L395 S400 L419	Y189-A398 HydrophobicContact CE1-CB 3.87Å; K394-A398 WeakPolarHBondContact O-CB 3.23Å; K394-A398 PolarHBondContact O-N 3.49Å; L395-A398 PolarHBondContact O-N 3.36Å; A398-S400 VanDerWaalsContact C-N 3.31Å; A398-S400 PolarHBondContact O-N 3.46Å; A398-L419 HydrophobicContact CB-CD1 4.17Å; A398-L419 WeakPolarHBondContact O-CD2 3.49Å
399	I	90.1	Very high	90.1	Very high	8 Å²	8	52.8 Å²	52.8	4%	0.041	25%	0.254	C	S	.	.	H	α-helix	trans	-72.5	-23.9	-176.2	68.6	-178.4	0	0	0	113.2	L175 L395 L396 F406 F408 I423	L175-I399 HydrophobicContact CD2-CD1 3.77Å; L395-I399 HydrophobicContact CD1-CG2 3.79Å; L395-I399 HydrophobicContact CG-CG2 4.32Å; L395-I399 WeakPolarHBondContact O-CG1 3.34Å; L395-I399 WeakPolarHBondContact O-CG2 3.28Å; L395-I399 PolarHBondContact O-N 3.34Å; L396-I399 HydrophobicContact CD2-CD1 4.22Å; I399-F406 HydrophobicContact CD1-CZ 4.46Å; I399-F408 HydrophobicContact CB-CB 4.13Å; I399-F408 HydrophobicContact CD1-CD1 3.96Å; I399-F408 HydrophobicContact CD1-CE1 4.39Å; I399-F408 HydrophobicContact CD1-CG 4.18Å; I399-F408 HydrophobicContact CG1-CB 4.35Å; I399-F408 HydrophobicContact CG1-CD1 4.42Å; I399-I423 HydrophobicContact CB-CD1 4.44Å; I399-I423 HydrophobicContact CB-CG1 4.19Å; I399-I423 HydrophobicContact CG2-CG1 3.85Å
400	S	89.1	Confident	89.7	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.021	26%	0.261	C	S	.	.			trans	-134.8	79.4	178.5	-176.8	0	0	0	0	110.4	Y54 L396 A398 D402 N405 F406 Y407	Y54-S400 PolarHBondContact OH-O 2.86Å; Y54-S400 VanDerWaalsContact OH-O 3.1Å; Y54-S400 PolarHBondContact OH-OG 3.31Å; L396-S400 PolarHBondContact O-N 2.97Å; A398-S400 VanDerWaalsContact C-N 3.31Å; A398-S400 PolarHBondContact O-N 3.46Å; S400-D402 PolarHBondContact O-N 2.88Å; S400-N405 PolarHBondContact OG-O 2.79Å; S400-F406 WeakPolarHBondContact OG-CA 3.42Å; S400-Y407 WeakPolarHBondContact CB-O 3.25Å; S400-Y407 PolarHBondContact OG-N 3.37Å; S400-Y407 VanDerWaalsContact OG-N 3.09Å; S400-Y407 PolarHBondContact OG-O 2.82Å
401	P	83.5	Confident	89.4	Confident	103 Å²	103	55.6 Å²	55.6	67%	0.669	27%	0.266	S	S	*	.			trans	-76	-5.9	-175.9	30.8	-35.5	0	0	0	114.1
402	D	85.9	Confident	89	Confident	53 Å²	53	60.3 Å²	60.3	28%	0.283	29%	0.291	S	S	.	.			trans	-67.8	146.7	176.6	-171.4	-84.7	0	0	0	111.3	K49 Y54 S400 E404 N405	K49-D402 IonicContact NZ-OD2 2.75Å; K49-D402 PolarHBondContact NZ-OD2 3.24Å; Y54-D402 WeakPolarHBondContact CE2-O 3.28Å; Y54-D402 PolarHBondContact OH-O 3.33Å; S400-D402 PolarHBondContact O-N 2.88Å; D402-E404 PolarHBondContact OD1-N 3.33Å; D402-N405 PolarHBondContact OD1-N 3.46Å
403	K	79.6	Confident	88.5	Confident	193 Å²	193	67.8 Å²	67.8	84%	0.839	33%	0.326	S	S	*	.	S	Bend	trans	-81.3	-22.1	-173.8	-66.6	-177	179.8	178.3	0	113.8
404	E	82.6	Confident	88.2	Confident	135 Å²	135	67.2 Å²	67.2	63%	0.631	32%	0.323	S	S	*	.	S	Bend	trans	-117.7	-35.3	-170.4	-64.8	-174.3	162.2	0	0	112.6	P53 Y54 D402	P53-E404 WeakPolarHBondContact CA-O 3.48Å; Y54-E404 VanDerWaalsContact CD2-C 3.43Å; Y54-E404 VanDerWaalsContact CD2-O 3.25Å; Y54-E404 WeakPolarHBondContact CD2-O 3.4Å; Y54-E404 PolarHBondContact N-O 3.02Å; D402-E404 PolarHBondContact OD1-N 3.33Å
405	N	88.1	Confident	87.9	Confident	21 Å²	21	65.3 Å²	65.3	11%	0.112	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	142.9	-175.8	-62.3	-47.7	0	0	0	112.2	Y54 S400 D402	Y54-N405 PolarHBondContact OH-O 3.37Å; S400-N405 PolarHBondContact OG-O 2.79Å; D402-N405 PolarHBondContact OD1-N 3.46Å
406	F	90.1	Very high	87.5	Confident	17 Å²	17	69.4 Å²	69.4	8%	0.075	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	115.2	167.9	-172.4	-119	0	0	0	109.6	G51 I52 Y54 L57 F87 L124 L396 I399 S400 F408	G51-F406 WeakPolarHBondContact CA-O 3.37Å; I52-F406 PolarHBondContact N-O 3.17Å; I52-F406 PolarHBondContact O-N 3.44Å; Y54-F406 HydrophobicContact CD1-CB 3.88Å; Y54-F406 HydrophobicContact CE1-CB 3.61Å; Y54-F406 AromaticContact CE1-CD2 3.75Å; Y54-F406 HydrophobicContact CE1-CD2 3.75Å; Y54-F406 HydrophobicContact CE1-CG 4.08Å; L57-F406 HydrophobicContact CD1-CB 3.46Å; L57-F406 VanDerWaalsContact CD1-CB 3.46Å; L57-F406 HydrophobicContact CD1-CD1 3.71Å; L57-F406 HydrophobicContact CD1-CG 3.91Å; F87-F406 HydrophobicContact CE1-CG 4.49Å; F87-F406 AromaticContact CZ-CD2 3.91Å; F87-F406 HydrophobicContact CZ-CD2 3.91Å; F87-F406 HydrophobicContact CZ-CE2 4.27Å; F87-F406 HydrophobicContact CZ-CG 4.18Å; L124-F406 HydrophobicContact CD1-CE1 4.29Å; L124-F406 HydrophobicContact CD2-CE1 4.01Å; L124-F406 HydrophobicContact CD2-CZ 4.04Å; L396-F406 HydrophobicContact CD2-CE2 3.86Å; L396-F406 HydrophobicContact CD2-CZ 3.84Å; I399-F406 HydrophobicContact CD1-CZ 4.46Å; S400-F406 WeakPolarHBondContact OG-CA 3.42Å; F406-F408 HydrophobicContact CE1-CD1 4.08Å; F406-F408 AromaticContact CE1-CE1 3.63Å; F406-F408 HydrophobicContact CE1-CE1 3.63Å; F406-F408 HydrophobicContact CE2-CD1 4.36Å; F406-F408 AromaticContact CZ-CD1 3.84Å; F406-F408 HydrophobicContact CZ-CD1 3.84Å; F406-F408 AromaticContact CZ-CE1 3.62Å; F406-F408 HydrophobicContact CZ-CE1 3.62Å
407	Y	90.1	Very high	87.1	Confident	95 Å²	95	70.8 Å²	70.8	37%	0.373	35%	0.348	S	S	.	.			trans	-154.5	135.8	178.1	-179.1	-104.7	0	0	0	111	P50 S400 E409	P50-Y407 HydrophobicContact CB-CD1 4.44Å; P50-Y407 HydrophobicContact CB-CD2 4.2Å; P50-Y407 HydrophobicContact CB-CE1 4.25Å; P50-Y407 HydrophobicContact CB-CE2 4.02Å; P50-Y407 HydrophobicContact CB-CG 4.4Å; P50-Y407 HydrophobicContact CG-CD1 4.31Å; P50-Y407 HydrophobicContact CG-CE1 4.14Å; P50-Y407 WeakPolarHBondContact O-CB 3.29Å; S400-Y407 WeakPolarHBondContact CB-O 3.25Å; S400-Y407 PolarHBondContact OG-N 3.37Å; S400-Y407 VanDerWaalsContact OG-N 3.09Å; S400-Y407 PolarHBondContact OG-O 2.82Å; Y407-E409 HydrophobicContact CE1-CB 4.18Å; Y407-E409 PolarHBondContact OH-OE2 3.46Å
408	F	90.7	Very high	87	Confident	29 Å²	29	66.4 Å²	66.4	13%	0.127	33%	0.334	C	S	.	.			trans	-146.8	145.2	169.6	60.4	-87.2	0	0	0	108.2	T173 L175 I399 F406 I423 V427	T173-F408 HydrophobicContact CG2-CE2 4.3Å; T173-F408 HydrophobicContact CG2-CZ 4.12Å; L175-F408 HydrophobicContact CD1-CE2 4.08Å; L175-F408 HydrophobicContact CD1-CZ 3.85Å; I399-F408 HydrophobicContact CB-CB 4.13Å; I399-F408 HydrophobicContact CD1-CD1 3.96Å; I399-F408 HydrophobicContact CD1-CE1 4.39Å; I399-F408 HydrophobicContact CD1-CG 4.18Å; I399-F408 HydrophobicContact CG1-CB 4.35Å; I399-F408 HydrophobicContact CG1-CD1 4.42Å; F406-F408 HydrophobicContact CE1-CD1 4.08Å; F406-F408 AromaticContact CE1-CE1 3.63Å; F406-F408 HydrophobicContact CE1-CE1 3.63Å; F406-F408 HydrophobicContact CE2-CD1 4.36Å; F406-F408 AromaticContact CZ-CD1 3.84Å; F406-F408 HydrophobicContact CZ-CD1 3.84Å; F406-F408 AromaticContact CZ-CE1 3.62Å; F406-F408 HydrophobicContact CZ-CE1 3.62Å; F408-I423 HydrophobicContact CD2-CG2 4.33Å; F408-V427 HydrophobicContact CD2-CG2 4.3Å; F408-V427 HydrophobicContact CE2-CG2 3.95Å
409	E	87.4	Confident	87	Confident	85 Å²	85	67.9 Å²	67.9	40%	0.397	34%	0.338	S	S	.	.			trans	-130.9	118.6	179.1	-175.7	164.8	-132.9	0	0	110.6	Y407 K411	Y407-E409 HydrophobicContact CE1-CB 4.18Å; Y407-E409 PolarHBondContact OH-OE2 3.46Å; E409-K411 PolarHBondContact O-N 3.34Å
410	P	89.7	Confident	87	Confident	21 Å²	21	69.7 Å²	69.7	14%	0.136	35%	0.348	C	S	.	.			trans	-73	126.9	170.4	29.4	-31.8	0	0	0	109.5	I423 V427 K430 I435	P410-I423 HydrophobicContact CB-CG2 4.24Å; P410-V427 HydrophobicContact CB-CB 4.49Å; P410-V427 HydrophobicContact CG-CG1 4.48Å; P410-K430 HydrophobicContact CG-CD 3.66Å; P410-I435 HydrophobicContact CB-CD1 4.34Å; P410-I435 HydrophobicContact CG-CD1 4.3Å
411	K	89.1	Confident	87	Confident	96 Å²	96	70.7 Å²	70.7	42%	0.417	35%	0.352	S	S	.	.			trans	-107.3	144.9	171.3	-59.7	177.4	-165.4	153.4	0	109.3	E409 F414 D420 R424	E409-K411 PolarHBondContact O-N 3.34Å; K411-F414 VanDerWaalsContact O-CD1 3.31Å; K411-F414 WeakPolarHBondContact O-CD1 3.35Å; K411-D420 IonicContact NZ-OD1 3.74Å; K411-D420 IonicContact NZ-OD2 3.69Å; K411-D420 PolarHBondContact NZ-OD2 3.41Å; K411-R424 WeakPolarHBondContact O-CB 3.21Å; K411-R424 WeakPolarHBondContact O-CD 3.35Å; K411-R424 VanDerWaalsContact O-CG 3.24Å; K411-R424 WeakPolarHBondContact O-CG 3.44Å
412	D	86.6	Confident	87.4	Confident	107 Å²	107	65.8 Å²	65.8	57%	0.572	32%	0.32	S	S	*	.	S	Bend	trans	-83.9	-16.7	176.5	-72.3	-42.9	0	0	0	112.8	F414 R424	D412-F414 WeakPolarHBondContact O-CE1 3.32Å; D412-R424 IonicContact OD1-CZ 3.49Å; D412-R424 IonicContact OD1-NE 2.92Å; D412-R424 PolarHBondContact OD1-NE 3.14Å; D412-R424 IonicContact OD1-NH2 3.03Å; D412-R424 PolarHBondContact OD1-NH2 2.68Å
413	E	86.1	Confident	87.8	Confident	157 Å²	157	63.6 Å²	63.6	73%	0.734	31%	0.308	S	S	*	.	S	Bend	trans	-105.3	121	171.3	-67.2	-177.9	-177.7	0	0	110.1
414	F	87.3	Confident	88.5	Confident	8 Å²	8	55 Å²	55	4%	0.035	27%	0.271	C	S	.	.			trans	-159.2	154.1	-178	51.5	-87.5	0	0	0	112.2	K411 D412 D420 H421 R424 P439 P441 N442	K411-F414 VanDerWaalsContact O-CD1 3.31Å; K411-F414 WeakPolarHBondContact O-CD1 3.35Å; D412-F414 WeakPolarHBondContact O-CE1 3.32Å; F414-D420 HydrophobicContact CB-CB 3.91Å; F414-H421 HydrophobicContact CD2-CB 3.62Å; F414-H421 AromaticContact CD2-CD2 3.87Å; F414-H421 AromaticContact CD2-CG 3.97Å; F414-H421 HydrophobicContact CE2-CB 4.16Å; F414-H421 AromaticContact CE2-CD2 3.46Å; F414-H421 VanDerWaalsContact CE2-CD2 3.46Å; F414-H421 WeakPolarHBondContact CE2-CD2 3.39Å; F414-H421 HydrophobicContact CG-CB 4.43Å; F414-R424 HydrophobicContact CD1-CB 4.08Å; F414-R424 HydrophobicContact CD1-CG 4.04Å; F414-R424 HydrophobicContact CE1-CB 3.88Å; F414-R424 HydrophobicContact CE1-CG 3.44Å; F414-R424 VanDerWaalsContact CE1-CG 3.44Å; F414-R424 HydrophobicContact CZ-CB 4.33Å; F414-R424 HydrophobicContact CZ-CG 3.98Å; F414-P439 HydrophobicContact CE1-CG 3.9Å; F414-P439 HydrophobicContact CZ-CG 4.17Å; F414-P439 VanDerWaalsContact CZ-O 3.32Å; F414-P439 WeakPolarHBondContact CZ-O 3.43Å; F414-P441 HydrophobicContact CD2-CB 4.11Å; F414-P441 HydrophobicContact CD2-CG 4.42Å; F414-P441 HydrophobicContact CE2-CB 3.99Å; F414-P441 HydrophobicContact CE2-CG 3.9Å; F414-N442 PolarHBondContact O-N 3.05Å; F414-N442 VanDerWaalsContact O-N 3.08Å
415	D	86.4	Confident	88.9	Confident	71 Å²	71	49.2 Å²	49.2	38%	0.38	25%	0.247	S	C	.	.			trans	-93.1	145.2	176.5	-66.9	-26	0	0	0	111.3	T418 N443	D415-T418 HydrophobicContact CB-CG2 3.77Å; D415-T418 PolarHBondContact O-N 2.89Å; D415-T418 PolarHBondContact O-OG1 3.36Å; D415-N443 WeakPolarHBondContact CA-OD1 3.49Å; D415-N443 WeakPolarHBondContact CB-OD1 3.21Å
416	Y	85	Confident	89.3	Confident	86 Å²	86	48.3 Å²	48.3	34%	0.337	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	137.6	174.5	-176.8	-92.2	0	0	0	110.8	V183 T418 H421 P441 N443 P445	V183-Y416 HydrophobicContact CG1-CE1 4.33Å; V183-Y416 HydrophobicContact CG1-CE2 3.91Å; Y416-T418 VanDerWaalsContact C-N 3.26Å; Y416-T418 PolarHBondContact O-N 3.4Å; Y416-H421 AromaticContact CD2-CE1 3.76Å; Y416-P441 HydrophobicContact CD2-CG 4.09Å; Y416-N443 WeakPolarHBondContact CB-OD1 3.35Å; Y416-N443 PolarHBondContact N-OD1 3.29Å; Y416-P445 VanDerWaalsContact CD1-CD 3.45Å; Y416-P445 HydrophobicContact CD1-CG 3.8Å; Y416-P445 HydrophobicContact CE1-CG 3.81Å
417	G	83.1	Confident	89.5	Confident	29 Å²	29	47.6 Å²	47.6	30%	0.299	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	76	2.2	179.1	0	0	0	0	0	115.9	I185	I185-G417 WeakPolarHBondContact CD1-O 3.32Å
418	T	87.9	Confident	89.8	Confident	52 Å²	52	43.2 Å²	43.2	32%	0.319	22%	0.222	S	C	.	.	S	Bend	trans	-88.6	165.2	173.2	66.8	0	0	0	0	112.4	D415 Y416 D420 H421 V422	D415-T418 HydrophobicContact CB-CG2 3.77Å; D415-T418 PolarHBondContact O-N 2.89Å; D415-T418 PolarHBondContact O-OG1 3.36Å; Y416-T418 VanDerWaalsContact C-N 3.26Å; Y416-T418 PolarHBondContact O-N 3.4Å; T418-D420 VanDerWaalsContact C-N 3.29Å; T418-D420 PolarHBondContact O-N 3.29Å; T418-H421 WeakPolarHBondContact O-CB 3.36Å; T418-H421 PolarHBondContact O-N 3.38Å; T418-V422 PolarHBondContact O-N 2.92Å
419	L	88.7	Confident	90	Very high	56 Å²	56	41.8 Å²	41.8	29%	0.293	22%	0.216	S	C	.	.	H	α-helix	trans	-65.1	-33.1	176.5	-174.3	69	0	0	0	112.2	A398 H421 V422 I423	A398-L419 HydrophobicContact CB-CD1 4.17Å; A398-L419 WeakPolarHBondContact O-CD2 3.49Å; L419-H421 VanDerWaalsContact C-N 3.27Å; L419-H421 PolarHBondContact O-N 3.37Å; L419-V422 WeakPolarHBondContact O-CA 3.43Å; L419-V422 WeakPolarHBondContact O-CB 3.35Å; L419-V422 PolarHBondContact O-N 3.33Å; L419-I423 HydrophobicContact CD2-CD1 4.37Å; L419-I423 HydrophobicContact CG-CD1 4.09Å; L419-I423 HydrophobicContact CG-CG1 4.39Å; L419-I423 WeakPolarHBondContact O-CG1 3.48Å; L419-I423 PolarHBondContact O-N 3.18Å
420	D	89.9	Confident	90.4	Very high	47 Å²	47	40.8 Å²	40.8	25%	0.251	21%	0.211	S	C	.	.	H	α-helix	trans	-62.3	-36.5	177.9	-74.4	-11.6	0	0	0	111.2	K411 F414 T418 V422 I423 R424	K411-D420 IonicContact NZ-OD1 3.74Å; K411-D420 IonicContact NZ-OD2 3.69Å; K411-D420 PolarHBondContact NZ-OD2 3.41Å; F414-D420 HydrophobicContact CB-CB 3.91Å; T418-D420 VanDerWaalsContact C-N 3.29Å; T418-D420 PolarHBondContact O-N 3.29Å; D420-V422 VanDerWaalsContact C-N 3.34Å; D420-V422 PolarHBondContact O-N 2.89Å; D420-I423 PolarHBondContact O-N 2.99Å; D420-R424 WeakPolarHBondContact O-CB 3.45Å; D420-R424 PolarHBondContact O-N 2.71Å
421	H	90	Very high	90.5	Very high	23 Å²	23	44.5 Å²	44.5	11%	0.106	23%	0.229	C	C	.	.	H	α-helix	trans	-60.2	-41.8	170.9	177.5	-152.7	0	0	0	112.1	F414 Y416 T418 L419 G425	F414-H421 HydrophobicContact CD2-CB 3.62Å; F414-H421 AromaticContact CD2-CD2 3.87Å; F414-H421 AromaticContact CD2-CG 3.97Å; F414-H421 HydrophobicContact CE2-CB 4.16Å; F414-H421 AromaticContact CE2-CD2 3.46Å; F414-H421 VanDerWaalsContact CE2-CD2 3.46Å; F414-H421 WeakPolarHBondContact CE2-CD2 3.39Å; F414-H421 HydrophobicContact CG-CB 4.43Å; Y416-H421 AromaticContact CD2-CE1 3.76Å; T418-H421 WeakPolarHBondContact O-CB 3.36Å; T418-H421 PolarHBondContact O-N 3.38Å; L419-H421 VanDerWaalsContact C-N 3.27Å; L419-H421 PolarHBondContact O-N 3.37Å; H421-G425 PolarHBondContact O-N 3.04Å
422	V	92	Very high	90.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.9	-48.5	177.1	178.9	0	0	0	0	111	P181 V183 I185 A186 Y189 L395 T418 L419 D420 G425 T426	P181-V422 HydrophobicContact CG-CB 4.41Å; P181-V422 HydrophobicContact CG-CG2 4.21Å; V183-V422 HydrophobicContact CG2-CG2 4Å; I185-V422 HydrophobicContact CD1-CG2 4.11Å; I185-V422 HydrophobicContact CG1-CG2 4.36Å; A186-V422 HydrophobicContact CB-CG2 3.92Å; Y189-V422 HydrophobicContact CE2-CG1 3.61Å; L395-V422 HydrophobicContact CD1-CG1 4.49Å; T418-V422 PolarHBondContact O-N 2.92Å; L419-V422 WeakPolarHBondContact O-CA 3.43Å; L419-V422 WeakPolarHBondContact O-CB 3.35Å; L419-V422 PolarHBondContact O-N 3.33Å; D420-V422 VanDerWaalsContact C-N 3.34Å; D420-V422 PolarHBondContact O-N 2.89Å; V422-G425 PolarHBondContact O-N 3.28Å; V422-T426 VanDerWaalsContact O-CB 3.29Å; V422-T426 WeakPolarHBondContact O-CB 3.21Å; V422-T426 PolarHBondContact O-N 3.25Å; V422-T426 PolarHBondContact O-OG1 2.98Å
423	I	93.6	Very high	90.9	Very high	8 Å²	8	43 Å²	43	4%	0.041	22%	0.222	C	C	.	.	H	α-helix	trans	-60.3	-49.7	-179.7	-65.5	169.2	0	0	0	109.8	I399 F408 P410 L419 D420 G425 T426 V427	I399-I423 HydrophobicContact CB-CD1 4.44Å; I399-I423 HydrophobicContact CB-CG1 4.19Å; I399-I423 HydrophobicContact CG2-CG1 3.85Å; F408-I423 HydrophobicContact CD2-CG2 4.33Å; P410-I423 HydrophobicContact CB-CG2 4.24Å; L419-I423 HydrophobicContact CD2-CD1 4.37Å; L419-I423 HydrophobicContact CG-CD1 4.09Å; L419-I423 HydrophobicContact CG-CG1 4.39Å; L419-I423 WeakPolarHBondContact O-CG1 3.48Å; L419-I423 PolarHBondContact O-N 3.18Å; D420-I423 PolarHBondContact O-N 2.99Å; I423-G425 PolarHBondContact O-N 2.81Å; I423-T426 PolarHBondContact O-N 3.05Å; I423-V427 HydrophobicContact CG2-CG2 4.3Å; I423-V427 WeakPolarHBondContact O-CG2 3.48Å; I423-V427 PolarHBondContact O-N 3.23Å
424	R	94.2	Very high	91.3	Very high	12 Å²	12	38.1 Å²	38.1	5%	0.045	20%	0.203	C	C	.	.	H	α-helix	trans	-67.4	-34.3	-176.7	-177.7	57.6	-176.1	87.8	-2.3	113.7	K411 D412 F414 D420 I435	K411-R424 WeakPolarHBondContact O-CB 3.21Å; K411-R424 WeakPolarHBondContact O-CD 3.35Å; K411-R424 VanDerWaalsContact O-CG 3.24Å; K411-R424 WeakPolarHBondContact O-CG 3.44Å; D412-R424 IonicContact OD1-CZ 3.49Å; D412-R424 IonicContact OD1-NE 2.92Å; D412-R424 PolarHBondContact OD1-NE 3.14Å; D412-R424 IonicContact OD1-NH2 3.03Å; D412-R424 PolarHBondContact OD1-NH2 2.68Å; F414-R424 HydrophobicContact CD1-CB 4.08Å; F414-R424 HydrophobicContact CD1-CG 4.04Å; F414-R424 HydrophobicContact CE1-CB 3.88Å; F414-R424 HydrophobicContact CE1-CG 3.44Å; F414-R424 VanDerWaalsContact CE1-CG 3.44Å; F414-R424 HydrophobicContact CZ-CB 4.33Å; F414-R424 HydrophobicContact CZ-CG 3.98Å; D420-R424 WeakPolarHBondContact O-CB 3.45Å; D420-R424 PolarHBondContact O-N 2.71Å; R424-I435 VanDerWaalsContact CZ-O 3.27Å; R424-I435 PolarHBondContact NH1-O 2.9Å; R424-I435 PolarHBondContact NH2-O 3.23Å
425	G	91.7	Very high	91.6	Very high	14 Å²	14	39.2 Å²	39.2	14%	0.144	21%	0.209	C	C	.	.	H	α-helix	trans	-69	-39.5	173.1	0	0	0	0	0	112.7	Q179 H421 V422 I423	Q179-G425 VanDerWaalsContact CB-O 3.26Å; Q179-G425 WeakPolarHBondContact CB-O 3.44Å; Q179-G425 CarbonylContact O-C 3.48Å; H421-G425 PolarHBondContact O-N 3.04Å; V422-G425 PolarHBondContact O-N 3.28Å; I423-G425 PolarHBondContact O-N 2.81Å
426	T	95	Very high	91.8	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-75.3	-37.3	-176.2	-53.2	0	0	0	0	112.8	L175 A176 V180 L395 V422 I423 V428	L175-T426 WeakPolarHBondContact CA-O 3.31Å; L175-T426 HydrophobicContact CB-CG2 4Å; L175-T426 HydrophobicContact CD2-CG2 4.4Å; L175-T426 HydrophobicContact CG-CG2 4.21Å; A176-T426 PolarHBondContact N-O 2.91Å; V180-T426 HydrophobicContact CG2-CG2 4.17Å; L395-T426 HydrophobicContact CD2-CG2 4.18Å; V422-T426 VanDerWaalsContact O-CB 3.29Å; V422-T426 WeakPolarHBondContact O-CB 3.21Å; V422-T426 PolarHBondContact O-N 3.25Å; V422-T426 PolarHBondContact O-OG1 2.98Å; I423-T426 PolarHBondContact O-N 3.05Å; T426-V428 PolarHBondContact O-N 3.43Å
427	V	96.1	Very high	92.1	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.018	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	111.1	-179.1	-175.4	0	0	0	0	110.1	T173 L175 F408 P410 I423 M429 K430 I435	T173-V427 HydrophobicContact CG2-CG1 4.44Å; L175-V427 HydrophobicContact CD1-CG2 4.22Å; L175-V427 HydrophobicContact CG-CG2 4.13Å; F408-V427 HydrophobicContact CD2-CG2 4.3Å; F408-V427 HydrophobicContact CE2-CG2 3.95Å; P410-V427 HydrophobicContact CB-CB 4.49Å; P410-V427 HydrophobicContact CG-CG1 4.48Å; I423-V427 HydrophobicContact CG2-CG2 4.3Å; I423-V427 WeakPolarHBondContact O-CG2 3.48Å; I423-V427 PolarHBondContact O-N 3.23Å; V427-M429 WeakPolarHBondContact CG1-O 3.39Å; V427-K430 HydrophobicContact CG1-CB 4.41Å; V427-I435 HydrophobicContact CB-CD1 4.28Å; V427-I435 HydrophobicContact CG1-CD1 3.89Å; V427-I435 WeakPolarHBondContact O-CD1 3.31Å; V427-I435 WeakPolarHBondContact O-CG1 3.49Å
428	V	95.8	Very high	92.3	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.012	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-21	-179.9	-62.9	0	0	0	0	112.7	P157 V174 A176 Q179 T426 I435 F436	P157-V428 HydrophobicContact CG-CG1 4.07Å; V174-V428 HydrophobicContact CB-CG2 3.9Å; V174-V428 HydrophobicContact CG1-CG2 3.76Å; V174-V428 PolarHBondContact O-N 3.31Å; A176-V428 HydrophobicContact CB-CG1 3.63Å; A176-V428 HydrophobicContact CB-CG2 4.07Å; Q179-V428 HydrophobicContact CB-CG1 4.33Å; Q179-V428 HydrophobicContact CG-CG1 3.87Å; T426-V428 PolarHBondContact O-N 3.43Å; V428-I435 PolarHBondContact O-N 3.45Å; V428-F436 HydrophobicContact CB-CB 4.15Å; V428-F436 HydrophobicContact CG1-CB 4.42Å; V428-F436 HydrophobicContact CG1-CD2 4.33Å; V428-F436 PolarHBondContact O-N 3.46Å
429	M	95.4	Very high	92.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	137.1	177.4	-177.5	-171.9	-68.5	0	0	109.8	L164 L167 A168 T172 T173 V174 V427 K433 V434	L164-M429 HydrophobicContact CB-CE 4.24Å; L164-M429 HydrophobicContact CD2-CE 4.26Å; L164-M429 WeakPolarHBondContact O-CE 3.41Å; L167-M429 HydrophobicContact CB-CE 3.87Å; L167-M429 HydrophobicContact CB-SD 4.04Å; A168-M429 HydrophobicContact CB-CE 3.94Å; A168-M429 HydrophobicContact CB-SD 4.39Å; T172-M429 WeakPolarHBondContact O-CG 3.27Å; T172-M429 VanDerWaalsContact O-SD 3.38Å; T173-M429 CarbonylContact C-O 3.51Å; T173-M429 WeakPolarHBondContact CA-O 3.49Å; V174-M429 HydrophobicContact CB-CB 4Å; V174-M429 HydrophobicContact CG2-CB 4Å; V174-M429 HydrophobicContact CG2-SD 3.99Å; V174-M429 PolarHBondContact N-O 3.16Å; V427-M429 WeakPolarHBondContact CG1-O 3.39Å; M429-K433 WeakPolarHBondContact CA-O 3.42Å; M429-V434 HydrophobicContact CE-CG2 3.77Å
430	K	94.6	Very high	92.3	Very high	63 Å²	63	42.1 Å²	42.1	27%	0.274	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	124.2	173.8	179.5	170	176	177.3	0	109.4	P410 V427 G432 K433 I435	P410-K430 HydrophobicContact CG-CD 3.66Å; V427-K430 HydrophobicContact CG1-CB 4.41Å; K430-G432 PolarHBondContact O-N 2.83Å; K430-G432 VanDerWaalsContact O-N 3.14Å; K430-K433 PolarHBondContact N-O 2.99Å; K430-K433 WeakPolarHBondContact O-CB 3.4Å; K430-K433 PolarHBondContact O-N 3.16Å; K430-I435 HydrophobicContact CB-CD1 4.5Å
431	D	92	Very high	92.1	Very high	99 Å²	99	40.9 Å²	40.9	53%	0.529	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	36.7	179.4	-54.8	-45.6	0	0	0	113.8	T173 K433	T173-D431 PolarHBondContact OG1-N 2.82Å; T173-D431 VanDerWaalsContact OG1-N 3.17Å; D431-K433 VanDerWaalsContact C-N 3.3Å; D431-K433 PolarHBondContact O-N 2.68Å
432	G	90.8	Very high	91.9	Very high	15 Å²	15	45.1 Å²	45.1	16%	0.155	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	-9.2	-176.2	0	0	0	0	0	116	A168 T172 K430	A168-G432 VanDerWaalsContact CB-O 3.28Å; A168-G432 WeakPolarHBondContact CB-O 3.34Å; T172-G432 PolarHBondContact O-N 2.83Å; K430-G432 PolarHBondContact O-N 2.83Å; K430-G432 VanDerWaalsContact O-N 3.14Å
433	K	93.9	Very high	91.4	Very high	156 Å²	156	49.1 Å²	49.1	68%	0.678	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	117.5	172.7	-172.6	-178.9	177.6	-173.7	0	109.7	M429 K430 D431 I435	M429-K433 WeakPolarHBondContact CA-O 3.42Å; K430-K433 PolarHBondContact N-O 2.99Å; K430-K433 WeakPolarHBondContact O-CB 3.4Å; K430-K433 PolarHBondContact O-N 3.16Å; D431-K433 VanDerWaalsContact C-N 3.3Å; D431-K433 PolarHBondContact O-N 2.68Å; K433-I435 HydrophobicContact CG-CG2 4.46Å; K433-I435 PolarHBondContact O-N 2.7Å
434	V	93.7	Very high	90.5	Very high	56 Å²	56	53.1 Å²	53.1	34%	0.339	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	124.9	172.7	-178.7	0	0	0	0	109	L164 M429 F436	L164-V434 HydrophobicContact CB-CG2 4.36Å; L164-V434 HydrophobicContact CD1-CG1 4.38Å; M429-V434 HydrophobicContact CE-CG2 3.77Å; V434-F436 HydrophobicContact CG1-CB 4.13Å
435	I	93.4	Very high	89.1	Confident	30 Å²	30	56.1 Å²	56.1	15%	0.154	32%	0.319	C	S	.	.			trans	-118.6	14.9	178.7	58.5	166.5	0	0	0	112	P410 R424 V427 V428 K430 K433	P410-I435 HydrophobicContact CB-CD1 4.34Å; P410-I435 HydrophobicContact CG-CD1 4.3Å; R424-I435 VanDerWaalsContact CZ-O 3.27Å; R424-I435 PolarHBondContact NH1-O 2.9Å; R424-I435 PolarHBondContact NH2-O 3.23Å; V427-I435 HydrophobicContact CB-CD1 4.28Å; V427-I435 HydrophobicContact CG1-CD1 3.89Å; V427-I435 WeakPolarHBondContact O-CD1 3.31Å; V427-I435 WeakPolarHBondContact O-CG1 3.49Å; V428-I435 PolarHBondContact O-N 3.45Å; K430-I435 HydrophobicContact CB-CD1 4.5Å; K433-I435 HydrophobicContact CG-CG2 4.46Å; K433-I435 PolarHBondContact O-N 2.7Å
436	F	91.5	Very high	87.1	Confident	65 Å²	65	65 Å²	65	29%	0.285	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-86.5	141.7	169.4	174.2	-93.4	0	0	0	110.7	P157 A158 V428 V434	P157-F436 HydrophobicContact CB-CD1 4.04Å; P157-F436 HydrophobicContact CB-CD2 4.17Å; P157-F436 HydrophobicContact CB-CE1 4.28Å; P157-F436 HydrophobicContact CB-CE2 4.41Å; P157-F436 HydrophobicContact CB-CG 3.99Å; P157-F436 HydrophobicContact CB-CZ 4.47Å; P157-F436 HydrophobicContact CG-CD1 4.26Å; P157-F436 HydrophobicContact CG-CD2 3.59Å; P157-F436 HydrophobicContact CG-CE1 4.26Å; P157-F436 HydrophobicContact CG-CE2 3.61Å; P157-F436 HydrophobicContact CG-CG 3.95Å; P157-F436 HydrophobicContact CG-CZ 3.96Å; A158-F436 HydrophobicContact CB-CE1 4.21Å; A158-F436 HydrophobicContact CB-CZ 4.01Å; V428-F436 HydrophobicContact CB-CB 4.15Å; V428-F436 HydrophobicContact CG1-CB 4.42Å; V428-F436 HydrophobicContact CG1-CD2 4.33Å; V428-F436 PolarHBondContact O-N 3.46Å; V434-F436 HydrophobicContact CG1-CB 4.13Å
437	P	90.1	Very high	85.1	Confident	97 Å²	97	67.7 Å²	67.7	63%	0.63	39%	0.385	S	S	*	.	S	Bend	cis	-76.6	159.5	-6.1	31.6	-34.6	0	0	0	113.2
438	A	88.6	Confident	83	Confident	45 Å²	45	72 Å²	72	37%	0.372	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-71.8	144.7	175.2	0	0	0	0	0	111.6
439	P	89.6	Confident	81.1	Confident	46 Å²	46	77.6 Å²	77.6	30%	0.299	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-67.6	159.2	172.6	29.5	-34.2	0	0	0	111.3	F414	F414-P439 HydrophobicContact CE1-CG 3.9Å; F414-P439 HydrophobicContact CZ-CG 4.17Å; F414-P439 VanDerWaalsContact CZ-O 3.32Å; F414-P439 WeakPolarHBondContact CZ-O 3.43Å
440	P	85.5	Confident	79.3	Confident	102 Å²	102	84.7 Å²	84.7	66%	0.662	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-69.3	146.7	174.8	28.8	-33.6	0	0	0	111.7	I444	P440-I444 HydrophobicContact CB-CD1 4.3Å
441	P	86.6	Confident	78	Confident	22 Å²	22	90.5 Å²	90.5	14%	0.143	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-64.5	156.6	175	-12.5	20.6	0	0	0	113.8	F414 Y416 N443 I444	F414-P441 HydrophobicContact CD2-CB 4.11Å; F414-P441 HydrophobicContact CD2-CG 4.42Å; F414-P441 HydrophobicContact CE2-CB 3.99Å; F414-P441 HydrophobicContact CE2-CG 3.9Å; Y416-P441 HydrophobicContact CD2-CG 4.09Å; P441-N443 PolarHBondContact O-N 2.94Å; P441-I444 HydrophobicContact CB-CG1 4.19Å; P441-I444 HydrophobicContact CG-CG1 4.15Å
442	N	85.3	Confident	77.1	Confident	111 Å²	111	90.7 Å²	90.7	59%	0.594	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-36	-176.4	-68.1	-24.2	0	0	0	114.7	F414	F414-N442 PolarHBondContact O-N 3.05Å; F414-N442 VanDerWaalsContact O-N 3.08Å
443	N	82.8	Confident	76.7	Confident	84 Å²	84	94.5 Å²	94.5	45%	0.449	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	46.1	-167.5	66.4	-16.5	0	0	0	112.9	D415 Y416 P441 P445	D415-N443 WeakPolarHBondContact CA-OD1 3.49Å; D415-N443 WeakPolarHBondContact CB-OD1 3.21Å; Y416-N443 WeakPolarHBondContact CB-OD1 3.35Å; Y416-N443 PolarHBondContact N-OD1 3.29Å; P441-N443 PolarHBondContact O-N 2.94Å; N443-P445 VanDerWaalsContact O-CD 3.29Å; N443-P445 WeakPolarHBondContact O-CD 3.47Å
444	I	73.2	Confident	76.2	Confident	93 Å²	93	89.6 Å²	89.6	48%	0.477	52%	0.518	S	S	.	.			trans	-53.2	118.2	178.4	-55.2	174.4	0	0	0	109.2	P440 P441 Q446	P440-I444 HydrophobicContact CB-CD1 4.3Å; P441-I444 HydrophobicContact CB-CG1 4.19Å; P441-I444 HydrophobicContact CG-CG1 4.15Å; I444-Q446 PolarHBondContact O-N 3.25Å; I444-Q446 VanDerWaalsContact O-N 3.14Å
445	P	65	Low	75.8	Confident	74 Å²	74	87.1 Å²	87.1	48%	0.481	50%	0.503	S	S	.	.			trans	-62.1	120.2	-179.4	19.6	-27.9	0	0	0	110	Y416 N443 G447	Y416-P445 VanDerWaalsContact CD1-CD 3.45Å; Y416-P445 HydrophobicContact CD1-CG 3.8Å; Y416-P445 HydrophobicContact CE1-CG 3.81Å; N443-P445 VanDerWaalsContact O-CD 3.29Å; N443-P445 WeakPolarHBondContact O-CD 3.47Å; P445-G447 PolarHBondContact O-N 3.21Å
446	Q	50	Low	75.4	Confident	202 Å²	202	89 Å²	89	94%	0.944	52%	0.523	S	S	*	.			trans	-82.7	90.1	175.5	-69.6	-168.2	-5.4	0	0	109.5	I444	I444-Q446 PolarHBondContact O-N 3.25Å; I444-Q446 VanDerWaalsContact O-N 3.14Å
447	G	54	Low	75.1	Confident	57 Å²	57	90.6 Å²	90.6	59%	0.588	53%	0.531	S	S	*	.	S	Bend	trans	103.7	168	174.9	0	0	0	0	0	114.4	P445	P445-G447 PolarHBondContact O-N 3.21Å
448	A	50.6	Low	74.9	Confident	92 Å²	92	88.2 Å²	88.2	76%	0.76	51%	0.513	S	S	*	.	S	Bend	trans	-63.5	135.6	174.6	0	0	0	0	0	109.6	V450	A448-V450 PolarHBondContact O-N 2.93Å
449	P	55.6	Low	74.6	Confident	121 Å²	121	90.3 Å²	90.3	79%	0.786	52%	0.515	S	S	*	.			trans	-55.9	134.1	176.8	21.2	-30.5	0	0	0	109.8	K451	P449-K451 PolarHBondContact O-N 3.31Å
450	V	58.7	Low	74.4	Confident	148 Å²	148	91 Å²	91	90%	0.897	53%	0.525	S	S	*	.			trans	-63.5	100.5	173.5	-178.8	0	0	0	0	107.1	A448 Q452	A448-V450 PolarHBondContact O-N 2.93Å; V450-Q452 PolarHBondContact O-N 3Å
451	K	66.6	Low	74.5	Confident	186 Å²	186	90.6 Å²	90.6	81%	0.809	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-64.9	118.6	176.8	-167.7	177	-179.1	-175.9	0	107.7	P449 K453	P449-K451 PolarHBondContact O-N 3.31Å; K451-K453 PolarHBondContact O-N 2.6Å
452	Q	73.3	Confident	74.4	Confident	102 Å²	102	96.9 Å²	96.9	48%	0.477	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-61.1	135.5	174.2	-170.3	164.5	-15.2	0	0	108.9	V450 P1020 N1021	V450-Q452 PolarHBondContact O-N 3Å; Q452-P1020 HydrophobicContact CG-CG 4.49Å; Q452-N1021 PolarHBondContact NE2-ND2 3.47Å
453	K	82.6	Confident	74.4	Confident	95 Å²	95	94 Å²	94	41%	0.413	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-62.8	140.6	178.1	-67	-178.1	-175.2	175	0	109.9	K451 E457 L458 E461	K451-K453 PolarHBondContact O-N 2.6Å; K453-E457 WeakPolarHBondContact CA-OE2 3.34Å; K453-E457 HydrophobicContact CB-CB 4.19Å; K453-L458 HydrophobicContact CB-CD2 4.46Å; K453-L458 HydrophobicContact CB-CG 4.26Å; K453-L458 HydrophobicContact CD-CD2 4.42Å; K453-E461 IonicContact NZ-OE1 2.73Å; K453-E461 PolarHBondContact NZ-OE1 3.38Å; K453-E461 IonicContact NZ-OE2 3.23Å
454	T	84.4	Confident	74.6	Confident	54 Å²	54	94 Å²	94	33%	0.331	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-65.7	162.7	173.1	62.4	0	0	0	0	110.8	A456 E457 L458	T454-A456 VanDerWaalsContact C-N 3.28Å; T454-A456 PolarHBondContact O-N 3.24Å; T454-E457 PolarHBondContact N-OE2 3.31Å; T454-E457 PolarHBondContact O-N 3.23Å; T454-E457 VanDerWaalsContact OG1-CG 3.3Å; T454-E457 WeakPolarHBondContact OG1-CG 3.49Å; T454-E457 PolarHBondContact OG1-N 3.02Å; T454-E457 PolarHBondContact OG1-OE2 3.18Å; T454-L458 PolarHBondContact O-N 3.26Å
455	V	85	Confident	75.6	Confident	4 Å²	4	94.3 Å²	94.3	2%	0.024	55%	0.549	C	S	.	.	H	α-helix	trans	-58.9	-41.6	176.9	-180	0	0	0	0	111.5	E457 L458 E459 Q1017 P1020 A1025	V455-E457 VanDerWaalsContact C-N 3.35Å; V455-E457 PolarHBondContact O-N 3.05Å; V455-L458 PolarHBondContact O-N 3.17Å; V455-E459 HydrophobicContact CG1-CG 4.41Å; V455-E459 PolarHBondContact O-N 3.47Å; V455-Q1017 PolarHBondContact N-O 3.41Å; V455-P1020 HydrophobicContact CG2-CB 4.21Å; V455-A1025 HydrophobicContact CG2-CB 4.13Å
456	A	83.9	Confident	76.8	Confident	68 Å²	68	94.6 Å²	94.6	56%	0.562	55%	0.546	S	S	*	.	H	α-helix	trans	-63	-37.9	-179.6	0	0	0	0	0	112.9	T454 E459 A460	T454-A456 VanDerWaalsContact C-N 3.28Å; T454-A456 PolarHBondContact O-N 3.24Å; A456-E459 PolarHBondContact O-N 3.2Å; A456-A460 WeakPolarHBondContact O-CB 3.32Å; A456-A460 PolarHBondContact O-N 2.91Å
457	E	85.9	Confident	79	Confident	99 Å²	99	88.2 Å²	88.2	46%	0.463	52%	0.521	S	S	.	.	H	α-helix	trans	-65.7	-40	176.5	-72.9	167.1	136.5	0	0	111.8	K453 T454 V455 A460 E461	K453-E457 WeakPolarHBondContact CA-OE2 3.34Å; K453-E457 HydrophobicContact CB-CB 4.19Å; T454-E457 PolarHBondContact N-OE2 3.31Å; T454-E457 PolarHBondContact O-N 3.23Å; T454-E457 VanDerWaalsContact OG1-CG 3.3Å; T454-E457 WeakPolarHBondContact OG1-CG 3.49Å; T454-E457 PolarHBondContact OG1-N 3.02Å; T454-E457 PolarHBondContact OG1-OE2 3.18Å; V455-E457 VanDerWaalsContact C-N 3.35Å; V455-E457 PolarHBondContact O-N 3.05Å; E457-A460 PolarHBondContact O-N 3.14Å; E457-E461 PolarHBondContact O-N 2.8Å; E457-E461 VanDerWaalsContact O-N 3.08Å
458	L	85.7	Confident	80.9	Confident	47 Å²	47	90.4 Å²	90.4	25%	0.246	52%	0.524	C	S	.	.	H	α-helix	trans	-67.1	-38.7	175.8	-68.6	167.3	0	0	0	111.9	K453 T454 V455 E461 K462 P1020	K453-L458 HydrophobicContact CB-CD2 4.46Å; K453-L458 HydrophobicContact CB-CG 4.26Å; K453-L458 HydrophobicContact CD-CD2 4.42Å; T454-L458 PolarHBondContact O-N 3.26Å; V455-L458 PolarHBondContact O-N 3.17Å; L458-E461 PolarHBondContact O-N 3.29Å; L458-K462 PolarHBondContact O-N 3.08Å; L458-P1020 HydrophobicContact CD1-CB 3.45Å; L458-P1020 VanDerWaalsContact CD1-CB 3.45Å; L458-P1020 HydrophobicContact CD1-CG 3.88Å
459	E	82.4	Confident	83.2	Confident	89 Å²	89	93.1 Å²	93.1	42%	0.416	52%	0.519	S	S	.	.	H	α-helix	trans	-66.2	-38.7	173.8	-72.4	-168	158.6	0	0	112.3	V455 A456 E461 K462 A463	V455-E459 HydrophobicContact CG1-CG 4.41Å; V455-E459 PolarHBondContact O-N 3.47Å; A456-E459 PolarHBondContact O-N 3.2Å; E459-E461 VanDerWaalsContact C-N 3.34Å; E459-E461 PolarHBondContact O-N 2.92Å; E459-K462 PolarHBondContact O-N 2.99Å; E459-A463 WeakPolarHBondContact O-CB 3.42Å; E459-A463 PolarHBondContact O-N 3.17Å
460	A	85.8	Confident	85.1	Confident	60 Å²	60	95.4 Å²	95.4	50%	0.496	51%	0.512	S	S	.	.	H	α-helix	trans	-61.6	-41.8	175.2	0	0	0	0	0	111.7	A456 E457 A463 A464	A456-A460 WeakPolarHBondContact O-CB 3.32Å; A456-A460 PolarHBondContact O-N 2.91Å; E457-A460 PolarHBondContact O-N 3.14Å; A460-A463 PolarHBondContact O-N 3.02Å; A460-A464 WeakPolarHBondContact O-CB 3.16Å; A460-A464 PolarHBondContact O-N 3.39Å
461	E	86.7	Confident	86.8	Confident	95 Å²	95	94.1 Å²	94.1	44%	0.444	49%	0.494	S	S	.	.	H	α-helix	trans	-62.2	-46.8	173.5	-73.5	179.8	176.4	0	0	111.5	K453 E457 L458 E459 A463 A464 T465	K453-E461 IonicContact NZ-OE1 2.73Å; K453-E461 PolarHBondContact NZ-OE1 3.38Å; K453-E461 IonicContact NZ-OE2 3.23Å; E457-E461 PolarHBondContact O-N 2.8Å; E457-E461 VanDerWaalsContact O-N 3.08Å; L458-E461 PolarHBondContact O-N 3.29Å; E459-E461 VanDerWaalsContact C-N 3.34Å; E459-E461 PolarHBondContact O-N 2.92Å; E461-A463 VanDerWaalsContact C-N 3.33Å; E461-A463 PolarHBondContact O-N 2.98Å; E461-A464 WeakPolarHBondContact O-CB 3.47Å; E461-A464 PolarHBondContact O-N 2.74Å; E461-A464 VanDerWaalsContact O-N 3.17Å; E461-T465 WeakPolarHBondContact O-CG2 3.44Å; E461-T465 PolarHBondContact O-N 3.31Å; E461-T465 VanDerWaalsContact O-N 3.13Å
462	K	84.8	Confident	88.2	Confident	153 Å²	153	89.8 Å²	89.8	67%	0.665	48%	0.484	S	S	*	.	H	α-helix	trans	-59.9	-43	176.7	-169.5	178.8	-178.4	-179.4	0	111.6	L458 E459 A464 T465	L458-K462 PolarHBondContact O-N 3.08Å; E459-K462 PolarHBondContact O-N 2.99Å; K462-A464 VanDerWaalsContact C-N 3.34Å; K462-A464 PolarHBondContact O-N 2.91Å; K462-T465 PolarHBondContact O-N 3.28Å; K462-T465 PolarHBondContact O-OG1 2.92Å
463	A	84.8	Confident	89.4	Confident	52 Å²	52	90 Å²	90	43%	0.43	49%	0.486	S	S	.	.	H	α-helix	trans	-65.2	-36.4	176.8	0	0	0	0	0	112.3	E459 A460 E461 T465 I466	E459-A463 WeakPolarHBondContact O-CB 3.42Å; E459-A463 PolarHBondContact O-N 3.17Å; A460-A463 PolarHBondContact O-N 3.02Å; E461-A463 VanDerWaalsContact C-N 3.33Å; E461-A463 PolarHBondContact O-N 2.98Å; A463-T465 VanDerWaalsContact C-N 3.31Å; A463-T465 PolarHBondContact O-N 3.14Å; A463-I466 PolarHBondContact O-N 2.88Å
464	A	88.4	Confident	90	Very high	83 Å²	83	89.8 Å²	89.8	69%	0.686	49%	0.493	S	S	*	.	H	α-helix	trans	-68.5	-25.9	177	0	0	0	0	0	113.1	A460 E461 K462 I466	A460-A464 WeakPolarHBondContact O-CB 3.16Å; A460-A464 PolarHBondContact O-N 3.39Å; E461-A464 WeakPolarHBondContact O-CB 3.47Å; E461-A464 PolarHBondContact O-N 2.74Å; E461-A464 VanDerWaalsContact O-N 3.17Å; K462-A464 VanDerWaalsContact C-N 3.34Å; K462-A464 PolarHBondContact O-N 2.91Å; A464-I466 PolarHBondContact O-N 3.46Å
465	T	92.4	Very high	90.6	Very high	100 Å²	100	90 Å²	90	61%	0.613	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.6	175.2	69.3	0	0	0	0	114.1	E461 K462 A463 T467	E461-T465 WeakPolarHBondContact O-CG2 3.44Å; E461-T465 PolarHBondContact O-N 3.31Å; E461-T465 VanDerWaalsContact O-N 3.13Å; K462-T465 PolarHBondContact O-N 3.28Å; K462-T465 PolarHBondContact O-OG1 2.92Å; A463-T465 VanDerWaalsContact C-N 3.31Å; A463-T465 PolarHBondContact O-N 3.14Å; T465-T467 PolarHBondContact O-N 3.1Å
466	I	91.8	Very high	91.2	Very high	80 Å²	80	92 Å²	92	41%	0.41	51%	0.513	S	S	.	.	S	Bend	trans	-81.7	105.2	-178.3	-52.7	-175.5	0	0	0	109.6	A463 A464 R470 K471	A463-I466 PolarHBondContact O-N 2.88Å; A464-I466 PolarHBondContact O-N 3.46Å; I466-R470 HydrophobicContact CG2-CB 4.27Å; I466-K471 HydrophobicContact CG2-CD 4.39Å; I466-K471 HydrophobicContact CG2-CG 3.61Å
467	T	94.8	Very high	91.9	Very high	68 Å²	68	91.1 Å²	91.1	42%	0.417	50%	0.503	S	S	.	.			trans	-62.6	148.9	179.5	67.8	0	0	0	0	112.3	T465 F469 R470 K471	T465-T467 PolarHBondContact O-N 3.1Å; T467-F469 PolarHBondContact O-N 3.38Å; T467-F469 VanDerWaalsContact O-N 3.16Å; T467-R470 PolarHBondContact O-N 2.99Å; T467-R470 PolarHBondContact OG1-N 3.03Å; T467-K471 PolarHBondContact O-N 3.04Å
468	P	95.5	Very high	92.4	Very high	102 Å²	102	91 Å²	91	66%	0.662	51%	0.509	S	S	*	.	H	α-helix	trans	-54.9	-33.2	175.2	-27.6	35.4	0	0	0	113.6	K471 T472	P468-K471 PolarHBondContact O-N 3.19Å; P468-T472 WeakPolarHBondContact O-CB 3.32Å; P468-T472 PolarHBondContact O-N 3Å; P468-T472 PolarHBondContact O-OG1 2.96Å
469	F	97.1	Very high	92.9	Very high	150 Å²	150	96.6 Å²	96.6	66%	0.658	53%	0.528	S	S	*	.	H	α-helix	trans	-60.2	-50.2	174.1	175.8	-96.1	0	0	0	111.9	T467 K471 T472 M473	T467-F469 PolarHBondContact O-N 3.38Å; T467-F469 VanDerWaalsContact O-N 3.16Å; F469-K471 VanDerWaalsContact C-N 3.34Å; F469-K471 PolarHBondContact O-N 3.13Å; F469-T472 PolarHBondContact O-N 2.78Å; F469-M473 HydrophobicContact CE1-CB 4.45Å; F469-M473 WeakPolarHBondContact O-CB 3.39Å; F469-M473 PolarHBondContact O-N 2.7Å
470	R	95.8	Very high	93.7	Very high	169 Å²	169	96.8 Å²	96.8	64%	0.638	54%	0.535	S	S	*	.	H	α-helix	trans	-62.1	-41.8	179	-77.2	-174.3	177.7	178.4	0.5	111.7	I466 T467 T472 M473 T474	I466-R470 HydrophobicContact CG2-CB 4.27Å; T467-R470 PolarHBondContact O-N 2.99Å; T467-R470 PolarHBondContact OG1-N 3.03Å; R470-T472 VanDerWaalsContact C-N 3.34Å; R470-T472 PolarHBondContact O-N 3.18Å; R470-M473 PolarHBondContact O-N 3.13Å; R470-T474 WeakPolarHBondContact O-CB 3.36Å; R470-T474 PolarHBondContact O-N 3.32Å; R470-T474 PolarHBondContact O-OG1 3.11Å
471	K	94.5	Very high	94.2	Very high	120 Å²	120	98.2 Å²	98.2	52%	0.522	54%	0.538	S	S	.	.	H	α-helix	trans	-57.8	-47.7	175.2	-65.9	-172.6	-179.7	179.9	0	111.5	I466 T467 P468 F469 S475	I466-K471 HydrophobicContact CG2-CD 4.39Å; I466-K471 HydrophobicContact CG2-CG 3.61Å; T467-K471 PolarHBondContact O-N 3.04Å; P468-K471 PolarHBondContact O-N 3.19Å; F469-K471 VanDerWaalsContact C-N 3.34Å; F469-K471 PolarHBondContact O-N 3.13Å; K471-S475 WeakPolarHBondContact O-CB 3.49Å; K471-S475 PolarHBondContact O-N 3.47Å
472	T	97.1	Very high	94.6	Very high	96 Å²	96	95.3 Å²	95.3	59%	0.589	53%	0.534	S	S	*	.	H	α-helix	trans	-64.9	-44.9	179.3	-51.9	0	0	0	0	111.5	P468 F469 R470 S475 A476	P468-T472 WeakPolarHBondContact O-CB 3.32Å; P468-T472 PolarHBondContact O-N 3Å; P468-T472 PolarHBondContact O-OG1 2.96Å; F469-T472 PolarHBondContact O-N 2.78Å; R470-T472 VanDerWaalsContact C-N 3.34Å; R470-T472 PolarHBondContact O-N 3.18Å; T472-S475 PolarHBondContact O-N 3.01Å; T472-A476 WeakPolarHBondContact O-CB 3.3Å; T472-A476 PolarHBondContact O-N 3.14Å
473	M	97.6	Very high	95.2	Very high	105 Å²	105	93.8 Å²	93.8	52%	0.517	53%	0.532	S	S	.	.	H	α-helix	trans	-62.2	-46	179	-174.7	64.1	-171.2	0	0	111.6	F469 R470 A476 S477	F469-M473 HydrophobicContact CE1-CB 4.45Å; F469-M473 WeakPolarHBondContact O-CB 3.39Å; F469-M473 PolarHBondContact O-N 2.7Å; R470-M473 PolarHBondContact O-N 3.13Å; M473-A476 PolarHBondContact O-N 3.18Å; M473-S477 VanDerWaalsContact O-CB 3.31Å; M473-S477 WeakPolarHBondContact O-CB 3.41Å; M473-S477 PolarHBondContact O-N 3.09Å; M473-S477 PolarHBondContact O-OG 3.34Å
474	T	95.8	Very high	95.8	Very high	92 Å²	92	93.9 Å²	93.9	56%	0.564	53%	0.534	S	S	*	.	H	α-helix	trans	-61.6	-45.3	176.1	-64.7	0	0	0	0	111.2	R470 S477 V478	R470-T474 WeakPolarHBondContact O-CB 3.36Å; R470-T474 PolarHBondContact O-N 3.32Å; R470-T474 PolarHBondContact O-OG1 3.11Å; T474-S477 PolarHBondContact O-N 3.17Å; T474-V478 WeakPolarHBondContact O-CG2 3.31Å; T474-V478 PolarHBondContact O-N 3.17Å
475	S	96.9	Very high	96.1	Very high	57 Å²	57	93.5 Å²	93.5	40%	0.399	52%	0.523	S	S	.	.	H	α-helix	trans	-60.2	-50.3	177	-177.3	0	0	0	0	111.9	K471 T472 S477 V478 Y479	K471-S475 WeakPolarHBondContact O-CB 3.49Å; K471-S475 PolarHBondContact O-N 3.47Å; T472-S475 PolarHBondContact O-N 3.01Å; S475-S477 VanDerWaalsContact C-N 3.26Å; S475-S477 PolarHBondContact O-N 3.1Å; S475-V478 PolarHBondContact O-N 3.1Å; S475-Y479 WeakPolarHBondContact O-CD2 3.45Å; S475-Y479 PolarHBondContact O-N 3.3Å; S475-Y479 VanDerWaalsContact O-N 3.1Å; S475-Y479 WeakPolarHBondContact OG-CE2 3.33Å
476	A	97.8	Very high	96.2	Very high	46 Å²	46	94 Å²	94	38%	0.38	52%	0.52	S	S	.	.	H	α-helix	trans	-59.1	-38.1	177.2	0	0	0	0	0	112.2	T472 M473 T480	T472-A476 WeakPolarHBondContact O-CB 3.3Å; T472-A476 PolarHBondContact O-N 3.14Å; M473-A476 PolarHBondContact O-N 3.18Å; A476-T480 WeakPolarHBondContact O-CB 3.3Å; A476-T480 PolarHBondContact O-N 3.43Å; A476-T480 PolarHBondContact O-OG1 2.9Å
477	S	97.9	Very high	96.4	Very high	50 Å²	50	96.1 Å²	96.1	35%	0.35	53%	0.531	S	S	.	.	H	α-helix	trans	-66.4	-41	178	-59.1	0	0	0	0	112.1	M473 T474 S475 T480 T481	M473-S477 VanDerWaalsContact O-CB 3.31Å; M473-S477 WeakPolarHBondContact O-CB 3.41Å; M473-S477 PolarHBondContact O-N 3.09Å; M473-S477 PolarHBondContact O-OG 3.34Å; T474-S477 PolarHBondContact O-N 3.17Å; S475-S477 VanDerWaalsContact C-N 3.26Å; S475-S477 PolarHBondContact O-N 3.1Å; S477-T480 PolarHBondContact O-N 3.07Å; S477-T481 WeakPolarHBondContact O-CB 3.42Å; S477-T481 PolarHBondContact O-N 3.27Å; S477-T481 PolarHBondContact O-OG1 3.02Å
478	V	96.6	Very high	96.5	Very high	98 Å²	98	94.6 Å²	94.6	59%	0.594	53%	0.529	S	S	*	.	H	α-helix	trans	-62.8	-48.3	176.1	170.4	0	0	0	0	110.7	T474 S475 T480 T481 G482	T474-V478 WeakPolarHBondContact O-CG2 3.31Å; T474-V478 PolarHBondContact O-N 3.17Å; S475-V478 PolarHBondContact O-N 3.1Å; V478-T480 PolarHBondContact O-N 3.08Å; V478-T481 PolarHBondContact O-N 2.86Å; V478-G482 PolarHBondContact O-N 3.25Å
479	Y	96.9	Very high	96.5	Very high	163 Å²	163	92.8 Å²	92.8	64%	0.639	51%	0.513	S	S	*	.	H	α-helix	trans	-63.6	-42	177.1	-72.9	-66.8	0	0	0	112.7	S475 T481 G482 L483	S475-Y479 WeakPolarHBondContact O-CD2 3.45Å; S475-Y479 PolarHBondContact O-N 3.3Å; S475-Y479 VanDerWaalsContact O-N 3.1Å; S475-Y479 WeakPolarHBondContact OG-CE2 3.33Å; Y479-T481 VanDerWaalsContact C-N 3.31Å; Y479-T481 PolarHBondContact O-N 3.47Å; Y479-G482 PolarHBondContact O-N 2.85Å; Y479-L483 WeakPolarHBondContact O-CG 3.43Å; Y479-L483 PolarHBondContact O-N 3.48Å
480	T	98	Very high	96.4	Very high	93 Å²	93	88 Å²	88	57%	0.571	51%	0.507	S	S	*	.	H	α-helix	trans	-60.1	-43.2	176.6	-59.4	0	0	0	0	111	A476 S477 V478 L483 A484	A476-T480 WeakPolarHBondContact O-CB 3.3Å; A476-T480 PolarHBondContact O-N 3.43Å; A476-T480 PolarHBondContact O-OG1 2.9Å; S477-T480 PolarHBondContact O-N 3.07Å; V478-T480 PolarHBondContact O-N 3.08Å; T480-L483 PolarHBondContact O-N 3.11Å; T480-A484 VanDerWaalsContact O-CB 3.27Å; T480-A484 WeakPolarHBondContact O-CB 3.49Å; T480-A484 PolarHBondContact O-N 3.1Å
481	T	97.3	Very high	96.4	Very high	90 Å²	90	87.2 Å²	87.2	55%	0.552	51%	0.513	S	S	*	.	H	α-helix	trans	-64.4	-40.9	176.4	-56.5	0	0	0	0	111.7	S477 V478 Y479 A484 T485	S477-T481 WeakPolarHBondContact O-CB 3.42Å; S477-T481 PolarHBondContact O-N 3.27Å; S477-T481 PolarHBondContact O-OG1 3.02Å; V478-T481 PolarHBondContact O-N 2.86Å; Y479-T481 VanDerWaalsContact C-N 3.31Å; Y479-T481 PolarHBondContact O-N 3.47Å; T481-A484 PolarHBondContact O-N 3.38Å; T481-T485 WeakPolarHBondContact O-CB 3.4Å; T481-T485 PolarHBondContact O-N 3.09Å; T481-T485 PolarHBondContact O-OG1 2.79Å
482	G	94.9	Very high	96.3	Very high	35 Å²	35	84.9 Å²	84.9	36%	0.361	52%	0.516	S	S	.	.	H	α-helix	trans	-60.9	-49.5	175.2	0	0	0	0	0	112.4	V478 Y479 T485 M486	V478-G482 PolarHBondContact O-N 3.25Å; Y479-G482 PolarHBondContact O-N 2.85Å; G482-T485 WeakPolarHBondContact O-CB 3.18Å; G482-T485 PolarHBondContact O-N 2.96Å; G482-M486 PolarHBondContact O-N 2.65Å; G482-M486 VanDerWaalsContact O-N 3.11Å
483	L	97.1	Very high	96.2	Very high	120 Å²	120	81.7 Å²	81.7	63%	0.628	50%	0.5	S	S	*	.	H	α-helix	trans	-64.3	-40.8	177.7	-68	174	0	0	0	112.1	Y479 T480 T485 M486 L487	Y479-L483 WeakPolarHBondContact O-CG 3.43Å; Y479-L483 PolarHBondContact O-N 3.48Å; T480-L483 PolarHBondContact O-N 3.11Å; L483-T485 VanDerWaalsContact C-N 3.33Å; L483-T485 PolarHBondContact O-N 3.4Å; L483-M486 PolarHBondContact O-N 3.47Å; L483-L487 WeakPolarHBondContact O-CG 3.39Å; L483-L487 PolarHBondContact O-N 3.22Å
484	A	97.8	Very high	96	Very high	55 Å²	55	78.9 Å²	78.9	46%	0.455	49%	0.49	S	S	.	.	H	α-helix	trans	-62.6	-39.6	175.6	0	0	0	0	0	112	T480 T481 M486 L487 G488	T480-A484 VanDerWaalsContact O-CB 3.27Å; T480-A484 WeakPolarHBondContact O-CB 3.49Å; T480-A484 PolarHBondContact O-N 3.1Å; T481-A484 PolarHBondContact O-N 3.38Å; A484-M486 VanDerWaalsContact C-N 3.34Å; A484-M486 PolarHBondContact O-N 3.46Å; A484-L487 PolarHBondContact O-N 3.07Å; A484-G488 PolarHBondContact O-N 3.03Å
485	T	95.4	Very high	95.9	Very high	75 Å²	75	77.7 Å²	77.7	46%	0.46	48%	0.48	S	S	.	.	H	α-helix	trans	-61.2	-42	173.8	-57	0	0	0	0	111.4	T481 G482 L483 G488 L489	T481-T485 WeakPolarHBondContact O-CB 3.4Å; T481-T485 PolarHBondContact O-N 3.09Å; T481-T485 PolarHBondContact O-OG1 2.79Å; G482-T485 WeakPolarHBondContact O-CB 3.18Å; G482-T485 PolarHBondContact O-N 2.96Å; L483-T485 VanDerWaalsContact C-N 3.33Å; L483-T485 PolarHBondContact O-N 3.4Å; T485-G488 PolarHBondContact O-N 2.91Å; T485-L489 HydrophobicContact CG2-CD1 4.43Å; T485-L489 WeakPolarHBondContact O-CG 3.16Å; T485-L489 PolarHBondContact O-N 3.39Å
486	M	93.9	Very high	95.8	Very high	111 Å²	111	78.5 Å²	78.5	55%	0.547	49%	0.49	S	S	.	.	H	α-helix	trans	-62.8	-42.6	176.4	-67.6	-61.2	105.4	0	0	112.2	G482 L483 A484 G488 L489 G490	G482-M486 PolarHBondContact O-N 2.65Å; G482-M486 VanDerWaalsContact O-N 3.11Å; L483-M486 PolarHBondContact O-N 3.47Å; A484-M486 VanDerWaalsContact C-N 3.34Å; A484-M486 PolarHBondContact O-N 3.46Å; M486-G488 VanDerWaalsContact C-N 3.34Å; M486-L489 HydrophobicContact CE-CD1 3.81Å; M486-L489 PolarHBondContact O-N 3.15Å; M486-G490 PolarHBondContact O-N 3.44Å
487	L	96.6	Very high	95.6	Very high	123 Å²	123	77.9 Å²	77.9	64%	0.644	49%	0.485	S	S	*	.	H	α-helix	trans	-61.5	-43.2	173.7	-67.2	174.1	0	0	0	111.5	L483 A484 G490 I491	L483-L487 WeakPolarHBondContact O-CG 3.39Å; L483-L487 PolarHBondContact O-N 3.22Å; A484-L487 PolarHBondContact O-N 3.07Å; L487-G490 PolarHBondContact O-N 2.97Å; L487-I491 WeakPolarHBondContact O-CG1 3.47Å; L487-I491 PolarHBondContact O-N 3.08Å
488	G	96.5	Very high	95.5	Very high	36 Å²	36	76.7 Å²	76.7	37%	0.371	47%	0.473	S	S	.	.	H	α-helix	trans	-60.9	-44.2	177.2	0	0	0	0	0	113.1	A484 T485 M486 G490 I491 A492	A484-G488 PolarHBondContact O-N 3.03Å; T485-G488 PolarHBondContact O-N 2.91Å; M486-G488 VanDerWaalsContact C-N 3.34Å; G488-G490 VanDerWaalsContact C-N 3.31Å; G488-G490 PolarHBondContact O-N 3.01Å; G488-I491 PolarHBondContact O-N 3.29Å; G488-A492 WeakPolarHBondContact O-CB 3.37Å; G488-A492 PolarHBondContact O-N 3.24Å
489	L	94.8	Very high	95.4	Very high	64 Å²	64	75.2 Å²	75.2	34%	0.335	46%	0.464	S	S	.	.	H	α-helix	trans	-63.3	-37.6	174.4	-70.7	175.1	0	0	0	112	T485 M486 A492 A493 F498	T485-L489 HydrophobicContact CG2-CD1 4.43Å; T485-L489 WeakPolarHBondContact O-CG 3.16Å; T485-L489 PolarHBondContact O-N 3.39Å; M486-L489 HydrophobicContact CE-CD1 3.81Å; M486-L489 PolarHBondContact O-N 3.15Å; L489-A492 PolarHBondContact O-N 3.29Å; L489-A493 PolarHBondContact O-N 3.09Å; L489-A493 VanDerWaalsContact O-N 3.13Å; L489-F498 HydrophobicContact CD2-CZ 4.42Å
490	G	94.9	Very high	95.4	Very high	51 Å²	51	73.2 Å²	73.2	53%	0.526	46%	0.461	S	S	.	.	H	α-helix	trans	-64.1	-40	174.5	0	0	0	0	0	113	M486 L487 G488 A493	M486-G490 PolarHBondContact O-N 3.44Å; L487-G490 PolarHBondContact O-N 2.97Å; G488-G490 VanDerWaalsContact C-N 3.31Å; G488-G490 PolarHBondContact O-N 3.01Å; G490-A493 WeakPolarHBondContact O-CB 3.48Å; G490-A493 PolarHBondContact O-N 3.34Å
491	I	95.4	Very high	95.3	Very high	151 Å²	151	69 Å²	69	77%	0.774	44%	0.435	S	S	*	.	H	α-helix	trans	-67.9	-37.4	175.4	-67	164.4	0	0	0	111.2	L487 G488 A493	L487-I491 WeakPolarHBondContact O-CG1 3.47Å; L487-I491 PolarHBondContact O-N 3.08Å; G488-I491 PolarHBondContact O-N 3.29Å; I491-A493 VanDerWaalsContact C-N 3.28Å; I491-A493 PolarHBondContact O-N 2.78Å
492	A	93.1	Very high	95.3	Very high	71 Å²	71	66 Å²	66	59%	0.587	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-4.9	-179.2	0	0	0	0	0	114.1	G488 L489 P494	G488-A492 WeakPolarHBondContact O-CB 3.37Å; G488-A492 PolarHBondContact O-N 3.24Å; L489-A492 PolarHBondContact O-N 3.29Å; A492-P494 WeakPolarHBondContact O-CD 3.49Å
493	A	95.2	Very high	95.4	Very high	29 Å²	29	67.7 Å²	67.7	24%	0.24	42%	0.42	C	S	.	.			trans	-69.8	118.7	-175.3	0	0	0	0	0	111.7	L489 G490 I491 F498	L489-A493 PolarHBondContact O-N 3.09Å; L489-A493 VanDerWaalsContact O-N 3.13Å; G490-A493 WeakPolarHBondContact O-CB 3.48Å; G490-A493 PolarHBondContact O-N 3.34Å; I491-A493 VanDerWaalsContact C-N 3.28Å; I491-A493 PolarHBondContact O-N 2.78Å; A493-F498 HydrophobicContact CB-CD1 3.64Å; A493-F498 HydrophobicContact CB-CE1 4.18Å
494	P	93.4	Very high	95.3	Very high	47 Å²	47	63.7 Å²	63.7	31%	0.305	40%	0.401	S	S	.	.			trans	-78.4	-23.4	179.2	31.9	-36.3	0	0	0	112.9	A492 A734 L737	A492-P494 WeakPolarHBondContact O-CD 3.49Å; P494-A734 HydrophobicContact CB-CB 4.22Å; P494-A734 HydrophobicContact CG-CB 4.2Å; P494-L737 HydrophobicContact CG-CB 3.88Å; P494-L737 HydrophobicContact CG-CD2 3.58Å; P494-L737 HydrophobicContact CG-CG 4.33Å
495	N	94.1	Very high	95.3	Very high	66 Å²	66	64.2 Å²	64.2	35%	0.353	39%	0.393	S	S	.	.	S	Bend	trans	-158.3	173	-175.7	61	38.8	0	0	0	112.3	A497 F498	N495-A497 VanDerWaalsContact C-N 3.34Å; N495-A497 PolarHBondContact O-N 3.3Å; N495-A497 PolarHBondContact OD1-N 3.34Å; N495-F498 PolarHBondContact OD1-N 3.08Å
496	A	94.1	Very high	95.4	Very high	74 Å²	74	62.2 Å²	62.2	61%	0.612	39%	0.387	S	S	*	.	H	α-helix	trans	-66.8	-32.6	178.5	0	0	0	0	0	113	F498 T499 Q500	A496-F498 VanDerWaalsContact C-N 3.34Å; A496-F498 PolarHBondContact O-N 3.38Å; A496-T499 PolarHBondContact O-N 3.12Å; A496-T499 VanDerWaalsContact O-N 3.15Å; A496-Q500 WeakPolarHBondContact O-CG 3.17Å; A496-Q500 PolarHBondContact O-N 3.24Å
497	A	93.6	Very high	95.6	Very high	33 Å²	33	62 Å²	62	27%	0.273	39%	0.387	S	S	.	.	H	α-helix	trans	-61.5	-42.3	-179.3	0	0	0	0	0	111.7	N495 T499 Q500 M501	N495-A497 VanDerWaalsContact C-N 3.34Å; N495-A497 PolarHBondContact O-N 3.3Å; N495-A497 PolarHBondContact OD1-N 3.34Å; A497-T499 VanDerWaalsContact C-N 3.34Å; A497-T499 PolarHBondContact O-N 3.5Å; A497-Q500 PolarHBondContact O-N 3.21Å; A497-M501 WeakPolarHBondContact O-CB 3.45Å; A497-M501 PolarHBondContact O-N 2.88Å
498	F	95.3	Very high	95.6	Very high	25 Å²	25	56.6 Å²	56.6	11%	0.11	36%	0.361	C	S	.	.	H	α-helix	trans	-58.1	-45.6	173.5	177.5	-106.8	0	0	0	111.9	L489 A493 N495 A496 Q500 M501 V502 L737 F851	L489-F498 HydrophobicContact CD2-CZ 4.42Å; A493-F498 HydrophobicContact CB-CD1 3.64Å; A493-F498 HydrophobicContact CB-CE1 4.18Å; N495-F498 PolarHBondContact OD1-N 3.08Å; A496-F498 VanDerWaalsContact C-N 3.34Å; A496-F498 PolarHBondContact O-N 3.38Å; F498-Q500 VanDerWaalsContact C-N 3.34Å; F498-Q500 PolarHBondContact O-N 2.71Å; F498-M501 PolarHBondContact O-N 2.96Å; F498-V502 HydrophobicContact CD1-CG2 4.24Å; F498-V502 HydrophobicContact CD2-CG2 4.25Å; F498-V502 HydrophobicContact CE1-CG2 3.84Å; F498-V502 HydrophobicContact CE2-CG2 3.84Å; F498-V502 HydrophobicContact CG-CG2 4.46Å; F498-V502 HydrophobicContact CZ-CG2 3.63Å; F498-V502 WeakPolarHBondContact O-CG2 3.34Å; F498-V502 PolarHBondContact O-N 3.43Å; F498-L737 HydrophobicContact CB-CD2 3.89Å; F498-L737 HydrophobicContact CD2-CD1 3.78Å; F498-L737 HydrophobicContact CD2-CD2 3.49Å; F498-L737 VanDerWaalsContact CD2-CD2 3.49Å; F498-L737 HydrophobicContact CD2-CG 4.28Å; F498-L737 HydrophobicContact CE2-CD1 3.66Å; F498-L737 HydrophobicContact CE2-CD2 4.26Å; F498-L737 HydrophobicContact CG-CD2 3.87Å; F498-L737 HydrophobicContact CZ-CD1 4.41Å; F498-F851 HydrophobicContact CD2-CD1 4.29Å; F498-F851 HydrophobicContact CD2-CE1 4.44Å; F498-F851 HydrophobicContact CE2-CD1 4.28Å; F498-F851 HydrophobicContact CE2-CE1 4.26Å
499	T	95	Very high	95.6	Very high	67 Å²	67	55.9 Å²	55.9	41%	0.411	35%	0.353	S	S	.	.	H	α-helix	trans	-64.2	-39.3	179.6	-54.2	0	0	0	0	111.8	A496 A497 T503	A496-T499 PolarHBondContact O-N 3.12Å; A496-T499 VanDerWaalsContact O-N 3.15Å; A497-T499 VanDerWaalsContact C-N 3.34Å; A497-T499 PolarHBondContact O-N 3.5Å; T499-T503 PolarHBondContact O-N 3.07Å; T499-T503 PolarHBondContact O-OG1 3.13Å
500	Q	96.4	Very high	95.7	Very high	122 Å²	122	57.5 Å²	57.5	57%	0.57	36%	0.361	S	S	*	.	H	α-helix	trans	-64.1	-43.9	173.9	-67	-60.4	-21.7	0	0	111.4	A496 A497 F498 V502 T503 T504	A496-Q500 WeakPolarHBondContact O-CG 3.17Å; A496-Q500 PolarHBondContact O-N 3.24Å; A497-Q500 PolarHBondContact O-N 3.21Å; F498-Q500 VanDerWaalsContact C-N 3.34Å; F498-Q500 PolarHBondContact O-N 2.71Å; Q500-V502 PolarHBondContact O-N 3Å; Q500-T503 WeakPolarHBondContact O-CB 3.49Å; Q500-T503 PolarHBondContact O-N 2.9Å; Q500-T504 PolarHBondContact O-N 3.39Å; Q500-T504 PolarHBondContact O-OG1 3.39Å
501	M	96.3	Very high	95.8	Very high	3 Å²	3	58 Å²	58	2%	0.015	35%	0.354	C	S	.	.	H	α-helix	trans	-64.7	-41.4	178.5	-163.4	64.6	72	0	0	112.2	A497 F498 T503 T504 F505 F851 N854 T859	A497-M501 WeakPolarHBondContact O-CB 3.45Å; A497-M501 PolarHBondContact O-N 2.88Å; F498-M501 PolarHBondContact O-N 2.96Å; M501-T503 VanDerWaalsContact C-N 3.28Å; M501-T503 PolarHBondContact O-N 2.87Å; M501-T504 PolarHBondContact O-N 2.81Å; M501-F505 VanDerWaalsContact O-CB 3.25Å; M501-F505 WeakPolarHBondContact O-CB 3.24Å; M501-F505 PolarHBondContact O-N 3.06Å; M501-F851 HydrophobicContact CB-CD1 3.89Å; M501-F851 HydrophobicContact CB-CE1 3.69Å; M501-F851 HydrophobicContact CG-CD1 3.4Å; M501-F851 VanDerWaalsContact CG-CD1 3.4Å; M501-F851 HydrophobicContact CG-CE1 3.4Å; M501-F851 VanDerWaalsContact CG-CE1 3.4Å; M501-F851 HydrophobicContact CG-CG 4.22Å; M501-F851 HydrophobicContact CG-CZ 4.21Å; M501-N854 WeakPolarHBondContact CE-OD1 3.35Å; M501-T859 HydrophobicContact CG-CG2 4.11Å; M501-T859 HydrophobicContact SD-CG2 4.01Å; M501-T859 PolarHBondContact SD-OG1 3.07Å
502	V	97	Very high	95.8	Very high	29 Å²	29	50.9 Å²	50.9	18%	0.176	32%	0.317	C	S	.	.	H	α-helix	trans	-61.7	-38.3	173.8	171.4	0	0	0	0	111.1	F498 Q500 F505 G506 F851	F498-V502 HydrophobicContact CD1-CG2 4.24Å; F498-V502 HydrophobicContact CD2-CG2 4.25Å; F498-V502 HydrophobicContact CE1-CG2 3.84Å; F498-V502 HydrophobicContact CE2-CG2 3.84Å; F498-V502 HydrophobicContact CG-CG2 4.46Å; F498-V502 HydrophobicContact CZ-CG2 3.63Å; F498-V502 WeakPolarHBondContact O-CG2 3.34Å; F498-V502 PolarHBondContact O-N 3.43Å; Q500-V502 PolarHBondContact O-N 3Å; V502-F505 PolarHBondContact O-N 3.42Å; V502-G506 PolarHBondContact O-N 3.5Å; V502-F851 HydrophobicContact CG2-CE1 3.85Å; V502-F851 HydrophobicContact CG2-CZ 4.18Å
503	T	97	Very high	95.9	Very high	69 Å²	69	53 Å²	53	42%	0.423	31%	0.311	S	S	.	.	H	α-helix	trans	-63.8	-50.6	175.8	-56.8	0	0	0	0	111	T499 Q500 M501 F505 G506 L507	T499-T503 PolarHBondContact O-N 3.07Å; T499-T503 PolarHBondContact O-OG1 3.13Å; Q500-T503 WeakPolarHBondContact O-CB 3.49Å; Q500-T503 PolarHBondContact O-N 2.9Å; M501-T503 VanDerWaalsContact C-N 3.28Å; M501-T503 PolarHBondContact O-N 2.87Å; T503-F505 VanDerWaalsContact C-N 3.34Å; T503-F505 PolarHBondContact O-N 3.31Å; T503-G506 PolarHBondContact O-N 3.18Å; T503-L507 HydrophobicContact CG2-CD1 4.26Å; T503-L507 WeakPolarHBondContact O-CG 3.44Å; T503-L507 PolarHBondContact O-N 2.89Å
504	T	96.5	Very high	96	Very high	37 Å²	37	57.5 Å²	57.5	23%	0.227	33%	0.326	C	S	.	.	H	α-helix	trans	-59.2	-44	175.9	-61.7	0	0	0	0	111.5	Q500 M501 L507 A508 V860	Q500-T504 PolarHBondContact O-N 3.39Å; Q500-T504 PolarHBondContact O-OG1 3.39Å; M501-T504 PolarHBondContact O-N 2.81Å; T504-L507 PolarHBondContact O-N 3.27Å; T504-A508 WeakPolarHBondContact O-CB 3.35Å; T504-A508 PolarHBondContact O-N 3.21Å; T504-V860 HydrophobicContact CG2-CG2 3.57Å
505	F	97.4	Very high	96	Very high	65 Å²	65	56.3 Å²	56.3	29%	0.285	32%	0.318	S	S	.	.	H	α-helix	trans	-57.9	-48.7	175.8	171.1	-102.9	0	0	0	112.1	M501 V502 T503 A508 G509 W844 C847 F851 T859 A863	M501-F505 VanDerWaalsContact O-CB 3.25Å; M501-F505 WeakPolarHBondContact O-CB 3.24Å; M501-F505 PolarHBondContact O-N 3.06Å; V502-F505 PolarHBondContact O-N 3.42Å; T503-F505 VanDerWaalsContact C-N 3.34Å; T503-F505 PolarHBondContact O-N 3.31Å; F505-A508 PolarHBondContact O-N 2.95Å; F505-G509 PolarHBondContact O-N 2.8Å; F505-W844 HydrophobicContact CE2-CE3 4.15Å; F505-W844 AromaticContact CE2-CZ3 3.79Å; F505-W844 HydrophobicContact CE2-CZ3 3.79Å; F505-W844 HydrophobicContact CZ-CE3 4.44Å; F505-W844 AromaticContact CZ-CZ3 3.98Å; F505-W844 HydrophobicContact CZ-CZ3 3.98Å; F505-C847 HydrophobicContact CD2-CB 4.45Å; F505-C847 HydrophobicContact CE2-CB 4.25Å; F505-F851 HydrophobicContact CB-CE2 4.41Å; F505-F851 HydrophobicContact CB-CZ 3.88Å; F505-F851 HydrophobicContact CD1-CZ 4.49Å; F505-F851 HydrophobicContact CD2-CE2 4.2Å; F505-F851 HydrophobicContact CD2-CZ 4.48Å; F505-F851 HydrophobicContact CG-CE2 4.21Å; F505-F851 HydrophobicContact CG-CZ 4.04Å; F505-T859 HydrophobicContact CB-CG2 3.71Å; F505-T859 HydrophobicContact CD2-CG2 4.02Å; F505-T859 HydrophobicContact CG-CG2 4.34Å; F505-A863 HydrophobicContact CD2-CB 4.13Å; F505-A863 HydrophobicContact CE2-CB 4.25Å
506	G	96.8	Very high	96	Very high	33 Å²	33	53.3 Å²	53.3	34%	0.34	30%	0.302	S	S	.	.	H	α-helix	trans	-61.8	-46.5	179.4	0	0	0	0	0	112.4	V502 T503 G509 I510	V502-G506 PolarHBondContact O-N 3.5Å; T503-G506 PolarHBondContact O-N 3.18Å; G506-G509 PolarHBondContact O-N 2.95Å; G506-I510 WeakPolarHBondContact O-CG1 3.27Å; G506-I510 PolarHBondContact O-N 3.45Å; G506-I510 VanDerWaalsContact O-N 3.11Å
507	L	97.9	Very high	96	Very high	107 Å²	107	55.2 Å²	55.2	56%	0.56	29%	0.294	S	S	*	.	H	α-helix	trans	-64.8	-45.6	177.1	-67.4	175.8	0	0	0	111.8	T503 T504 G509 I510 V511	T503-L507 HydrophobicContact CG2-CD1 4.26Å; T503-L507 WeakPolarHBondContact O-CG 3.44Å; T503-L507 PolarHBondContact O-N 2.89Å; T504-L507 PolarHBondContact O-N 3.27Å; L507-G509 VanDerWaalsContact C-N 3.3Å; L507-G509 PolarHBondContact O-N 3.5Å; L507-I510 PolarHBondContact O-N 3.46Å; L507-V511 WeakPolarHBondContact O-CG2 3.39Å; L507-V511 PolarHBondContact O-N 2.9Å
508	A	97.2	Very high	95.9	Very high	10 Å²	10	55.6 Å²	55.6	8%	0.083	30%	0.302	C	S	.	.	H	α-helix	trans	-63.4	-36.2	177.5	0	0	0	0	0	112.2	T504 F505 V511 G512 V860 A863	T504-A508 WeakPolarHBondContact O-CB 3.35Å; T504-A508 PolarHBondContact O-N 3.21Å; F505-A508 PolarHBondContact O-N 2.95Å; A508-V511 PolarHBondContact O-N 2.8Å; A508-G512 PolarHBondContact O-N 3.47Å; A508-V860 HydrophobicContact CB-CB 4.24Å; A508-V860 HydrophobicContact CB-CG1 4.26Å; A508-V860 HydrophobicContact CB-CG2 4.11Å; A508-A863 HydrophobicContact CB-CB 3.95Å
509	G	96.5	Very high	95.9	Very high	20 Å²	20	54.7 Å²	54.7	21%	0.206	30%	0.298	C	S	.	.	H	α-helix	trans	-62.1	-43	173.2	0	0	0	0	0	112.6	F505 G506 L507 G512 Y513	F505-G509 PolarHBondContact O-N 2.8Å; G506-G509 PolarHBondContact O-N 2.95Å; L507-G509 VanDerWaalsContact C-N 3.3Å; L507-G509 PolarHBondContact O-N 3.5Å; G509-G512 PolarHBondContact O-N 3.06Å; G509-Y513 WeakPolarHBondContact O-CB 3.44Å; G509-Y513 PolarHBondContact O-N 3.1Å
510	I	96.9	Very high	95.7	Very high	99 Å²	99	53.8 Å²	53.8	51%	0.508	29%	0.292	S	S	.	.	H	α-helix	trans	-65.1	-42.9	175.2	-66.2	166.7	0	0	0	110.9	G506 L507 Y513 H514	G506-I510 WeakPolarHBondContact O-CG1 3.27Å; G506-I510 PolarHBondContact O-N 3.45Å; G506-I510 VanDerWaalsContact O-N 3.11Å; L507-I510 PolarHBondContact O-N 3.46Å; I510-Y513 PolarHBondContact O-N 3.04Å; I510-H514 PolarHBondContact O-N 3.42Å; I510-H514 VanDerWaalsContact O-N 3.16Å; I510-H514 PolarHBondContact O-ND1 3.28Å
511	V	97.3	Very high	95.6	Very high	62 Å²	62	50.9 Å²	50.9	38%	0.376	28%	0.284	S	S	.	.	H	α-helix	trans	-60.8	-47.4	175.9	169.5	0	0	0	0	110.5	L507 A508 Y513 H514 T515 V632	L507-V511 WeakPolarHBondContact O-CG2 3.39Å; L507-V511 PolarHBondContact O-N 2.9Å; A508-V511 PolarHBondContact O-N 2.8Å; V511-Y513 PolarHBondContact O-N 3.22Å; V511-H514 PolarHBondContact O-N 3.22Å; V511-T515 VanDerWaalsContact O-CB 3.26Å; V511-T515 WeakPolarHBondContact O-CB 3.47Å; V511-T515 PolarHBondContact O-N 3.07Å; V511-T515 PolarHBondContact O-OG1 2.84Å; V511-V632 HydrophobicContact CG1-CB 4.43Å; V511-V632 HydrophobicContact CG1-CG1 3.62Å; V511-V632 HydrophobicContact CG1-CG2 3.85Å
512	G	95.6	Very high	95.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.8	-42.4	178.3	0	0	0	0	0	112.7	A508 G509 H514 T515 V516 L864 S867	A508-G512 PolarHBondContact O-N 3.47Å; G509-G512 PolarHBondContact O-N 3.06Å; G512-H514 PolarHBondContact O-N 3.14Å; G512-T515 PolarHBondContact O-N 3.09Å; G512-V516 VanDerWaalsContact O-CG2 3.27Å; G512-V516 WeakPolarHBondContact O-CG2 3.25Å; G512-V516 PolarHBondContact O-N 2.82Å; G512-L864 VanDerWaalsContact CA-CD1 3.49Å; G512-S867 WeakPolarHBondContact CA-OG 3.45Å
513	Y	95.4	Very high	95.2	Very high	116 Å²	116	50.2 Å²	50.2	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-54.8	-54	175.1	178.5	-91.2	0	0	0	112	G509 I510 V511 W517 I871	G509-Y513 WeakPolarHBondContact O-CB 3.44Å; G509-Y513 PolarHBondContact O-N 3.1Å; I510-Y513 PolarHBondContact O-N 3.04Å; V511-Y513 PolarHBondContact O-N 3.22Å; Y513-W517 AromaticContact CD2-NE1 3.94Å; Y513-W517 AromaticContact CE1-CD1 3.76Å; Y513-W517 AromaticContact CE1-NE1 3.97Å; Y513-W517 AromaticContact CE2-CD1 3.84Å; Y513-W517 AromaticContact CE2-NE1 3.34Å; Y513-W517 VanDerWaalsContact CE2-NE1 3.34Å; Y513-W517 AromaticContact CZ-CD1 3.65Å; Y513-W517 AromaticContact CZ-NE1 3.36Å; Y513-W517 PolarHBondContact O-N 3.12Å; Y513-I871 HydrophobicContact CD2-CD1 3.96Å; Y513-I871 HydrophobicContact CD2-CG1 4.47Å; Y513-I871 HydrophobicContact CG-CD1 4.45Å
514	H	95.6	Very high	95.1	Very high	123 Å²	123	47.8 Å²	47.8	57%	0.569	27%	0.266	S	S	*	.	H	α-helix	trans	-70.4	-36.1	-177.6	-69.6	83.7	0	0	0	112.6	I510 V511 G512 G518	I510-H514 PolarHBondContact O-N 3.42Å; I510-H514 VanDerWaalsContact O-N 3.16Å; I510-H514 PolarHBondContact O-ND1 3.28Å; V511-H514 PolarHBondContact O-N 3.22Å; G512-H514 PolarHBondContact O-N 3.14Å; H514-G518 PolarHBondContact O-N 3.22Å
515	T	94.8	Very high	95	Very high	22 Å²	22	46 Å²	46	14%	0.135	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-42.1	-178.3	-58.7	0	0	0	0	111.3	V511 G512 G518 L635 A636	V511-T515 VanDerWaalsContact O-CB 3.26Å; V511-T515 WeakPolarHBondContact O-CB 3.47Å; V511-T515 PolarHBondContact O-N 3.07Å; V511-T515 PolarHBondContact O-OG1 2.84Å; G512-T515 PolarHBondContact O-N 3.09Å; T515-G518 PolarHBondContact O-N 3.31Å; T515-L635 HydrophobicContact CG2-CB 3.75Å; T515-A636 HydrophobicContact CG2-CB 3.82Å
516	V	92.7	Very high	94.9	Very high	3 Å²	3	43 Å²	43	2%	0.018	24%	0.241	C	C	.	.	H	α-helix	trans	-72.8	-40.3	-177.3	173.4	0	0	0	0	111.9	G512 G518 V519 L527 L635 I871	G512-V516 VanDerWaalsContact O-CG2 3.27Å; G512-V516 WeakPolarHBondContact O-CG2 3.25Å; G512-V516 PolarHBondContact O-N 2.82Å; V516-G518 PolarHBondContact O-N 3.16Å; V516-V519 WeakPolarHBondContact O-CB 3.4Å; V516-V519 PolarHBondContact O-N 3.38Å; V516-L527 HydrophobicContact CG1-CD2 4Å; V516-L635 HydrophobicContact CG2-CD2 4Å; V516-I871 HydrophobicContact CB-CD1 3.89Å; V516-I871 HydrophobicContact CG1-CB 4.07Å; V516-I871 HydrophobicContact CG1-CD1 4.02Å; V516-I871 HydrophobicContact CG1-CG2 3.97Å
517	W	94.1	Very high	94.8	Very high	114 Å²	114	41.4 Å²	41.4	43%	0.432	23%	0.225	S	C	.	.	H	α-helix	trans	-60.7	-24.8	174.5	-83.7	114.5	0	0	0	113.2	Y513 V519 I871 Y874 I875	Y513-W517 AromaticContact CD2-NE1 3.94Å; Y513-W517 AromaticContact CE1-CD1 3.76Å; Y513-W517 AromaticContact CE1-NE1 3.97Å; Y513-W517 AromaticContact CE2-CD1 3.84Å; Y513-W517 AromaticContact CE2-NE1 3.34Å; Y513-W517 VanDerWaalsContact CE2-NE1 3.34Å; Y513-W517 AromaticContact CZ-CD1 3.65Å; Y513-W517 AromaticContact CZ-NE1 3.36Å; Y513-W517 PolarHBondContact O-N 3.12Å; W517-V519 VanDerWaalsContact C-N 3.33Å; W517-I871 HydrophobicContact CD2-CG2 4.09Å; W517-I871 HydrophobicContact CE3-CG2 4.49Å; W517-I871 HydrophobicContact CG-CD1 4.42Å; W517-I871 HydrophobicContact CH2-CG2 4.44Å; W517-I871 HydrophobicContact CZ2-CG2 4.03Å; W517-Y874 HydrophobicContact CH2-CD1 4.06Å; W517-Y874 HydrophobicContact CH2-CE1 4.13Å; W517-Y874 HydrophobicContact CZ2-CD1 4.11Å; W517-Y874 HydrophobicContact CZ2-CE1 4.3Å; W517-I875 HydrophobicContact CH2-CD1 4.34Å; W517-I875 HydrophobicContact CH2-CG1 4Å; W517-I875 HydrophobicContact CZ3-CD1 4.02Å; W517-I875 HydrophobicContact CZ3-CG1 4.08Å
518	G	92.4	Very high	94.6	Very high	42 Å²	42	36.3 Å²	36.3	43%	0.433	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-5.9	175.2	0	0	0	0	0	114.9	H514 T515 V516 S639	H514-G518 PolarHBondContact O-N 3.22Å; T515-G518 PolarHBondContact O-N 3.31Å; V516-G518 PolarHBondContact O-N 3.16Å; G518-S639 WeakPolarHBondContact O-CA 3.26Å; G518-S639 WeakPolarHBondContact O-CB 3.38Å
519	V	94.7	Very high	94.5	Very high	6 Å²	6	36 Å²	36	4%	0.036	20%	0.196	C	C	.	.	S	Bend	trans	-73.3	136.5	-179.9	176.1	0	0	0	0	110.5	V516 W517 L523 L527 L638	V516-V519 WeakPolarHBondContact O-CB 3.4Å; V516-V519 PolarHBondContact O-N 3.38Å; W517-V519 VanDerWaalsContact C-N 3.33Å; V519-L523 HydrophobicContact CG1-CB 4.29Å; V519-L527 HydrophobicContact CB-CD2 4.35Å; V519-L527 HydrophobicContact CG1-CB 4.37Å; V519-L527 HydrophobicContact CG1-CD2 4.18Å; V519-L527 HydrophobicContact CG2-CD1 4.34Å; V519-L527 HydrophobicContact CG2-CD2 4.28Å; V519-L638 HydrophobicContact CG1-CB 4.02Å; V519-L638 HydrophobicContact CG2-CB 4.27Å
520	T	91.8	Very high	94.5	Very high	47 Å²	47	35 Å²	35	29%	0.288	19%	0.186	S	C	.	.			trans	-61.9	131.9	175.2	-53.4	0	0	0	0	110.1	A522 L523 L638 S639	T520-A522 HydrophobicContact CG2-CB 4.14Å; T520-A522 PolarHBondContact O-N 2.87Å; T520-A522 VanDerWaalsContact O-N 3.15Å; T520-L523 WeakPolarHBondContact O-CA 3.29Å; T520-L523 WeakPolarHBondContact O-CB 3.46Å; T520-L523 PolarHBondContact O-N 3Å; T520-L638 PolarHBondContact N-O 2.96Å; T520-S639 PolarHBondContact OG1-O 2.84Å
521	P	93	Very high	94.5	Very high	61 Å²	61	30.3 Å²	30.3	40%	0.396	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-53.9	-37.3	-179.6	-29.8	36.1	0	0	0	114.8	L523 H524 E989	P521-L523 PolarHBondContact O-N 3.02Å; P521-H524 WeakPolarHBondContact O-CB 3.4Å; P521-H524 VanDerWaalsContact O-CG 3.26Å; P521-H524 PolarHBondContact O-N 2.97Å; P521-H524 VanDerWaalsContact O-N 3.13Å; P521-E989 HydrophobicContact CB-CG 4.02Å; P521-E989 HydrophobicContact CG-CG 4.45Å
522	A	91.2	Very high	94.4	Very high	17 Å²	17	27.4 Å²	27.4	14%	0.14	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-59.6	-17.9	175	0	0	0	0	0	114.3	T520 N974	T520-A522 HydrophobicContact CG2-CB 4.14Å; T520-A522 PolarHBondContact O-N 2.87Å; T520-A522 VanDerWaalsContact O-N 3.15Å; A522-N974 HydrophobicContact CB-CB 4.2Å
523	L	95.2	Very high	94.4	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-105.6	11.7	-178.8	-64.5	177.6	0	0	0	113.8	V519 T520 P521 S525 P526 L527 L582 F585 L638 A644	V519-L523 HydrophobicContact CG1-CB 4.29Å; T520-L523 WeakPolarHBondContact O-CA 3.29Å; T520-L523 WeakPolarHBondContact O-CB 3.46Å; T520-L523 PolarHBondContact O-N 3Å; P521-L523 PolarHBondContact O-N 3.02Å; L523-S525 VanDerWaalsContact C-N 3.3Å; L523-S525 PolarHBondContact O-N 2.86Å; L523-P526 HydrophobicContact CD2-CB 4.49Å; L523-P526 HydrophobicContact CD2-CG 3.94Å; L523-P526 VanDerWaalsContact O-CD 3.28Å; L523-P526 WeakPolarHBondContact O-CD 3.48Å; L523-L527 WeakPolarHBondContact O-CB 3.17Å; L523-L527 PolarHBondContact O-N 2.79Å; L523-L582 HydrophobicContact CD2-CD2 4.21Å; L523-F585 HydrophobicContact CD2-CD2 4.11Å; L523-F585 HydrophobicContact CD2-CE2 3.87Å; L523-F585 HydrophobicContact CD2-CZ 4.26Å; L523-L638 WeakPolarHBondContact CD1-O 3.25Å; L523-A644 HydrophobicContact CD1-CB 4.07Å
524	H	94.6	Very high	94.5	Very high	19 Å²	19	22 Å²	22	9%	0.088	12%	0.123	C	C	.	.	H	α-helix	trans	-61	-33.4	176.8	-73.2	174	0	0	0	114.1	P521 L527 M528 L872 P970	P521-H524 WeakPolarHBondContact O-CB 3.4Å; P521-H524 VanDerWaalsContact O-CG 3.26Å; P521-H524 PolarHBondContact O-N 2.97Å; P521-H524 VanDerWaalsContact O-N 3.13Å; H524-L527 WeakPolarHBondContact O-CB 3.48Å; H524-L527 PolarHBondContact O-N 2.89Å; H524-M528 WeakPolarHBondContact O-CG 3.27Å; H524-M528 PolarHBondContact O-N 2.77Å; H524-L872 HydrophobicContact CB-CD2 4.09Å; H524-P970 HydrophobicContact CB-CB 3.91Å
525	S	93.1	Very high	94.6	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-67.7	-50	174.1	-82.5	0	0	0	0	112.2	L523 L527 M528 S529 P970 Q972	L523-S525 VanDerWaalsContact C-N 3.3Å; L523-S525 PolarHBondContact O-N 2.86Å; S525-L527 VanDerWaalsContact C-N 3.31Å; S525-L527 PolarHBondContact O-N 3.36Å; S525-M528 PolarHBondContact O-N 3.14Å; S525-S529 PolarHBondContact O-N 2.96Å; S525-S529 VanDerWaalsContact O-N 3.11Å; S525-P970 PolarHBondContact N-O 3.33Å; S525-P970 PolarHBondContact OG-O 2.98Å; S525-Q972 PolarHBondContact OG-N 2.87Å
526	P	95.8	Very high	94.7	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-53.1	-41.6	167	-30.7	35.4	0	0	0	114.7	L523 M528 S529 V530 M581 L582 F585	L523-P526 HydrophobicContact CD2-CB 4.49Å; L523-P526 HydrophobicContact CD2-CG 3.94Å; L523-P526 VanDerWaalsContact O-CD 3.28Å; L523-P526 WeakPolarHBondContact O-CD 3.48Å; P526-M528 PolarHBondContact O-N 2.93Å; P526-S529 PolarHBondContact O-N 3.37Å; P526-S529 VanDerWaalsContact O-N 3.15Å; P526-V530 WeakPolarHBondContact O-CG2 3.41Å; P526-V530 PolarHBondContact O-N 3.28Å; P526-M581 HydrophobicContact CB-CE 4.41Å; P526-M581 HydrophobicContact CG-CB 4.33Å; P526-M581 HydrophobicContact CG-CE 4.37Å; P526-L582 HydrophobicContact CB-CD2 3.81Å; P526-L582 HydrophobicContact CG-CD2 4.01Å; P526-F585 HydrophobicContact CG-CE2 4.27Å
527	L	95.8	Very high	94.9	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-56.7	-48.8	175.6	172.4	63.7	0	0	0	111.7	V516 V519 L523 H524 S525 S529 V530 T531 L635 L638 L872	V516-L527 HydrophobicContact CG1-CD2 4Å; V519-L527 HydrophobicContact CB-CD2 4.35Å; V519-L527 HydrophobicContact CG1-CB 4.37Å; V519-L527 HydrophobicContact CG1-CD2 4.18Å; V519-L527 HydrophobicContact CG2-CD1 4.34Å; V519-L527 HydrophobicContact CG2-CD2 4.28Å; L523-L527 WeakPolarHBondContact O-CB 3.17Å; L523-L527 PolarHBondContact O-N 2.79Å; H524-L527 WeakPolarHBondContact O-CB 3.48Å; H524-L527 PolarHBondContact O-N 2.89Å; S525-L527 VanDerWaalsContact C-N 3.31Å; S525-L527 PolarHBondContact O-N 3.36Å; L527-S529 VanDerWaalsContact C-N 3.29Å; L527-S529 PolarHBondContact O-N 3.03Å; L527-V530 PolarHBondContact O-N 2.82Å; L527-T531 HydrophobicContact CD1-CG2 4.35Å; L527-T531 PolarHBondContact O-N 2.65Å; L527-T531 PolarHBondContact O-OG1 3.44Å; L527-L635 HydrophobicContact CD1-CB 4.37Å; L527-L635 HydrophobicContact CD1-CD2 3.72Å; L527-L635 HydrophobicContact CD1-CG 3.58Å; L527-L638 HydrophobicContact CB-CD1 4.04Å; L527-L638 HydrophobicContact CD1-CD1 4.15Å; L527-L872 HydrophobicContact CD2-CD1 4.15Å; L527-L872 HydrophobicContact CD2-CD2 4.36Å; L527-L872 HydrophobicContact CD2-CG 4.47Å
528	M	94.1	Very high	95	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-61.9	-36.8	176.7	-72.8	-122.7	-74.3	0	0	112.6	H524 S525 P526 T531 N532 V703 I835 T836 L872 M969	H524-M528 WeakPolarHBondContact O-CG 3.27Å; H524-M528 PolarHBondContact O-N 2.77Å; S525-M528 PolarHBondContact O-N 3.14Å; P526-M528 PolarHBondContact O-N 2.93Å; M528-T531 WeakPolarHBondContact CA-OG1 3.38Å; M528-T531 PolarHBondContact O-OG1 2.86Å; M528-N532 WeakPolarHBondContact O-CB 3.35Å; M528-N532 PolarHBondContact O-N 2.84Å; M528-N532 VanDerWaalsContact O-N 3.08Å; M528-N532 PolarHBondContact O-OD1 3.26Å; M528-V703 HydrophobicContact CE-CG1 4.17Å; M528-I835 HydrophobicContact CE-CG2 3.75Å; M528-T836 HydrophobicContact CE-CG2 4.09Å; M528-T836 HydrophobicContact SD-CG2 3.79Å; M528-L872 HydrophobicContact CG-CD1 3.58Å; M528-L872 HydrophobicContact SD-CD1 3.96Å; M528-M969 HydrophobicContact CB-CE 3.52Å; M528-M969 HydrophobicContact CE-CE 3.44Å; M528-M969 VanDerWaalsContact CE-CE 3.44Å; M528-M969 HydrophobicContact CE-CG 3.67Å; M528-M969 HydrophobicContact CE-SD 4.15Å; M528-M969 HydrophobicContact CG-CE 4.07Å
529	S	94.6	Very high	95.3	Very high	3 Å²	3	7.5 Å²	7.5	2%	0.021	5%	0.047	C	C	.	.	H	α-helix	trans	-69.1	-39.1	176.5	-177.1	0	0	0	0	112.4	S525 P526 L527 N532 A533 G574 T578	S525-S529 PolarHBondContact O-N 2.96Å; S525-S529 VanDerWaalsContact O-N 3.11Å; P526-S529 PolarHBondContact O-N 3.37Å; P526-S529 VanDerWaalsContact O-N 3.15Å; L527-S529 VanDerWaalsContact C-N 3.29Å; L527-S529 PolarHBondContact O-N 3.03Å; S529-N532 PolarHBondContact O-N 3.05Å; S529-A533 PolarHBondContact O-N 3.42Å; S529-G574 PolarHBondContact OG-O 2.96Å; S529-T578 WeakPolarHBondContact CB-OG1 3.06Å; S529-T578 PolarHBondContact OG-N 3.15Å; S529-T578 PolarHBondContact OG-OG1 2.82Å
530	V	96.2	Very high	95.4	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-65	-45.7	174.4	171.3	0	0	0	0	111	P526 L527 N532 A533 I534 T578 A634 L635 L638	P526-V530 WeakPolarHBondContact O-CG2 3.41Å; P526-V530 PolarHBondContact O-N 3.28Å; L527-V530 PolarHBondContact O-N 2.82Å; V530-N532 PolarHBondContact O-N 3.1Å; V530-A533 WeakPolarHBondContact O-CB 3.41Å; V530-A533 PolarHBondContact O-N 3.48Å; V530-A533 VanDerWaalsContact O-N 3.14Å; V530-I534 HydrophobicContact CG1-CD1 3.59Å; V530-I534 HydrophobicContact CG1-CG1 4.25Å; V530-I534 WeakPolarHBondContact O-CG1 3.45Å; V530-I534 PolarHBondContact O-N 2.96Å; V530-T578 HydrophobicContact CG2-CG2 3.36Å; V530-A634 HydrophobicContact CG1-CB 4.15Å; V530-L635 HydrophobicContact CG1-CD1 3.72Å; V530-L638 HydrophobicContact CB-CD1 4.44Å; V530-L638 HydrophobicContact CG2-CD1 4.13Å
531	T	96.5	Very high	95.6	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-60.1	-35.1	176.7	53.3	0	0	0	0	111.6	L527 M528 S535 L635 N839 I865	L527-T531 HydrophobicContact CD1-CG2 4.35Å; L527-T531 PolarHBondContact O-N 2.65Å; L527-T531 PolarHBondContact O-OG1 3.44Å; M528-T531 WeakPolarHBondContact CA-OG1 3.38Å; M528-T531 PolarHBondContact O-OG1 2.86Å; T531-S535 VanDerWaalsContact O-CB 3.24Å; T531-S535 WeakPolarHBondContact O-CB 3.45Å; T531-S535 PolarHBondContact O-N 3.16Å; T531-S535 PolarHBondContact O-OG 2.9Å; T531-L635 HydrophobicContact CG2-CD2 4.13Å; T531-N839 PolarHBondContact OG1-ND2 3.24Å; T531-I865 HydrophobicContact CG2-CG1 4.29Å
532	N	94.6	Very high	95.7	Very high	2 Å²	2	2 Å²	2	1%	0.011	1%	0.013	C	C	.	.	H	α-helix	trans	-72.4	-34.1	176.3	-72.7	5.5	0	0	0	113.8	M528 S529 V530 S535 H707	M528-N532 WeakPolarHBondContact O-CB 3.35Å; M528-N532 PolarHBondContact O-N 2.84Å; M528-N532 VanDerWaalsContact O-N 3.08Å; M528-N532 PolarHBondContact O-OD1 3.26Å; S529-N532 PolarHBondContact O-N 3.05Å; V530-N532 PolarHBondContact O-N 3.1Å; N532-S535 WeakPolarHBondContact CA-OG 3.37Å; N532-S535 PolarHBondContact O-OG 3.42Å; N532-H707 PolarHBondContact ND2-CD2 3.01Å; N532-H707 PolarHBondContact ND2-NE2 3.39Å; N532-H707 PolarHBondContact OD1-CD2 3.04Å; N532-H707 PolarHBondContact OD1-NE2 3.44Å
533	A	96.2	Very high	96	Very high	0 Å²	0	1.2 Å²	1.2	0%	0	1%	0.006	C	C	.	.	H	α-helix	trans	-65.6	-46.5	173.5	0	0	0	0	0	110.7	S529 V530 G536 F575	S529-A533 PolarHBondContact O-N 3.42Å; V530-A533 WeakPolarHBondContact O-CB 3.41Å; V530-A533 PolarHBondContact O-N 3.48Å; V530-A533 VanDerWaalsContact O-N 3.14Å; A533-G536 PolarHBondContact O-N 3.02Å; A533-F575 HydrophobicContact CB-CD1 3.84Å; A533-F575 HydrophobicContact CB-CD2 3.9Å; A533-F575 HydrophobicContact CB-CE1 3.9Å; A533-F575 HydrophobicContact CB-CE2 3.95Å; A533-F575 HydrophobicContact CB-CG 3.83Å; A533-F575 HydrophobicContact CB-CZ 3.94Å
534	I	97.7	Very high	96.1	Very high	1 Å²	1	3.4 Å²	3.4	1%	0.005	2%	0.02	C	C	.	.	H	α-helix	trans	-71.8	-34.7	-178.2	-61.4	173.2	0	0	0	111.1	V530 G536 L537 F575 C631 A634 L635 V655 V861 I865	V530-I534 HydrophobicContact CG1-CD1 3.59Å; V530-I534 HydrophobicContact CG1-CG1 4.25Å; V530-I534 WeakPolarHBondContact O-CG1 3.45Å; V530-I534 PolarHBondContact O-N 2.96Å; I534-G536 PolarHBondContact O-N 2.83Å; I534-G536 VanDerWaalsContact O-N 3.13Å; I534-L537 HydrophobicContact CG2-CD1 4.07Å; I534-L537 VanDerWaalsContact O-CB 3.3Å; I534-L537 WeakPolarHBondContact O-CB 3.31Å; I534-L537 WeakPolarHBondContact O-CG 3.34Å; I534-L537 PolarHBondContact O-N 3.35Å; I534-F575 HydrophobicContact CG1-CZ 4.41Å; I534-C631 HydrophobicContact CD1-CB 4.2Å; I534-C631 HydrophobicContact CG2-CB 4.25Å; I534-A634 HydrophobicContact CD1-CB 3.98Å; I534-L635 HydrophobicContact CD1-CD1 3.94Å; I534-V655 HydrophobicContact CG1-CG2 4.39Å; I534-V861 HydrophobicContact CG2-CB 4.41Å; I534-V861 HydrophobicContact CG2-CG1 3.46Å; I534-V861 VanDerWaalsContact CG2-CG1 3.46Å; I534-V861 HydrophobicContact CG2-CG2 4.1Å; I534-I865 HydrophobicContact CG2-CD1 4.47Å
535	S	96.9	Very high	96.2	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-62.9	-18.8	177	69.2	0	0	0	0	113.2	T531 N532 L537 T538 V710	T531-S535 VanDerWaalsContact O-CB 3.24Å; T531-S535 WeakPolarHBondContact O-CB 3.45Å; T531-S535 PolarHBondContact O-N 3.16Å; T531-S535 PolarHBondContact O-OG 2.9Å; N532-S535 WeakPolarHBondContact CA-OG 3.37Å; N532-S535 PolarHBondContact O-OG 3.42Å; S535-L537 PolarHBondContact O-N 2.83Å; S535-T538 PolarHBondContact O-N 3.18Å; S535-V710 WeakPolarHBondContact OG-CG2 3.25Å
536	G	96.7	Very high	96.4	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.023	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-3.5	167.9	0	0	0	0	0	114.4	A533 I534 T538 A539 S567 I571	A533-G536 PolarHBondContact O-N 3.02Å; I534-G536 PolarHBondContact O-N 2.83Å; I534-G536 VanDerWaalsContact O-N 3.13Å; G536-T538 PolarHBondContact O-N 2.93Å; G536-T538 VanDerWaalsContact O-N 3.16Å; G536-A539 WeakPolarHBondContact O-CB 3.36Å; G536-A539 PolarHBondContact O-N 2.94Å; G536-S567 WeakPolarHBondContact O-CB 3.31Å; G536-I571 WeakPolarHBondContact O-CD1 3.26Å
537	L	97.9	Very high	96.2	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	3%	0.03	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-4.7	169.1	-79.5	171.6	0	0	0	114.4	I534 S535 A539 V540 V655 L857 L858 V861	I534-L537 HydrophobicContact CG2-CD1 4.07Å; I534-L537 VanDerWaalsContact O-CB 3.3Å; I534-L537 WeakPolarHBondContact O-CB 3.31Å; I534-L537 WeakPolarHBondContact O-CG 3.34Å; I534-L537 PolarHBondContact O-N 3.35Å; S535-L537 PolarHBondContact O-N 2.83Å; L537-A539 PolarHBondContact O-N 2.9Å; L537-V540 HydrophobicContact CD2-CG2 3.82Å; L537-V540 VanDerWaalsContact O-CB 3.25Å; L537-V540 WeakPolarHBondContact O-CB 3.12Å; L537-V540 PolarHBondContact O-N 3.16Å; L537-V655 HydrophobicContact CD1-CG2 4.17Å; L537-V655 HydrophobicContact CD2-CB 4.46Å; L537-V655 HydrophobicContact CD2-CG1 4.07Å; L537-V655 HydrophobicContact CD2-CG2 4.42Å; L537-V655 HydrophobicContact CG-CG1 4.46Å; L537-V655 HydrophobicContact CG-CG2 4.13Å; L537-L857 HydrophobicContact CD1-CD2 4.39Å; L537-L857 HydrophobicContact CD1-CG 4.42Å; L537-L857 HydrophobicContact CD2-CD2 4.43Å; L537-L858 HydrophobicContact CB-CD2 4.3Å; L537-L858 WeakPolarHBondContact O-CD2 3.28Å; L537-V861 HydrophobicContact CD1-CB 4.41Å; L537-V861 HydrophobicContact CD1-CG1 4.14Å; L537-V861 HydrophobicContact CD1-CG2 3.79Å
538	T	96.9	Very high	96.1	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-52.2	-20.5	159.7	50.4	0	0	0	0	112.5	S535 G536 V540 G541 G542 S567 V710 A713 L846 E849	S535-T538 PolarHBondContact O-N 3.18Å; G536-T538 PolarHBondContact O-N 2.93Å; G536-T538 VanDerWaalsContact O-N 3.16Å; T538-V540 PolarHBondContact O-N 3.49Å; T538-G541 PolarHBondContact O-N 3.21Å; T538-G541 VanDerWaalsContact O-N 3.14Å; T538-G542 PolarHBondContact O-N 2.81Å; T538-G542 VanDerWaalsContact O-N 3.08Å; T538-S567 WeakPolarHBondContact CB-OG 3.19Å; T538-S567 WeakPolarHBondContact OG1-CB 3.35Å; T538-S567 PolarHBondContact OG1-OG 3.15Å; T538-V710 HydrophobicContact CG2-CG1 3.9Å; T538-A713 HydrophobicContact CG2-CB 4.4Å; T538-L846 HydrophobicContact CG2-CD1 3.44Å; T538-L846 VanDerWaalsContact CG2-CD1 3.44Å; T538-L846 HydrophobicContact CG2-CG 3.84Å; T538-E849 WeakPolarHBondContact CG2-OE2 3.39Å
539	A	97.5	Very high	96.2	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-56.1	-33.6	168.4	0	0	0	0	0	113	G536 L537 G541 G542 L543 S567 I571 L659	G536-A539 WeakPolarHBondContact O-CB 3.36Å; G536-A539 PolarHBondContact O-N 2.94Å; L537-A539 PolarHBondContact O-N 2.9Å; A539-G541 VanDerWaalsContact C-N 3.34Å; A539-G541 PolarHBondContact O-N 3.11Å; A539-G542 PolarHBondContact O-N 3.04Å; A539-L543 WeakPolarHBondContact O-CB 3.14Å; A539-L543 WeakPolarHBondContact O-CG 3.38Å; A539-L543 PolarHBondContact O-N 2.91Å; A539-S567 VanDerWaalsContact N-CB 3.29Å; A539-S567 PolarHBondContact N-OG 3.32Å; A539-I571 HydrophobicContact CB-CD1 4.33Å; A539-L659 HydrophobicContact CB-CD2 3.96Å
540	V	97.4	Very high	96.2	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.7	-45.8	175.7	168.7	0	0	0	0	110.4	L537 T538 L543 V544 L659 T662 N855 L858	L537-V540 HydrophobicContact CD2-CG2 3.82Å; L537-V540 VanDerWaalsContact O-CB 3.25Å; L537-V540 WeakPolarHBondContact O-CB 3.12Å; L537-V540 PolarHBondContact O-N 3.16Å; T538-V540 PolarHBondContact O-N 3.49Å; V540-L543 PolarHBondContact O-N 3.47Å; V540-V544 PolarHBondContact O-N 2.95Å; V540-L659 HydrophobicContact CG2-CD2 4.11Å; V540-T662 HydrophobicContact CG1-CG2 3.96Å; V540-T662 WeakPolarHBondContact CG1-OG1 3.18Å; V540-N855 WeakPolarHBondContact CG1-ND2 3.39Å; V540-L858 HydrophobicContact CB-CD2 4.13Å; V540-L858 HydrophobicContact CG1-CD1 4.35Å; V540-L858 HydrophobicContact CG1-CD2 4.43Å; V540-L858 HydrophobicContact CG1-CG 4.35Å
541	G	95.3	Very high	96.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-69	-37	177.4	0	0	0	0	0	113.3	T538 A539 L543 V544 L545 E849	T538-G541 PolarHBondContact O-N 3.21Å; T538-G541 VanDerWaalsContact O-N 3.14Å; A539-G541 VanDerWaalsContact C-N 3.34Å; A539-G541 PolarHBondContact O-N 3.11Å; G541-L543 PolarHBondContact O-N 3.47Å; G541-V544 VanDerWaalsContact O-CG2 3.27Å; G541-V544 WeakPolarHBondContact O-CG2 3.35Å; G541-L545 WeakPolarHBondContact O-CG 3.46Å; G541-L545 PolarHBondContact O-N 3.15Å; G541-E849 WeakPolarHBondContact CA-OE1 3.33Å
542	G	96.5	Very high	96.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-58.5	-47.2	169.2	0	0	0	0	0	112.6	T538 A539 V544 L545 M546 A560	T538-G542 PolarHBondContact O-N 2.81Å; T538-G542 VanDerWaalsContact O-N 3.08Å; A539-G542 PolarHBondContact O-N 3.04Å; G542-V544 PolarHBondContact O-N 2.91Å; G542-L545 PolarHBondContact O-N 3.26Å; G542-M546 VanDerWaalsContact O-CG 3.3Å; G542-M546 WeakPolarHBondContact O-CG 3.42Å; G542-M546 PolarHBondContact O-N 2.93Å; G542-A560 WeakPolarHBondContact O-CB 3.4Å
543	L	97.6	Very high	96.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.3	-39.2	-176	-72.9	170.1	0	0	0	113.1	A539 V540 G541 L545 M546 L659 T662 L663 L666 M676 M680	A539-L543 WeakPolarHBondContact O-CB 3.14Å; A539-L543 WeakPolarHBondContact O-CG 3.38Å; A539-L543 PolarHBondContact O-N 2.91Å; V540-L543 PolarHBondContact O-N 3.47Å; G541-L543 PolarHBondContact O-N 3.47Å; L543-L545 VanDerWaalsContact C-N 3.25Å; L543-L545 PolarHBondContact O-N 2.85Å; L543-M546 HydrophobicContact CD2-SD 4.18Å; L543-M546 PolarHBondContact O-N 3.28Å; L543-L659 HydrophobicContact CD1-CD2 3.91Å; L543-T662 HydrophobicContact CB-CG2 4.28Å; L543-L663 HydrophobicContact CD1-CD2 4.08Å; L543-L663 HydrophobicContact CD1-CG 4.15Å; L543-L663 HydrophobicContact CD2-CD2 4.02Å; L543-L666 WeakPolarHBondContact O-CD1 3.44Å; L543-M676 HydrophobicContact CD2-CB 3.78Å; L543-M676 HydrophobicContact CD2-CE 4.49Å; L543-M676 HydrophobicContact CD2-CG 3.67Å; L543-M676 HydrophobicContact CD2-SD 3.97Å; L543-M676 VanDerWaalsContact O-CE 3.32Å; L543-M676 WeakPolarHBondContact O-CE 3.47Å; L543-M680 HydrophobicContact CD1-SD 4.13Å; L543-M680 HydrophobicContact CD2-SD 4.42Å
544	V	96.8	Very high	96.2	Very high	47 Å²	47	34.7 Å²	34.7	29%	0.285	18%	0.178	S	C	.	.	H	α-helix	trans	-69.5	-23.2	179.1	-60.7	0	0	0	0	113.3	V540 G541 G542 T662 L666 L853	V540-V544 PolarHBondContact O-N 2.95Å; G541-V544 VanDerWaalsContact O-CG2 3.27Å; G541-V544 WeakPolarHBondContact O-CG2 3.35Å; G542-V544 PolarHBondContact O-N 2.91Å; V544-T662 HydrophobicContact CG1-CG2 3.51Å; V544-L666 HydrophobicContact CB-CD2 4.44Å; V544-L666 HydrophobicContact CG1-CD1 4.31Å; V544-L666 HydrophobicContact CG1-CD2 4.33Å; V544-L853 HydrophobicContact CG2-CD1 3.81Å; V544-L853 HydrophobicContact CG2-CD2 3.69Å; V544-L853 HydrophobicContact CG2-CG 4.36Å
545	L	96.9	Very high	96.1	Very high	19 Å²	19	37.3 Å²	37.3	10%	0.099	20%	0.2	C	C	.	.	H	α-helix	trans	-97.3	-6.6	177	-57.7	179.7	0	0	0	113.2	G541 G542 L543 A560 T717 A720 E721 I724 L853	G541-L545 WeakPolarHBondContact O-CG 3.46Å; G541-L545 PolarHBondContact O-N 3.15Å; G542-L545 PolarHBondContact O-N 3.26Å; L543-L545 VanDerWaalsContact C-N 3.25Å; L543-L545 PolarHBondContact O-N 2.85Å; L545-A560 HydrophobicContact CB-CB 3.8Å; L545-T717 HydrophobicContact CD1-CG2 3.62Å; L545-A720 HydrophobicContact CD1-CB 4.04Å; L545-E721 HydrophobicContact CD1-CB 3.88Å; L545-E721 HydrophobicContact CD2-CB 4.35Å; L545-E721 HydrophobicContact CD2-CG 4.32Å; L545-I724 HydrophobicContact CB-CD1 4.04Å; L545-I724 HydrophobicContact CD2-CD1 3.88Å; L545-I724 HydrophobicContact CG-CD1 4.43Å; L545-L853 HydrophobicContact CD2-CD2 4.15Å; L545-L853 HydrophobicContact CG-CD2 4.43Å
546	M	96.3	Very high	96.1	Very high	11 Å²	11	37.9 Å²	37.9	5%	0.054	20%	0.203	C	C	.	.			trans	-74.6	137	173.3	-82.3	179.1	73.6	0	0	110.5	G542 L543 A560 V561 A564 Q675 M676	G542-M546 VanDerWaalsContact O-CG 3.3Å; G542-M546 WeakPolarHBondContact O-CG 3.42Å; G542-M546 PolarHBondContact O-N 2.93Å; L543-M546 HydrophobicContact CD2-SD 4.18Å; L543-M546 PolarHBondContact O-N 3.28Å; M546-A560 HydrophobicContact CB-CB 4.45Å; M546-A560 HydrophobicContact CG-CB 3.69Å; M546-V561 HydrophobicContact CE-CB 4.24Å; M546-V561 HydrophobicContact CE-CG2 3.57Å; M546-V561 HydrophobicContact CG-CG2 4.17Å; M546-V561 HydrophobicContact SD-CG2 4.28Å; M546-A564 HydrophobicContact SD-CB 3.78Å; M546-Q675 HydrophobicContact CE-CG 3.95Å; M546-M676 HydrophobicContact CB-CE 3.78Å; M546-M676 HydrophobicContact CE-CB 4.36Å; M546-M676 HydrophobicContact CE-CG 3.78Å; M546-M676 HydrophobicContact SD-CG 4.14Å
547	G	92.5	Very high	96.1	Very high	15 Å²	15	39 Å²	39	16%	0.155	21%	0.209	C	C	.	.			trans	-159	-178.1	-178.8	0	0	0	0	0	111.7	Q557	G547-Q557 VanDerWaalsContact C-CD 3.42Å; G547-Q557 VanDerWaalsContact O-CD 3.31Å; G547-Q557 PolarHBondContact O-OE1 3.16Å
548	G	93.9	Very high	96.1	Very high	20 Å²	20	41.5 Å²	41.5	21%	0.206	23%	0.226	C	C	.	.	S	Bend	trans	92.9	-137.3	-172.5	0	0	0	0	0	111.6
549	H	94.8	Very high	96.2	Very high	99 Å²	99	43.6 Å²	43.6	46%	0.458	24%	0.237	S	C	.	.	S	Bend	trans	-128.3	-131.1	-176.3	-62.1	-66.8	0	0	0	111	I551 E553 E671 Q675	H549-I551 PolarHBondContact N-O 3.28Å; H549-I551 PolarHBondContact O-N 3.13Å; H549-E553 IonicContact CD2-OE1 2.76Å; H549-E553 PolarHBondContact CD2-OE1 3.17Å; H549-E553 IonicContact NE2-OE1 3.18Å; H549-E671 HydrophobicContact CB-CB 4.1Å; H549-Q675 PolarHBondContact O-OE1 3.27Å
550	Y	95	Very high	96.2	Very high	152 Å²	152	43.6 Å²	43.6	60%	0.596	24%	0.237	S	C	*	.	S	Bend	trans	-62.3	-25.9	175.6	-73.6	-69.9	0	0	0	113.5	E671 A674	Y550-E671 HydrophobicContact CD1-CB 4.26Å; Y550-E671 HydrophobicContact CD2-CB 3.82Å; Y550-E671 HydrophobicContact CD2-CG 3.75Å; Y550-E671 HydrophobicContact CE1-CB 4.22Å; Y550-E671 HydrophobicContact CE1-CG 4.36Å; Y550-E671 HydrophobicContact CE2-CB 3.76Å; Y550-E671 HydrophobicContact CE2-CG 3.26Å; Y550-E671 HydrophobicContact CG-CB 4.07Å; Y550-E671 HydrophobicContact CG-CG 4.47Å; Y550-A674 HydrophobicContact CD1-CB 4.18Å; Y550-A674 HydrophobicContact CE1-CB 3.88Å
551	I	95.3	Very high	96.2	Very high	127 Å²	127	45.2 Å²	45.2	65%	0.651	25%	0.247	S	C	*	.	S	Bend	trans	-131.3	152.1	-179.9	59.6	172.1	0	0	0	109.1	H549	H549-I551 PolarHBondContact N-O 3.28Å; H549-I551 PolarHBondContact O-N 3.13Å
552	P	96.3	Very high	96.3	Very high	42 Å²	42	48.8 Å²	48.8	27%	0.273	27%	0.266	S	S	.	.			trans	-70.6	144.3	177.6	30.9	-31.9	0	0	0	110	Q557 S558 V561 Q675	P552-Q557 HydrophobicContact CB-CB 3.71Å; P552-S558 WeakPolarHBondContact CG-OG 3.47Å; P552-V561 HydrophobicContact CB-CG2 4.41Å; P552-V561 HydrophobicContact CG-CG2 4.47Å; P552-Q675 VanDerWaalsContact CD-NE2 3.26Å; P552-Q675 VanDerWaalsContact N-NE2 3.18Å
553	E	95.4	Very high	96.4	Very high	127 Å²	127	48.8 Å²	48.8	59%	0.593	27%	0.266	S	S	*	.	S	Bend	trans	-97.6	-22.8	-177.4	-60.5	-177.7	161.7	0	0	112.6	H549	H549-E553 IonicContact CD2-OE1 2.76Å; H549-E553 PolarHBondContact CD2-OE1 3.17Å; H549-E553 IonicContact NE2-OE1 3.18Å
554	N	96.2	Very high	96.4	Very high	69 Å²	69	48.8 Å²	48.8	37%	0.369	27%	0.266	S	S	.	.	S	Bend	trans	-137.3	170.8	-178.9	62	43.2	0	0	0	112.4	P556 Q557 S558	N554-P556 WeakPolarHBondContact OD1-CD 3.38Å; N554-P556 VanDerWaalsContact OD1-CG 3.25Å; N554-P556 WeakPolarHBondContact OD1-CG 3.28Å; N554-Q557 PolarHBondContact ND2-NE2 2.89Å; N554-Q557 WeakPolarHBondContact OD1-CB 3.49Å; N554-Q557 VanDerWaalsContact OD1-CD 3.28Å; N554-Q557 WeakPolarHBondContact OD1-CG 3.41Å; N554-Q557 PolarHBondContact OD1-N 3.29Å; N554-S558 PolarHBondContact O-N 2.76Å; N554-S558 VanDerWaalsContact O-N 3.15Å; N554-S558 PolarHBondContact O-OG 3.2Å
555	A	96.3	Very high	96.5	Very high	55 Å²	55	48.9 Å²	48.9	46%	0.455	26%	0.262	S	S	.	.	H	α-helix	trans	-59.3	-48.9	-178.9	0	0	0	0	0	113.8	Q557 S558 L559 M723	A555-Q557 VanDerWaalsContact C-N 3.34Å; A555-Q557 PolarHBondContact O-N 3.2Å; A555-S558 WeakPolarHBondContact O-CA 3.25Å; A555-S558 WeakPolarHBondContact O-CB 3.38Å; A555-S558 PolarHBondContact O-N 3.29Å; A555-L559 WeakPolarHBondContact O-CG 3.35Å; A555-L559 PolarHBondContact O-N 3.41Å; A555-M723 HydrophobicContact CB-CE 3.77Å
556	P	96.6	Very high	96.5	Very high	12 Å²	12	48.5 Å²	48.5	8%	0.078	26%	0.26	C	S	.	.	H	α-helix	trans	-64.3	-36.4	-178.7	21.8	-30.4	0	0	0	113	N554 S558 L559 A560 A720 M723 I724	N554-P556 WeakPolarHBondContact OD1-CD 3.38Å; N554-P556 VanDerWaalsContact OD1-CG 3.25Å; N554-P556 WeakPolarHBondContact OD1-CG 3.28Å; P556-S558 VanDerWaalsContact C-N 3.28Å; P556-S558 PolarHBondContact O-N 3.43Å; P556-L559 PolarHBondContact O-N 3.48Å; P556-A560 WeakPolarHBondContact O-CB 3.48Å; P556-A560 PolarHBondContact O-N 3.21Å; P556-A720 HydrophobicContact CB-CB 4.04Å; P556-M723 HydrophobicContact CB-CB 4.11Å; P556-M723 HydrophobicContact CG-CB 4.22Å; P556-I724 HydrophobicContact CB-CD1 3.86Å; P556-I724 HydrophobicContact CB-CG1 3.67Å; P556-I724 HydrophobicContact CG-CD1 4.4Å; P556-I724 HydrophobicContact CG-CG1 3.81Å
557	Q	97.3	Very high	96.6	Very high	25 Å²	25	48 Å²	48	12%	0.117	26%	0.258	C	S	.	.	H	α-helix	trans	-61.6	-36.9	172	-69.8	166.4	-2.5	0	0	112	G547 P552 N554 A555 A560 V561	G547-Q557 VanDerWaalsContact C-CD 3.42Å; G547-Q557 VanDerWaalsContact O-CD 3.31Å; G547-Q557 PolarHBondContact O-OE1 3.16Å; P552-Q557 HydrophobicContact CB-CB 3.71Å; N554-Q557 PolarHBondContact ND2-NE2 2.89Å; N554-Q557 WeakPolarHBondContact OD1-CB 3.49Å; N554-Q557 VanDerWaalsContact OD1-CD 3.28Å; N554-Q557 WeakPolarHBondContact OD1-CG 3.41Å; N554-Q557 PolarHBondContact OD1-N 3.29Å; A555-Q557 VanDerWaalsContact C-N 3.34Å; A555-Q557 PolarHBondContact O-N 3.2Å; Q557-A560 PolarHBondContact O-N 3.41Å; Q557-V561 WeakPolarHBondContact O-CG2 3.47Å; Q557-V561 PolarHBondContact O-N 3.27Å
558	S	97.8	Very high	96.9	Very high	52 Å²	52	47.6 Å²	47.6	36%	0.364	25%	0.253	S	S	.	.	H	α-helix	trans	-67.3	-39.7	176.2	-57.2	0	0	0	0	112.4	P552 N554 A555 P556 A560 V561 L562	P552-S558 WeakPolarHBondContact CG-OG 3.47Å; N554-S558 PolarHBondContact O-N 2.76Å; N554-S558 VanDerWaalsContact O-N 3.15Å; N554-S558 PolarHBondContact O-OG 3.2Å; A555-S558 WeakPolarHBondContact O-CA 3.25Å; A555-S558 WeakPolarHBondContact O-CB 3.38Å; A555-S558 PolarHBondContact O-N 3.29Å; P556-S558 VanDerWaalsContact C-N 3.28Å; P556-S558 PolarHBondContact O-N 3.43Å; S558-A560 VanDerWaalsContact C-N 3.34Å; S558-V561 PolarHBondContact O-N 3.28Å; S558-L562 PolarHBondContact O-N 3.29Å; S558-L562 VanDerWaalsContact O-N 3.14Å
559	L	98	Very high	97.1	Very high	44 Å²	44	47 Å²	47	23%	0.23	25%	0.245	C	C	.	.	H	α-helix	trans	-64.6	-40.6	174.2	-61.8	176.4	0	0	0	111	A555 P556 L562 S563 L716 V719 A720 M723	A555-L559 WeakPolarHBondContact O-CG 3.35Å; A555-L559 PolarHBondContact O-N 3.41Å; P556-L559 PolarHBondContact O-N 3.48Å; L559-L562 PolarHBondContact O-N 2.98Å; L559-S563 PolarHBondContact O-N 2.93Å; L559-L716 HydrophobicContact CB-CD2 4.44Å; L559-L716 HydrophobicContact CD2-CD2 3.65Å; L559-V719 HydrophobicContact CD1-CG1 4.03Å; L559-A720 HydrophobicContact CB-CB 4.02Å; L559-A720 HydrophobicContact CD1-CB 4.27Å; L559-M723 HydrophobicContact CD1-SD 4.05Å
560	A	97.8	Very high	97.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-43	177.1	0	0	0	0	0	112.5	G542 L545 M546 P556 Q557 S558 L562 S563 A564	G542-A560 WeakPolarHBondContact O-CB 3.4Å; L545-A560 HydrophobicContact CB-CB 3.8Å; M546-A560 HydrophobicContact CB-CB 4.45Å; M546-A560 HydrophobicContact CG-CB 3.69Å; P556-A560 WeakPolarHBondContact O-CB 3.48Å; P556-A560 PolarHBondContact O-N 3.21Å; Q557-A560 PolarHBondContact O-N 3.41Å; S558-A560 VanDerWaalsContact C-N 3.34Å; A560-L562 VanDerWaalsContact C-N 3.32Å; A560-L562 PolarHBondContact O-N 2.89Å; A560-S563 WeakPolarHBondContact O-CB 3.38Å; A560-S563 PolarHBondContact O-N 3.17Å; A560-A564 PolarHBondContact O-N 3.24Å
561	V	98.1	Very high	97.3	Very high	33 Å²	33	36.1 Å²	36.1	20%	0.2	20%	0.2	C	C	.	.	H	α-helix	trans	-56.9	-46.7	171.9	174.7	0	0	0	0	110.7	M546 P552 Q557 S558 A564 F565 A679	M546-V561 HydrophobicContact CE-CB 4.24Å; M546-V561 HydrophobicContact CE-CG2 3.57Å; M546-V561 HydrophobicContact CG-CG2 4.17Å; M546-V561 HydrophobicContact SD-CG2 4.28Å; P552-V561 HydrophobicContact CB-CG2 4.41Å; P552-V561 HydrophobicContact CG-CG2 4.47Å; Q557-V561 WeakPolarHBondContact O-CG2 3.47Å; Q557-V561 PolarHBondContact O-N 3.27Å; S558-V561 PolarHBondContact O-N 3.28Å; V561-A564 PolarHBondContact O-N 2.96Å; V561-F565 VanDerWaalsContact O-CB 3.31Å; V561-F565 WeakPolarHBondContact O-CB 3.28Å; V561-F565 PolarHBondContact O-N 3.22Å; V561-A679 HydrophobicContact CG1-CB 4.3Å
562	L	97.9	Very high	97.4	Very high	75 Å²	75	31 Å²	31	39%	0.393	18%	0.176	S	C	.	.	H	α-helix	trans	-64.8	-41.2	-179.8	-176.8	61.9	0	0	0	111.4	S558 L559 A560 F565 I566 L716	S558-L562 PolarHBondContact O-N 3.29Å; S558-L562 VanDerWaalsContact O-N 3.14Å; L559-L562 PolarHBondContact O-N 2.98Å; A560-L562 VanDerWaalsContact C-N 3.32Å; A560-L562 PolarHBondContact O-N 2.89Å; L562-F565 HydrophobicContact CD1-CD1 4.18Å; L562-F565 PolarHBondContact O-N 3.19Å; L562-I566 HydrophobicContact CD1-CG2 4.25Å; L562-I566 WeakPolarHBondContact O-CG1 3.39Å; L562-I566 PolarHBondContact O-N 3.35Å; L562-L716 HydrophobicContact CB-CD1 4.07Å; L562-L716 HydrophobicContact CD2-CD1 3.67Å; L562-L716 HydrophobicContact CD2-CD2 4.23Å; L562-L716 HydrophobicContact CG-CD1 3.68Å
563	S	97.9	Very high	97.4	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59	-51.1	174.4	-174.8	0	0	0	0	111.2	L559 A560 F565 I566 S567 A713 T717	L559-S563 PolarHBondContact O-N 2.93Å; A560-S563 WeakPolarHBondContact O-CB 3.38Å; A560-S563 PolarHBondContact O-N 3.17Å; S563-F565 VanDerWaalsContact C-N 3.34Å; S563-F565 PolarHBondContact O-N 2.64Å; S563-I566 WeakPolarHBondContact O-CG1 3.16Å; S563-I566 PolarHBondContact O-N 3.24Å; S563-S567 WeakPolarHBondContact O-CB 3.49Å; S563-S567 PolarHBondContact O-N 2.95Å; S563-S567 PolarHBondContact O-OG 2.77Å; S563-A713 PolarHBondContact OG-O 3.45Å; S563-T717 PolarHBondContact OG-OG1 2.94Å
564	A	97.8	Very high	97.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.8	-39.5	177.9	0	0	0	0	0	112.8	M546 A560 V561 S568	M546-A564 HydrophobicContact SD-CB 3.78Å; A560-A564 PolarHBondContact O-N 3.24Å; V561-A564 PolarHBondContact O-N 2.96Å; A564-S568 WeakPolarHBondContact O-CB 3.48Å; A564-S568 PolarHBondContact O-N 3.39Å; A564-S568 VanDerWaalsContact O-N 3.07Å; A564-S568 PolarHBondContact O-OG 3.21Å
565	F	98.3	Very high	97.5	Very high	50 Å²	50	20.5 Å²	20.5	22%	0.219	12%	0.121	C	C	.	.	H	α-helix	trans	-61.4	-55.1	177.2	166.4	-104	0	0	0	112.4	V561 L562 S563 S567 S568 V569 L682 I686	V561-F565 VanDerWaalsContact O-CB 3.31Å; V561-F565 WeakPolarHBondContact O-CB 3.28Å; V561-F565 PolarHBondContact O-N 3.22Å; L562-F565 HydrophobicContact CD1-CD1 4.18Å; L562-F565 PolarHBondContact O-N 3.19Å; S563-F565 VanDerWaalsContact C-N 3.34Å; S563-F565 PolarHBondContact O-N 2.64Å; F565-S567 VanDerWaalsContact C-N 3.32Å; F565-S567 PolarHBondContact O-N 2.8Å; F565-S568 PolarHBondContact O-N 2.82Å; F565-V569 PolarHBondContact O-N 2.93Å; F565-L682 HydrophobicContact CD2-CB 4.37Å; F565-L682 HydrophobicContact CD2-CD2 4.36Å; F565-L682 HydrophobicContact CD2-CG 4.43Å; F565-L682 HydrophobicContact CE2-CB 4.17Å; F565-L682 HydrophobicContact CE2-CD2 3.87Å; F565-L682 HydrophobicContact CE2-CG 3.8Å; F565-I686 HydrophobicContact CE2-CD1 3.84Å; F565-I686 HydrophobicContact CZ-CD1 3.63Å
566	I	97.4	Very high	97.5	Very high	10 Å²	10	20.2 Å²	20.2	5%	0.051	11%	0.112	C	C	.	.	H	α-helix	trans	-69.2	-32.5	-177.9	65.3	-173.1	0	0	0	112.1	L562 S563 S568 V569 N570 L709 L712 A713 L716	L562-I566 HydrophobicContact CD1-CG2 4.25Å; L562-I566 WeakPolarHBondContact O-CG1 3.39Å; L562-I566 PolarHBondContact O-N 3.35Å; S563-I566 WeakPolarHBondContact O-CG1 3.16Å; S563-I566 PolarHBondContact O-N 3.24Å; I566-S568 VanDerWaalsContact C-N 3.3Å; I566-S568 PolarHBondContact O-N 3.42Å; I566-V569 VanDerWaalsContact O-CB 3.31Å; I566-V569 WeakPolarHBondContact O-CB 3.2Å; I566-V569 PolarHBondContact O-N 3.47Å; I566-N570 PolarHBondContact O-N 2.92Å; I566-L709 HydrophobicContact CB-CB 4.47Å; I566-L709 HydrophobicContact CB-CD2 4.39Å; I566-L709 WeakPolarHBondContact CD1-O 3.48Å; I566-L712 HydrophobicContact CD1-CB 4.07Å; I566-L712 HydrophobicContact CD1-CD2 4.05Å; I566-L712 HydrophobicContact CD1-CG 3.96Å; I566-A713 HydrophobicContact CD1-CB 3.87Å; I566-A713 HydrophobicContact CG1-CB 4.01Å; I566-L716 HydrophobicContact CD1-CD1 4.03Å
567	S	98.2	Very high	97.5	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.6	-39.1	174.6	-59.7	0	0	0	0	111.5	G536 T538 A539 S563 F565 V569 N570 I571	G536-S567 WeakPolarHBondContact O-CB 3.31Å; T538-S567 WeakPolarHBondContact CB-OG 3.19Å; T538-S567 WeakPolarHBondContact OG1-CB 3.35Å; T538-S567 PolarHBondContact OG1-OG 3.15Å; A539-S567 VanDerWaalsContact N-CB 3.29Å; A539-S567 PolarHBondContact N-OG 3.32Å; S563-S567 WeakPolarHBondContact O-CB 3.49Å; S563-S567 PolarHBondContact O-N 2.95Å; S563-S567 PolarHBondContact O-OG 2.77Å; F565-S567 VanDerWaalsContact C-N 3.32Å; F565-S567 PolarHBondContact O-N 2.8Å; S567-V569 VanDerWaalsContact C-N 3.3Å; S567-V569 PolarHBondContact O-N 3.24Å; S567-N570 WeakPolarHBondContact O-CB 3.47Å; S567-N570 PolarHBondContact O-N 3.43Å; S567-N570 VanDerWaalsContact O-N 3.12Å; S567-I571 WeakPolarHBondContact O-CG1 3.28Å; S567-I571 PolarHBondContact O-N 3.39Å
568	S	98.2	Very high	97.5	Very high	7 Å²	7	18.5 Å²	18.5	5%	0.049	10%	0.103	C	C	.	.	H	α-helix	trans	-67.6	-28.4	176.7	-58.8	0	0	0	0	113.3	A564 F565 I566 N570 A572 M680	A564-S568 WeakPolarHBondContact O-CB 3.48Å; A564-S568 PolarHBondContact O-N 3.39Å; A564-S568 VanDerWaalsContact O-N 3.07Å; A564-S568 PolarHBondContact O-OG 3.21Å; F565-S568 PolarHBondContact O-N 2.82Å; I566-S568 VanDerWaalsContact C-N 3.3Å; I566-S568 PolarHBondContact O-N 3.42Å; S568-N570 VanDerWaalsContact C-N 3.34Å; S568-A572 PolarHBondContact O-N 3.36Å; S568-M680 WeakPolarHBondContact CB-O 3.36Å; S568-M680 WeakPolarHBondContact OG-CA 3.28Å; S568-M680 WeakPolarHBondContact OG-CG 3.25Å
569	V	97.8	Very high	97.4	Very high	8 Å²	8	18.5 Å²	18.5	5%	0.048	10%	0.097	C	C	.	.	H	α-helix	trans	-60.9	-45.4	170	-179.7	0	0	0	0	110.2	F565 I566 S567 G573 G683 I686 G687 F706 L709	F565-V569 PolarHBondContact O-N 2.93Å; I566-V569 VanDerWaalsContact O-CB 3.31Å; I566-V569 WeakPolarHBondContact O-CB 3.2Å; I566-V569 PolarHBondContact O-N 3.47Å; S567-V569 VanDerWaalsContact C-N 3.3Å; S567-V569 PolarHBondContact O-N 3.24Å; V569-G573 PolarHBondContact O-N 3.16Å; V569-G683 WeakPolarHBondContact CA-O 3.5Å; V569-G683 WeakPolarHBondContact CG2-O 3.46Å; V569-I686 HydrophobicContact CG1-CG2 4.37Å; V569-I686 HydrophobicContact CG2-CB 4.41Å; V569-I686 HydrophobicContact CG2-CG2 4.37Å; V569-G687 WeakPolarHBondContact O-CA 3.46Å; V569-F706 HydrophobicContact CG1-CE1 4.45Å; V569-L709 HydrophobicContact CB-CD1 4.16Å; V569-L709 HydrophobicContact CG1-CD1 3.92Å
570	N	95.8	Very high	97.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-66.1	-44.7	179.1	-80.3	-7.8	0	0	0	112.6	I566 S567 S568 A572 G574 F706 V710	I566-N570 PolarHBondContact O-N 2.92Å; S567-N570 WeakPolarHBondContact O-CB 3.47Å; S567-N570 PolarHBondContact O-N 3.43Å; S567-N570 VanDerWaalsContact O-N 3.12Å; S568-N570 VanDerWaalsContact C-N 3.34Å; N570-A572 PolarHBondContact O-N 3.41Å; N570-G574 PolarHBondContact O-N 3.05Å; N570-F706 PolarHBondContact ND2-O 3.31Å; N570-F706 WeakPolarHBondContact OD1-CA 3.29Å; N570-F706 WeakPolarHBondContact OD1-CB 3.37Å; N570-F706 WeakPolarHBondContact OD1-CD1 3.26Å; N570-F706 WeakPolarHBondContact OD1-CG 3.38Å; N570-F706 PolarHBondContact OD1-O 2.84Å; N570-V710 WeakPolarHBondContact ND2-CG2 3.41Å
571	I	98.1	Very high	97.2	Very high	23 Å²	23	19.3 Å²	19.3	12%	0.118	10%	0.097	C	C	.	.	H	α-helix	trans	-54.7	-59	178	-66.3	175	0	0	0	110	G536 A539 S567 F575 V655 L659	G536-I571 WeakPolarHBondContact O-CD1 3.26Å; A539-I571 HydrophobicContact CB-CD1 4.33Å; S567-I571 WeakPolarHBondContact O-CG1 3.28Å; S567-I571 PolarHBondContact O-N 3.39Å; I571-F575 HydrophobicContact CG2-CD2 3.93Å; I571-F575 HydrophobicContact CG2-CE2 4Å; I571-F575 WeakPolarHBondContact O-CD2 3.46Å; I571-F575 PolarHBondContact O-N 3.39Å; I571-F575 VanDerWaalsContact O-N 3.17Å; I571-V655 HydrophobicContact CD1-CG1 3.95Å; I571-V655 HydrophobicContact CG1-CG1 4.3Å; I571-V655 HydrophobicContact CG2-CG1 4.01Å; I571-L659 HydrophobicContact CD1-CD1 4.04Å
572	A	97.7	Very high	97.1	Very high	18 Å²	18	17.8 Å²	17.8	15%	0.149	9%	0.088	C	C	.	.	H	α-helix	trans	-72	-36.6	-172	0	0	0	0	0	112.2	S568 N570 L576 G684 L688	S568-A572 PolarHBondContact O-N 3.36Å; N570-A572 PolarHBondContact O-N 3.41Å; A572-L576 WeakPolarHBondContact O-CB 3.09Å; A572-L576 PolarHBondContact O-N 3.47Å; A572-G684 WeakPolarHBondContact CB-O 3.4Å; A572-L688 HydrophobicContact CB-CD2 4.09Å; A572-L688 HydrophobicContact CB-CG 3.89Å
573	G	96	Very high	97	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-64.6	-49.6	176.1	0	0	0	0	0	112.4	V569 L576 V577 A691	V569-G573 PolarHBondContact O-N 3.16Å; G573-L576 PolarHBondContact O-N 3.35Å; G573-V577 WeakPolarHBondContact O-CG2 3.47Å; G573-V577 PolarHBondContact O-N 3.19Å; G573-V577 VanDerWaalsContact O-N 3.08Å; G573-A691 WeakPolarHBondContact O-CB 3.49Å
574	G	96	Very high	96.8	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-63.3	-45.2	-178.4	0	0	0	0	0	113.1	S529 N570 L576 V577 T578	S529-G574 PolarHBondContact OG-O 2.96Å; N570-G574 PolarHBondContact O-N 3.05Å; G574-L576 PolarHBondContact O-N 3.02Å; G574-V577 PolarHBondContact O-N 3.36Å; G574-T578 WeakPolarHBondContact O-CB 3.49Å; G574-T578 PolarHBondContact O-N 2.88Å; G574-T578 PolarHBondContact O-OG1 3.38Å
575	F	98	Very high	96.7	Very high	18 Å²	18	20.1 Å²	20.1	8%	0.079	10%	0.1	C	C	.	.	H	α-helix	trans	-65.7	-38.9	179.4	-78.5	-57.7	0	0	0	112.7	A533 I534 I571 T578 Q579 N648 G651 M652 V655	A533-F575 HydrophobicContact CB-CD1 3.84Å; A533-F575 HydrophobicContact CB-CD2 3.9Å; A533-F575 HydrophobicContact CB-CE1 3.9Å; A533-F575 HydrophobicContact CB-CE2 3.95Å; A533-F575 HydrophobicContact CB-CG 3.83Å; A533-F575 HydrophobicContact CB-CZ 3.94Å; I534-F575 HydrophobicContact CG1-CZ 4.41Å; I571-F575 HydrophobicContact CG2-CD2 3.93Å; I571-F575 HydrophobicContact CG2-CE2 4Å; I571-F575 WeakPolarHBondContact O-CD2 3.46Å; I571-F575 PolarHBondContact O-N 3.39Å; I571-F575 VanDerWaalsContact O-N 3.17Å; F575-T578 PolarHBondContact O-N 3.36Å; F575-Q579 WeakPolarHBondContact O-CB 3.33Å; F575-Q579 PolarHBondContact O-N 3.03Å; F575-N648 WeakPolarHBondContact CD1-OD1 3.41Å; F575-G651 VanDerWaalsContact CZ-C 3.4Å; F575-G651 WeakPolarHBondContact CZ-O 3.39Å; F575-M652 HydrophobicContact CB-CG 4.36Å; F575-M652 HydrophobicContact CD1-CG 3.44Å; F575-M652 VanDerWaalsContact CD1-CG 3.44Å; F575-M652 HydrophobicContact CD1-SD 4.45Å; F575-M652 HydrophobicContact CD2-CG 4.07Å; F575-M652 HydrophobicContact CE1-CB 4.41Å; F575-M652 HydrophobicContact CE1-CG 3.63Å; F575-M652 HydrophobicContact CE2-CG 4.23Å; F575-M652 HydrophobicContact CG-CG 3.7Å; F575-M652 HydrophobicContact CG-SD 4.47Å; F575-M652 HydrophobicContact CZ-CG 4.04Å; F575-V655 HydrophobicContact CE2-CB 4.09Å; F575-V655 HydrophobicContact CE2-CG1 4.37Å; F575-V655 HydrophobicContact CE2-CG2 3.87Å; F575-V655 HydrophobicContact CZ-CB 4.28Å; F575-V655 HydrophobicContact CZ-CG2 3.77Å
576	L	97.5	Very high	96.5	Very high	49 Å²	49	21.9 Å²	21.9	26%	0.257	11%	0.107	S	C	.	.	H	α-helix	trans	-68.5	-41.6	178.4	-176.5	62.4	0	0	0	112	A572 G573 G574 Q579 R580 L688 A691 K692	A572-L576 WeakPolarHBondContact O-CB 3.09Å; A572-L576 PolarHBondContact O-N 3.47Å; G573-L576 PolarHBondContact O-N 3.35Å; G574-L576 PolarHBondContact O-N 3.02Å; L576-Q579 PolarHBondContact O-N 2.99Å; L576-R580 VanDerWaalsContact O-CG 3.32Å; L576-R580 WeakPolarHBondContact O-CG 3.48Å; L576-R580 PolarHBondContact O-N 3.11Å; L576-L688 HydrophobicContact CB-CD2 4.17Å; L576-L688 HydrophobicContact CD2-CD2 4Å; L576-L688 WeakPolarHBondContact CD2-O 3.33Å; L576-A691 HydrophobicContact CB-CB 3.95Å; L576-A691 HydrophobicContact CD2-CB 3.84Å; L576-A691 HydrophobicContact CG-CB 4.15Å; L576-K692 HydrophobicContact CD2-CB 4Å
577	V	95.8	Very high	96.3	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.012	12%	0.117	C	C	.	.	H	α-helix	trans	-64.9	-42.3	176.2	172.2	0	0	0	0	111	G573 G574 Q579 R580 M581 A691 I694 L699 L702	G573-V577 WeakPolarHBondContact O-CG2 3.47Å; G573-V577 PolarHBondContact O-N 3.19Å; G573-V577 VanDerWaalsContact O-N 3.08Å; G574-V577 PolarHBondContact O-N 3.36Å; V577-Q579 PolarHBondContact O-N 3.31Å; V577-R580 PolarHBondContact O-N 2.92Å; V577-M581 HydrophobicContact CG1-CE 3.94Å; V577-M581 HydrophobicContact CG1-SD 4.42Å; V577-M581 WeakPolarHBondContact O-CG 3.2Å; V577-M581 PolarHBondContact O-N 2.85Å; V577-A691 HydrophobicContact CG2-CB 3.62Å; V577-I694 HydrophobicContact CG2-CD1 4.06Å; V577-L699 HydrophobicContact CG1-CD1 3.38Å; V577-L702 HydrophobicContact CG2-CD2 3.84Å
578	T	96.6	Very high	95.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-56.7	-52	174.6	-56.4	0	0	0	0	110.9	S529 V530 G574 F575 R580 M581 L582 N648	S529-T578 WeakPolarHBondContact CB-OG1 3.06Å; S529-T578 PolarHBondContact OG-N 3.15Å; S529-T578 PolarHBondContact OG-OG1 2.82Å; V530-T578 HydrophobicContact CG2-CG2 3.36Å; G574-T578 WeakPolarHBondContact O-CB 3.49Å; G574-T578 PolarHBondContact O-N 2.88Å; G574-T578 PolarHBondContact O-OG1 3.38Å; F575-T578 PolarHBondContact O-N 3.36Å; T578-R580 VanDerWaalsContact C-N 3.34Å; T578-R580 PolarHBondContact O-N 2.87Å; T578-M581 PolarHBondContact O-N 2.89Å; T578-L582 HydrophobicContact CG2-CD1 3.85Å; T578-L582 HydrophobicContact CG2-CG 4.25Å; T578-L582 WeakPolarHBondContact O-CG 3.17Å; T578-L582 PolarHBondContact O-N 2.91Å; T578-N648 HydrophobicContact CG2-CB 4.2Å; T578-N648 WeakPolarHBondContact CG2-OD1 3.47Å
579	Q	97	Very high	95.7	Very high	51 Å²	51	36.7 Å²	36.7	24%	0.238	19%	0.193	C	C	.	.	H	α-helix	trans	-57.1	-47.9	180	-173.4	61.2	42.4	0	0	111.3	F575 L576 V577 M581 L582 D583 N648	F575-Q579 WeakPolarHBondContact O-CB 3.33Å; F575-Q579 PolarHBondContact O-N 3.03Å; L576-Q579 PolarHBondContact O-N 2.99Å; V577-Q579 PolarHBondContact O-N 3.31Å; Q579-M581 VanDerWaalsContact C-N 3.32Å; Q579-M581 PolarHBondContact O-N 3.42Å; Q579-L582 PolarHBondContact O-N 3.46Å; Q579-D583 VanDerWaalsContact NE2-CG 3.28Å; Q579-D583 PolarHBondContact NE2-OD1 3.12Å; Q579-D583 PolarHBondContact NE2-OD2 3.03Å; Q579-D583 WeakPolarHBondContact O-CB 3.49Å; Q579-D583 PolarHBondContact O-N 3.09Å; Q579-N648 PolarHBondContact OE1-ND2 3.4Å
580	R	96	Very high	95.5	Very high	62 Å²	62	37.8 Å²	37.8	23%	0.234	20%	0.199	C	C	.	.	H	α-helix	trans	-57.6	-42.1	179	-74.5	178.5	65.6	-160.1	-4.2	112.8	L576 V577 T578 M584 A691 I694	L576-R580 VanDerWaalsContact O-CG 3.32Å; L576-R580 WeakPolarHBondContact O-CG 3.48Å; L576-R580 PolarHBondContact O-N 3.11Å; V577-R580 PolarHBondContact O-N 2.92Å; T578-R580 VanDerWaalsContact C-N 3.34Å; T578-R580 PolarHBondContact O-N 2.87Å; R580-M584 WeakPolarHBondContact O-CG 3.45Å; R580-M584 PolarHBondContact O-N 2.88Å; R580-A691 PolarHBondContact NH1-O 3.07Å; R580-I694 PolarHBondContact NH1-O 2.88Å; R580-I694 PolarHBondContact NH2-O 3.17Å; R580-I694 VanDerWaalsContact NH2-O 3.13Å
581	M	95.3	Very high	95.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-70.7	-43.6	179.1	-69.2	-175.1	-64.3	0	0	112.1	P526 V577 T578 Q579 D583 M584 F585 I696 L699 V975	P526-M581 HydrophobicContact CB-CE 4.41Å; P526-M581 HydrophobicContact CG-CB 4.33Å; P526-M581 HydrophobicContact CG-CE 4.37Å; V577-M581 HydrophobicContact CG1-CE 3.94Å; V577-M581 HydrophobicContact CG1-SD 4.42Å; V577-M581 WeakPolarHBondContact O-CG 3.2Å; V577-M581 PolarHBondContact O-N 2.85Å; T578-M581 PolarHBondContact O-N 2.89Å; Q579-M581 VanDerWaalsContact C-N 3.32Å; Q579-M581 PolarHBondContact O-N 3.42Å; M581-D583 VanDerWaalsContact C-N 3.27Å; M581-D583 PolarHBondContact O-N 3.03Å; M581-M584 WeakPolarHBondContact O-CB 3.08Å; M581-M584 PolarHBondContact O-N 3.14Å; M581-M584 VanDerWaalsContact O-N 3.15Å; M581-F585 VanDerWaalsContact O-CD2 3.29Å; M581-F585 WeakPolarHBondContact O-CD2 3.31Å; M581-I696 HydrophobicContact CG-CD1 4.24Å; M581-L699 HydrophobicContact CE-CD2 4.32Å; M581-L699 HydrophobicContact SD-CD2 3.31Å; M581-L699 WeakPolarHBondContact SD-CD2 3.2Å; M581-V975 HydrophobicContact CB-CG1 4.22Å; M581-V975 HydrophobicContact CG-CG1 3.96Å; M581-V975 HydrophobicContact SD-CG1 4.3Å
582	L	96	Very high	95.3	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.3	-34.9	179.6	-67.5	-178.5	0	0	0	111.9	L523 P526 T578 Q579 M584 F585 L638 A644 R645 N648	L523-L582 HydrophobicContact CD2-CD2 4.21Å; P526-L582 HydrophobicContact CB-CD2 3.81Å; P526-L582 HydrophobicContact CG-CD2 4.01Å; T578-L582 HydrophobicContact CG2-CD1 3.85Å; T578-L582 HydrophobicContact CG2-CG 4.25Å; T578-L582 WeakPolarHBondContact O-CG 3.17Å; T578-L582 PolarHBondContact O-N 2.91Å; Q579-L582 PolarHBondContact O-N 3.46Å; L582-M584 VanDerWaalsContact C-N 3.25Å; L582-M584 PolarHBondContact O-N 3.4Å; L582-F585 PolarHBondContact O-N 3.02Å; L582-L638 HydrophobicContact CD1-CD2 4.46Å; L582-L638 HydrophobicContact CD2-CD2 4.22Å; L582-A644 HydrophobicContact CD1-CB 4.42Å; L582-A644 WeakPolarHBondContact CD1-O 3.41Å; L582-A644 HydrophobicContact CD2-CB 3.76Å; L582-R645 HydrophobicContact CB-CG 4.36Å; L582-N648 HydrophobicContact CD1-CB 3.93Å
583	D	95.9	Very high	95.2	Very high	69 Å²	69	47.9 Å²	47.9	37%	0.369	26%	0.26	S	S	.	.	H	α-helix	trans	-67.7	-24.1	176.4	-69.4	-23.1	0	0	0	112.8	Q579 M581 F585 K586	Q579-D583 VanDerWaalsContact NE2-CG 3.28Å; Q579-D583 PolarHBondContact NE2-OD1 3.12Å; Q579-D583 PolarHBondContact NE2-OD2 3.03Å; Q579-D583 WeakPolarHBondContact O-CB 3.49Å; Q579-D583 PolarHBondContact O-N 3.09Å; M581-D583 VanDerWaalsContact C-N 3.27Å; M581-D583 PolarHBondContact O-N 3.03Å; D583-F585 VanDerWaalsContact C-N 3.3Å; D583-F585 PolarHBondContact O-N 3.43Å; D583-K586 WeakPolarHBondContact O-CB 3.44Å; D583-K586 PolarHBondContact O-N 2.97Å
584	M	94.2	Very high	95.3	Very high	47 Å²	47	54.3 Å²	54.3	23%	0.232	29%	0.285	C	S	.	.	H	α-helix	trans	-71.1	-25.3	175.5	-68.2	162.9	-178.8	0	0	112.8	R580 M581 L582 K586 I696 V975 A978 E979	R580-M584 WeakPolarHBondContact O-CG 3.45Å; R580-M584 PolarHBondContact O-N 2.88Å; M581-M584 WeakPolarHBondContact O-CB 3.08Å; M581-M584 PolarHBondContact O-N 3.14Å; M581-M584 VanDerWaalsContact O-N 3.15Å; L582-M584 VanDerWaalsContact C-N 3.25Å; L582-M584 PolarHBondContact O-N 3.4Å; M584-K586 VanDerWaalsContact C-N 3.27Å; M584-I696 HydrophobicContact CE-CD1 3.82Å; M584-I696 HydrophobicContact CE-CG1 3.45Å; M584-I696 VanDerWaalsContact CE-CG1 3.45Å; M584-I696 HydrophobicContact SD-CD1 4.3Å; M584-I696 HydrophobicContact SD-CG1 3.87Å; M584-V975 HydrophobicContact SD-CG1 4.3Å; M584-A978 HydrophobicContact CB-CB 4.27Å; M584-E979 HydrophobicContact CE-CG 4.37Å; M584-E979 HydrophobicContact SD-CB 3.99Å; M584-E979 HydrophobicContact SD-CG 4.32Å
585	F	94.4	Very high	95.3	Very high	9 Å²	9	56.9 Å²	56.9	4%	0.039	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-8.3	177.5	-73.3	-74.7	0	0	0	113.6	L523 P526 M581 L582 D583 R587 Q641 N974 V975 A978	L523-F585 HydrophobicContact CD2-CD2 4.11Å; L523-F585 HydrophobicContact CD2-CE2 3.87Å; L523-F585 HydrophobicContact CD2-CZ 4.26Å; P526-F585 HydrophobicContact CG-CE2 4.27Å; M581-F585 VanDerWaalsContact O-CD2 3.29Å; M581-F585 WeakPolarHBondContact O-CD2 3.31Å; L582-F585 PolarHBondContact O-N 3.02Å; D583-F585 VanDerWaalsContact C-N 3.3Å; D583-F585 PolarHBondContact O-N 3.43Å; F585-R587 PolarHBondContact O-N 3.46Å; F585-Q641 VanDerWaalsContact CB-NE2 3.26Å; F585-N974 HydrophobicContact CZ-CB 4.42Å; F585-V975 HydrophobicContact CE2-CG2 4.03Å; F585-V975 HydrophobicContact CZ-CB 4.46Å; F585-V975 HydrophobicContact CZ-CG2 3.95Å; F585-A978 HydrophobicContact CD1-CB 3.57Å; F585-A978 HydrophobicContact CE1-CB 3.63Å; F585-A978 HydrophobicContact CG-CB 4.08Å; F585-A978 HydrophobicContact CZ-CB 4.17Å
586	K	94.2	Very high	95.3	Very high	86 Å²	86	62.9 Å²	62.9	37%	0.374	32%	0.322	S	S	.	.			trans	-69.7	122.9	178.2	-176.5	176.9	-178.7	162.6	0	110.1	D583 M584 E593	D583-K586 WeakPolarHBondContact O-CB 3.44Å; D583-K586 PolarHBondContact O-N 2.97Å; M584-K586 VanDerWaalsContact C-N 3.27Å; K586-E593 WeakPolarHBondContact CD-OE1 3.33Å; K586-E593 WeakPolarHBondContact CE-OE1 3.43Å; K586-E593 IonicContact NZ-OE1 3.14Å; K586-E593 PolarHBondContact NZ-OE1 3.44Å
587	R	92.9	Very high	95.3	Very high	67 Å²	67	65.5 Å²	65.5	25%	0.253	34%	0.336	S	S	.	.			trans	-78.6	146.1	176.1	-60.5	177	-63.5	-171.3	-0.8	109.8	F585 T589 D590 Y984 D985	F585-R587 PolarHBondContact O-N 3.46Å; R587-T589 PolarHBondContact O-N 3.41Å; R587-T589 VanDerWaalsContact O-N 3.09Å; R587-D590 WeakPolarHBondContact CB-OD2 3.27Å; R587-D590 IonicContact CZ-OD1 2.85Å; R587-D590 VanDerWaalsContact CZ-OD1 3.23Å; R587-D590 PolarHBondContact N-OD2 3.5Å; R587-D590 IonicContact NE-OD1 2.63Å; R587-D590 PolarHBondContact NE-OD1 3.44Å; R587-D590 IonicContact NE-OD2 2.73Å; R587-D590 IonicContact NH2-OD1 2.78Å; R587-D590 PolarHBondContact NH2-OD1 3.03Å; R587-D590 PolarHBondContact O-N 2.87Å; R587-D590 VanDerWaalsContact O-N 3.1Å; R587-Y984 HydrophobicContact CG-CD1 4.25Å; R587-Y984 HydrophobicContact CG-CE1 3.98Å; R587-Y984 PolarHBondContact NH2-OH 3.43Å; R587-D985 IonicContact NH1-OD2 3.64Å
588	P	91.7	Very high	95.4	Very high	142 Å²	142	69.6 Å²	69.6	92%	0.922	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-21.2	172	-24.5	34.3	0	0	0	113.8
589	T	93.1	Very high	95.4	Very high	120 Å²	120	75.9 Å²	75.9	74%	0.736	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-3.7	-179.3	55.5	0	0	0	0	113.9	R587	R587-T589 PolarHBondContact O-N 3.41Å; R587-T589 VanDerWaalsContact O-N 3.09Å
590	D	92.6	Very high	95.5	Very high	30 Å²	30	79.7 Å²	79.7	16%	0.16	41%	0.406	C	S	.	.	S	Bend	trans	-68.9	148.1	177.2	-72.6	-28.4	0	0	0	110.8	R587	R587-D590 WeakPolarHBondContact CB-OD2 3.27Å; R587-D590 IonicContact CZ-OD1 2.85Å; R587-D590 VanDerWaalsContact CZ-OD1 3.23Å; R587-D590 PolarHBondContact N-OD2 3.5Å; R587-D590 IonicContact NE-OD1 2.63Å; R587-D590 PolarHBondContact NE-OD1 3.44Å; R587-D590 IonicContact NE-OD2 2.73Å; R587-D590 IonicContact NH2-OD1 2.78Å; R587-D590 PolarHBondContact NH2-OD1 3.03Å; R587-D590 PolarHBondContact O-N 2.87Å; R587-D590 VanDerWaalsContact O-N 3.1Å
591	P	95.2	Very high	95.5	Very high	105 Å²	105	79.7 Å²	79.7	68%	0.682	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-57.1	151	174.3	-24.6	34.3	0	0	0	112.7	E593	P591-E593 PolarHBondContact O-N 3.46Å
592	P	95.9	Very high	95.6	Very high	99 Å²	99	80.4 Å²	80.4	64%	0.643	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-56.5	131.2	171.3	-23.3	33.5	0	0	0	111.3
593	E	95.1	Very high	95.6	Very high	49 Å²	49	82.6 Å²	82.6	23%	0.229	44%	0.444	C	S	.	.			trans	-107	147.1	177.2	72.5	-162.3	147.2	0	0	110.4	K586 P591 R645	K586-E593 WeakPolarHBondContact CD-OE1 3.33Å; K586-E593 WeakPolarHBondContact CE-OE1 3.43Å; K586-E593 IonicContact NZ-OE1 3.14Å; K586-E593 PolarHBondContact NZ-OE1 3.44Å; P591-E593 PolarHBondContact O-N 3.46Å; E593-R645 IonicContact OE2-CZ 3.56Å; E593-R645 VanDerWaalsContact OE2-CZ 3.26Å; E593-R645 IonicContact OE2-NE 3.66Å; E593-R645 PolarHBondContact OE2-NE 3.36Å; E593-R645 IonicContact OE2-NH2 2.82Å; E593-R645 PolarHBondContact OE2-NH2 3.47Å
594	Y	97.3	Very high	95.7	Very high	135 Å²	135	84 Å²	84	53%	0.529	46%	0.455	S	S	.	.			trans	-117	57.6	-173.1	-58.1	-75.3	0	0	0	111.4	Y596 L597	Y594-Y596 AromaticContact CD1-CE1 3.74Å; Y594-Y596 HydrophobicContact CD1-CE1 3.74Å; Y594-Y596 AromaticContact CD1-CZ 3.85Å; Y594-Y596 VanDerWaalsContact CD1-OH 3.32Å; Y594-Y596 WeakPolarHBondContact CD1-OH 3.36Å; Y594-Y596 HydrophobicContact CG-CE1 4.34Å; Y594-Y596 PolarHBondContact O-N 3.29Å; Y594-L597 WeakPolarHBondContact O-CB 3.29Å; Y594-L597 WeakPolarHBondContact O-CG 3.35Å; Y594-L597 PolarHBondContact O-N 2.86Å
595	N	96.6	Very high	95.9	Very high	54 Å²	54	83.9 Å²	83.9	29%	0.289	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-58.2	-23.9	-173.2	-70.8	-31.3	0	0	0	114.4	L597 Y598	N595-L597 PolarHBondContact O-N 2.96Å; N595-Y598 HydrophobicContact CB-CD2 4.48Å; N595-Y598 WeakPolarHBondContact O-CB 3.17Å; N595-Y598 WeakPolarHBondContact O-CD2 3.42Å; N595-Y598 PolarHBondContact O-N 3.46Å; N595-Y598 VanDerWaalsContact O-N 3.11Å
596	Y	97.1	Very high	96	Very high	145 Å²	145	85.8 Å²	85.8	57%	0.569	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-62	-21	174.9	61.9	-99.4	0	0	0	113.2	Y594 Y598 L599	Y594-Y596 AromaticContact CD1-CE1 3.74Å; Y594-Y596 HydrophobicContact CD1-CE1 3.74Å; Y594-Y596 AromaticContact CD1-CZ 3.85Å; Y594-Y596 VanDerWaalsContact CD1-OH 3.32Å; Y594-Y596 WeakPolarHBondContact CD1-OH 3.36Å; Y594-Y596 HydrophobicContact CG-CE1 4.34Å; Y594-Y596 PolarHBondContact O-N 3.29Å; Y596-Y598 PolarHBondContact O-N 2.9Å; Y596-L599 WeakPolarHBondContact O-CB 3.26Å; Y596-L599 VanDerWaalsContact O-CG 3.29Å; Y596-L599 WeakPolarHBondContact O-CG 3.27Å; Y596-L599 PolarHBondContact O-N 2.94Å
597	L	98.1	Very high	96.1	Very high	104 Å²	104	83.6 Å²	83.6	55%	0.545	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-64.4	-23.8	175.5	-66	177.2	0	0	0	112.3	Y594 N595 L599 L600	Y594-L597 WeakPolarHBondContact O-CB 3.29Å; Y594-L597 WeakPolarHBondContact O-CG 3.35Å; Y594-L597 PolarHBondContact O-N 2.86Å; N595-L597 PolarHBondContact O-N 2.96Å; L597-L599 PolarHBondContact O-N 3.28Å; L597-L600 VanDerWaalsContact O-CB 3.22Å; L597-L600 WeakPolarHBondContact O-CB 3.28Å; L597-L600 PolarHBondContact O-N 3.21Å
598	Y	97.8	Very high	96.3	Very high	87 Å²	87	82.2 Å²	82.2	34%	0.341	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-70.2	-7.6	173.4	-61.1	-59.7	0	0	0	113.4	N595 Y596 L600 P601 G602 L646 A649	N595-Y598 HydrophobicContact CB-CD2 4.48Å; N595-Y598 WeakPolarHBondContact O-CB 3.17Å; N595-Y598 WeakPolarHBondContact O-CD2 3.42Å; N595-Y598 PolarHBondContact O-N 3.46Å; N595-Y598 VanDerWaalsContact O-N 3.11Å; Y596-Y598 PolarHBondContact O-N 2.9Å; Y598-L600 PolarHBondContact O-N 3.47Å; Y598-P601 VanDerWaalsContact O-CD 3.3Å; Y598-P601 WeakPolarHBondContact O-CD 3.43Å; Y598-P601 WeakPolarHBondContact O-CG 3.38Å; Y598-G602 PolarHBondContact O-N 3.46Å; Y598-L646 HydrophobicContact CD1-CD1 3.98Å; Y598-L646 HydrophobicContact CE1-CD1 3.49Å; Y598-L646 VanDerWaalsContact CE1-CD1 3.49Å; Y598-L646 HydrophobicContact CE2-CD1 4.41Å; Y598-A649 HydrophobicContact CD2-CB 4.15Å; Y598-A649 HydrophobicContact CG-CB 4.18Å
599	L	97.3	Very high	96.5	Very high	133 Å²	133	75.9 Å²	75.9	70%	0.696	43%	0.431	S	S	*	.	H	α-helix	trans	-66.6	-24.4	165.5	-64.4	174	0	0	0	112.2	Y596 L597 G603	Y596-L599 WeakPolarHBondContact O-CB 3.26Å; Y596-L599 VanDerWaalsContact O-CG 3.29Å; Y596-L599 WeakPolarHBondContact O-CG 3.27Å; Y596-L599 PolarHBondContact O-N 2.94Å; L597-L599 PolarHBondContact O-N 3.28Å; L599-G603 PolarHBondContact O-N 2.95Å
600	L	97.9	Very high	96.6	Very high	130 Å²	130	72.8 Å²	72.8	68%	0.681	42%	0.418	S	S	*	.	H	α-helix	trans	-60.2	-58.8	177.3	-179.1	73.9	0	0	0	111.8	L597 Y598 G602 G603 V604	L597-L600 VanDerWaalsContact O-CB 3.22Å; L597-L600 WeakPolarHBondContact O-CB 3.28Å; L597-L600 PolarHBondContact O-N 3.21Å; Y598-L600 PolarHBondContact O-N 3.47Å; L600-G602 VanDerWaalsContact C-N 3.34Å; L600-G602 PolarHBondContact O-N 2.93Å; L600-G603 PolarHBondContact O-N 2.97Å; L600-V604 WeakPolarHBondContact O-CG2 3.38Å; L600-V604 PolarHBondContact O-N 3.25Å
601	P	97.6	Very high	96.8	Very high	63 Å²	63	74.2 Å²	74.2	41%	0.409	43%	0.434	S	S	.	.	H	α-helix	trans	-63.5	-38.1	176.8	24.1	-33.8	0	0	0	112.4	Y598 V604 F605 I653	Y598-P601 VanDerWaalsContact O-CD 3.3Å; Y598-P601 WeakPolarHBondContact O-CD 3.43Å; Y598-P601 WeakPolarHBondContact O-CG 3.38Å; P601-V604 PolarHBondContact O-N 3.28Å; P601-F605 WeakPolarHBondContact O-CB 3.31Å; P601-F605 PolarHBondContact O-N 2.93Å; P601-I653 HydrophobicContact CG-CD1 4.22Å
602	G	96.3	Very high	96.9	Very high	15 Å²	15	70.1 Å²	70.1	16%	0.155	41%	0.409	C	S	.	.	H	α-helix	trans	-62.3	-44.7	177.4	0	0	0	0	0	113.3	Y598 L600 F605 V606	Y598-G602 PolarHBondContact O-N 3.46Å; L600-G602 VanDerWaalsContact C-N 3.34Å; L600-G602 PolarHBondContact O-N 2.93Å; G602-F605 PolarHBondContact O-N 3.24Å; G602-V606 PolarHBondContact O-N 3.46Å; G602-V606 VanDerWaalsContact O-N 3.08Å
603	G	96.8	Very high	96.8	Very high	46 Å²	46	67.7 Å²	67.7	47%	0.474	39%	0.391	S	S	.	.	H	α-helix	trans	-67.1	-42.2	177.6	0	0	0	0	0	112.7	L599 L600 G607	L599-G603 PolarHBondContact O-N 2.95Å; L600-G603 PolarHBondContact O-N 2.97Å; G603-G607 VanDerWaalsContact O-CA 3.27Å; G603-G607 WeakPolarHBondContact O-CA 3.44Å; G603-G607 PolarHBondContact O-N 3.07Å
604	V	97.9	Very high	96.8	Very high	99 Å²	99	70.4 Å²	70.4	60%	0.6	42%	0.415	S	S	*	.	H	α-helix	trans	-64.7	-40.8	174.4	171.4	0	0	0	0	111.2	L600 P601 G608	L600-V604 WeakPolarHBondContact O-CG2 3.38Å; L600-V604 PolarHBondContact O-N 3.25Å; P601-V604 PolarHBondContact O-N 3.28Å; V604-G608 VanDerWaalsContact O-CA 3.25Å; V604-G608 WeakPolarHBondContact O-CA 3.38Å; V604-G608 PolarHBondContact O-N 3.45Å
605	F	97.9	Very high	96.6	Very high	44 Å²	44	66.3 Å²	66.3	19%	0.193	41%	0.414	C	S	.	.	H	α-helix	trans	-66.3	-54.7	-177.7	-178.2	-134.3	0	0	0	112.2	P601 G602 Y609 M623 A626 I653	P601-F605 WeakPolarHBondContact O-CB 3.31Å; P601-F605 PolarHBondContact O-N 2.93Å; G602-F605 PolarHBondContact O-N 3.24Å; F605-Y609 PolarHBondContact O-N 3.11Å; F605-Y609 VanDerWaalsContact O-N 3.13Å; F605-M623 HydrophobicContact CD1-CE 4.37Å; F605-M623 HydrophobicContact CD2-CE 4Å; F605-M623 HydrophobicContact CD2-SD 4.01Å; F605-M623 HydrophobicContact CE1-CE 3.96Å; F605-M623 HydrophobicContact CE2-CE 3.51Å; F605-M623 HydrophobicContact CE2-SD 3.38Å; F605-M623 WeakPolarHBondContact CE2-SD 3.35Å; F605-M623 HydrophobicContact CG-CE 4.4Å; F605-M623 HydrophobicContact CZ-CE 3.48Å; F605-M623 VanDerWaalsContact CZ-CE 3.48Å; F605-M623 HydrophobicContact CZ-SD 3.86Å; F605-A626 HydrophobicContact CE2-CB 3.51Å; F605-A626 HydrophobicContact CZ-CB 3.5Å; F605-I653 HydrophobicContact CD1-CG2 3.75Å; F605-I653 HydrophobicContact CE1-CG2 4.35Å
606	V	96.4	Very high	96.5	Very high	48 Å²	48	66.5 Å²	66.5	29%	0.291	43%	0.429	S	S	.	.	H	α-helix	trans	-75.6	-39.7	-179.3	179.4	0	0	0	0	111.8	G602 Y609 A610 A656 A660	G602-V606 PolarHBondContact O-N 3.46Å; G602-V606 VanDerWaalsContact O-N 3.08Å; V606-Y609 WeakPolarHBondContact O-CB 3.46Å; V606-Y609 PolarHBondContact O-N 2.73Å; V606-A610 PolarHBondContact O-N 2.77Å; V606-A656 HydrophobicContact CG2-CB 4.45Å; V606-A660 HydrophobicContact CG1-CB 3.96Å
607	G	96	Very high	96.5	Very high	41 Å²	41	67.1 Å²	67.1	42%	0.423	43%	0.431	S	S	.	.	H	α-helix	trans	-67.8	-38.9	177.2	0	0	0	0	0	112.6	G603 Y609 A610 A611	G603-G607 VanDerWaalsContact O-CA 3.27Å; G603-G607 WeakPolarHBondContact O-CA 3.44Å; G603-G607 PolarHBondContact O-N 3.07Å; G607-Y609 VanDerWaalsContact C-N 3.34Å; G607-A610 PolarHBondContact O-N 3.01Å; G607-A611 PolarHBondContact O-N 3.03Å
608	G	96.8	Very high	96.3	Very high	37 Å²	37	67.2 Å²	67.2	38%	0.381	43%	0.432	S	S	.	.	H	α-helix	trans	-63.2	-39.5	172.8	0	0	0	0	0	112.1	V604 A611 A612	V604-G608 VanDerWaalsContact O-CA 3.25Å; V604-G608 WeakPolarHBondContact O-CA 3.38Å; V604-G608 PolarHBondContact O-N 3.45Å; G608-A611 PolarHBondContact O-N 3.47Å; G608-A612 WeakPolarHBondContact O-CB 3.49Å; G608-A612 PolarHBondContact O-N 3.36Å
609	Y	97.5	Very high	96.3	Very high	9 Å²	9	65.9 Å²	65.9	4%	0.035	43%	0.43	C	S	.	.	H	α-helix	trans	-60.7	-47.6	171.2	175.8	-108.9	0	0	0	112.3	F605 V606 G607 A611 A612 L613 I619 E620 M623 A660 A661	F605-Y609 PolarHBondContact O-N 3.11Å; F605-Y609 VanDerWaalsContact O-N 3.13Å; V606-Y609 WeakPolarHBondContact O-CB 3.46Å; V606-Y609 PolarHBondContact O-N 2.73Å; G607-Y609 VanDerWaalsContact C-N 3.34Å; Y609-A611 VanDerWaalsContact C-N 3.29Å; Y609-A611 PolarHBondContact O-N 2.95Å; Y609-A612 PolarHBondContact O-N 3.36Å; Y609-A612 VanDerWaalsContact O-N 3.16Å; Y609-L613 HydrophobicContact CE1-CD2 4.37Å; Y609-L613 WeakPolarHBondContact O-CB 3.32Å; Y609-L613 PolarHBondContact O-N 3.34Å; Y609-I619 HydrophobicContact CD2-CD1 3.88Å; Y609-I619 HydrophobicContact CD2-CG1 3.62Å; Y609-I619 HydrophobicContact CE2-CG1 3.83Å; Y609-E620 PolarHBondContact OH-OE1 2.87Å; Y609-M623 HydrophobicContact CD1-CE 4.49Å; Y609-M623 HydrophobicContact CD2-CE 4.21Å; Y609-M623 HydrophobicContact CD2-CG 3.47Å; Y609-M623 VanDerWaalsContact CD2-CG 3.47Å; Y609-M623 HydrophobicContact CD2-SD 3.85Å; Y609-M623 HydrophobicContact CE2-CG 3.88Å; Y609-M623 HydrophobicContact CG-CE 3.86Å; Y609-M623 HydrophobicContact CG-CG 4.11Å; Y609-M623 HydrophobicContact CG-SD 4.02Å; Y609-A660 HydrophobicContact CD1-CB 4.37Å; Y609-A660 VanDerWaalsContact CE1-O 3.26Å; Y609-A660 WeakPolarHBondContact CE1-O 3.42Å; Y609-A661 PolarHBondContact OH-O 3.22Å; Y609-A661 VanDerWaalsContact OH-O 3.12Å
610	A	95.5	Very high	96.2	Very high	55 Å²	55	61 Å²	61	46%	0.455	40%	0.404	S	S	.	.	H	α-helix	trans	-60.8	-38	177.7	0	0	0	0	0	112.5	V606 G607 S614	V606-A610 PolarHBondContact O-N 2.77Å; G607-A610 PolarHBondContact O-N 3.01Å; A610-S614 WeakPolarHBondContact O-CB 3.48Å; A610-S614 PolarHBondContact O-N 3.1Å; A610-S614 PolarHBondContact O-OG 2.98Å
611	A	96.8	Very high	96.2	Very high	60 Å²	60	60 Å²	60	50%	0.496	40%	0.396	S	S	.	.	H	α-helix	trans	-68.1	-39	174.4	0	0	0	0	0	112.7	G607 G608 Y609 S614 G615	G607-A611 PolarHBondContact O-N 3.03Å; G608-A611 PolarHBondContact O-N 3.47Å; Y609-A611 VanDerWaalsContact C-N 3.29Å; Y609-A611 PolarHBondContact O-N 2.95Å; A611-S614 PolarHBondContact O-OG 2.69Å; A611-G615 PolarHBondContact O-N 3.08Å
612	A	96.3	Very high	96.2	Very high	20 Å²	20	62.9 Å²	62.9	17%	0.165	41%	0.405	C	S	.	.	H	α-helix	trans	-66.1	-43.6	174.9	0	0	0	0	0	111.4	G608 Y609 S614 G615 G616 Y617 I619	G608-A612 WeakPolarHBondContact O-CB 3.49Å; G608-A612 PolarHBondContact O-N 3.36Å; Y609-A612 PolarHBondContact O-N 3.36Å; Y609-A612 VanDerWaalsContact O-N 3.16Å; A612-S614 PolarHBondContact O-N 2.88Å; A612-G615 CarbonylContact O-C 3.43Å; A612-G615 WeakPolarHBondContact O-CA 3.37Å; A612-G615 PolarHBondContact O-N 2.95Å; A612-G615 VanDerWaalsContact O-N 3.12Å; A612-G616 PolarHBondContact O-N 2.88Å; A612-Y617 WeakPolarHBondContact O-CB 3.36Å; A612-Y617 WeakPolarHBondContact O-CD2 3.47Å; A612-Y617 PolarHBondContact O-N 3.27Å; A612-I619 HydrophobicContact CB-CD1 3.73Å; A612-I619 HydrophobicContact CB-CG1 4.42Å
613	L	94.5	Very high	96.2	Very high	48 Å²	48	62.5 Å²	62.5	25%	0.251	40%	0.4	S	S	.	.	H	α-helix	trans	-62.1	-43.5	177.6	-175.3	65.9	0	0	0	111.4	Y609 G615 G616	Y609-L613 HydrophobicContact CE1-CD2 4.37Å; Y609-L613 WeakPolarHBondContact O-CB 3.32Å; Y609-L613 PolarHBondContact O-N 3.34Å; L613-G615 VanDerWaalsContact C-N 3.27Å; L613-G615 PolarHBondContact O-N 3.38Å; L613-G616 PolarHBondContact O-N 3Å; L613-G616 VanDerWaalsContact O-N 3.07Å
614	S	93.7	Very high	96.3	Very high	106 Å²	106	61.3 Å²	61.3	74%	0.741	38%	0.381	S	S	*	.	H	α-helix	trans	-68.4	-27.6	174.9	69.3	0	0	0	0	112.9	A610 A611 A612 G616	A610-S614 WeakPolarHBondContact O-CB 3.48Å; A610-S614 PolarHBondContact O-N 3.1Å; A610-S614 PolarHBondContact O-OG 2.98Å; A611-S614 PolarHBondContact O-OG 2.69Å; A612-S614 PolarHBondContact O-N 2.88Å; S614-G616 PolarHBondContact O-N 3.17Å
615	G	94.8	Very high	96.3	Very high	49 Å²	49	61.1 Å²	61.1	51%	0.505	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-0.5	169.6	0	0	0	0	0	114.9	A611 A612 L613	A611-G615 PolarHBondContact O-N 3.08Å; A612-G615 CarbonylContact O-C 3.43Å; A612-G615 WeakPolarHBondContact O-CA 3.37Å; A612-G615 PolarHBondContact O-N 2.95Å; A612-G615 VanDerWaalsContact O-N 3.12Å; L613-G615 VanDerWaalsContact C-N 3.27Å; L613-G615 PolarHBondContact O-N 3.38Å
616	G	93.6	Very high	96.3	Very high	58 Å²	58	60.5 Å²	60.5	60%	0.598	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	10.7	177.8	0	0	0	0	0	115.3	A612 L613 S614	A612-G616 PolarHBondContact O-N 2.88Å; L613-G616 PolarHBondContact O-N 3Å; L613-G616 VanDerWaalsContact O-N 3.07Å; S614-G616 PolarHBondContact O-N 3.17Å
617	Y	96.6	Very high	96.4	Very high	157 Å²	157	58.2 Å²	58.2	62%	0.616	37%	0.365	S	S	*	.			trans	-85.1	145.2	175.2	-61.6	-84.7	0	0	0	111.3	A612	A612-Y617 WeakPolarHBondContact O-CB 3.36Å; A612-Y617 WeakPolarHBondContact O-CD2 3.47Å; A612-Y617 PolarHBondContact O-N 3.27Å
618	N	95.1	Very high	96.5	Very high	107 Å²	107	56.4 Å²	56.4	57%	0.572	35%	0.346	S	S	*	.			trans	-113.1	111.3	171.4	-52.5	-60.1	0	0	0	107.8	E620	N618-E620 VanDerWaalsContact C-OE2 3.29Å; N618-E620 WeakPolarHBondContact CA-OE2 3.47Å; N618-E620 WeakPolarHBondContact CB-OE2 3.35Å
619	I	96.2	Very high	96.6	Very high	59 Å²	59	60 Å²	60	30%	0.303	36%	0.356	S	S	.	.			trans	-129.2	21.1	-173.2	61.7	170.2	0	0	0	112.7	Y609 A612 Q621 M622 M623	Y609-I619 HydrophobicContact CD2-CD1 3.88Å; Y609-I619 HydrophobicContact CD2-CG1 3.62Å; Y609-I619 HydrophobicContact CE2-CG1 3.83Å; A612-I619 HydrophobicContact CB-CD1 3.73Å; A612-I619 HydrophobicContact CB-CG1 4.42Å; I619-Q621 VanDerWaalsContact C-N 3.32Å; I619-Q621 PolarHBondContact O-N 2.98Å; I619-M622 PolarHBondContact O-N 2.73Å; I619-M622 VanDerWaalsContact O-N 3.07Å; I619-M623 HydrophobicContact CG1-CG 4.31Å; I619-M623 WeakPolarHBondContact O-CG 3.32Å; I619-M623 PolarHBondContact O-N 3.2Å
620	E	96.9	Very high	96.6	Very high	30 Å²	30	60.8 Å²	60.8	14%	0.14	36%	0.363	C	S	.	.	H	α-helix	trans	-58.5	-40.9	-173.4	-62.4	74.4	-164.7	0	0	111.9	Y609 N618 M622 M623 Y624	Y609-E620 PolarHBondContact OH-OE1 2.87Å; N618-E620 VanDerWaalsContact C-OE2 3.29Å; N618-E620 WeakPolarHBondContact CA-OE2 3.47Å; N618-E620 WeakPolarHBondContact CB-OE2 3.35Å; E620-M622 VanDerWaalsContact C-N 3.31Å; E620-M622 PolarHBondContact O-N 2.83Å; E620-M623 WeakPolarHBondContact O-CB 3.41Å; E620-M623 PolarHBondContact O-N 3.4Å; E620-Y624 VanDerWaalsContact O-CG 3.32Å; E620-Y624 PolarHBondContact O-N 3.26Å
621	Q	96.3	Very high	96.8	Very high	108 Å²	108	58.1 Å²	58.1	51%	0.505	34%	0.341	S	S	.	.	H	α-helix	trans	-64.1	-36.4	178.4	-63.7	-61.4	-25.8	0	0	112.4	I619 Y624 L625 N856	I619-Q621 VanDerWaalsContact C-N 3.32Å; I619-Q621 PolarHBondContact O-N 2.98Å; Q621-Y624 PolarHBondContact O-N 3.28Å; Q621-L625 PolarHBondContact O-N 3.26Å; Q621-L625 VanDerWaalsContact O-N 3.13Å; Q621-N856 PolarHBondContact OE1-ND2 2.66Å
622	M	97.3	Very high	96.8	Very high	124 Å²	124	56.5 Å²	56.5	61%	0.611	33%	0.325	S	S	*	.	H	α-helix	trans	-73.2	-35.7	174.5	-69.9	-56.4	-59.7	0	0	111.6	I619 E620 Y624 L625 A626	I619-M622 PolarHBondContact O-N 2.73Å; I619-M622 VanDerWaalsContact O-N 3.07Å; E620-M622 VanDerWaalsContact C-N 3.31Å; E620-M622 PolarHBondContact O-N 2.83Å; M622-Y624 VanDerWaalsContact C-N 3.34Å; M622-L625 HydrophobicContact CE-CD2 4.13Å; M622-L625 PolarHBondContact O-N 3.27Å; M622-A626 WeakPolarHBondContact O-CB 3.46Å; M622-A626 PolarHBondContact O-N 3.48Å
623	M	97.9	Very high	96.9	Very high	8 Å²	8	56.4 Å²	56.4	4%	0.039	33%	0.326	C	S	.	.	H	α-helix	trans	-62.1	-42.2	172.1	-68.7	-65	-66.8	0	0	111.4	F605 Y609 I619 E620 A626 S627 A661	F605-M623 HydrophobicContact CD1-CE 4.37Å; F605-M623 HydrophobicContact CD2-CE 4Å; F605-M623 HydrophobicContact CD2-SD 4.01Å; F605-M623 HydrophobicContact CE1-CE 3.96Å; F605-M623 HydrophobicContact CE2-CE 3.51Å; F605-M623 HydrophobicContact CE2-SD 3.38Å; F605-M623 WeakPolarHBondContact CE2-SD 3.35Å; F605-M623 HydrophobicContact CG-CE 4.4Å; F605-M623 HydrophobicContact CZ-CE 3.48Å; F605-M623 VanDerWaalsContact CZ-CE 3.48Å; F605-M623 HydrophobicContact CZ-SD 3.86Å; Y609-M623 HydrophobicContact CD1-CE 4.49Å; Y609-M623 HydrophobicContact CD2-CE 4.21Å; Y609-M623 HydrophobicContact CD2-CG 3.47Å; Y609-M623 VanDerWaalsContact CD2-CG 3.47Å; Y609-M623 HydrophobicContact CD2-SD 3.85Å; Y609-M623 HydrophobicContact CE2-CG 3.88Å; Y609-M623 HydrophobicContact CG-CE 3.86Å; Y609-M623 HydrophobicContact CG-CG 4.11Å; Y609-M623 HydrophobicContact CG-SD 4.02Å; I619-M623 HydrophobicContact CG1-CG 4.31Å; I619-M623 WeakPolarHBondContact O-CG 3.32Å; I619-M623 PolarHBondContact O-N 3.2Å; E620-M623 WeakPolarHBondContact O-CB 3.41Å; E620-M623 PolarHBondContact O-N 3.4Å; M623-A626 PolarHBondContact O-N 3.4Å; M623-S627 VanDerWaalsContact O-CB 3.28Å; M623-S627 WeakPolarHBondContact O-CB 3.1Å; M623-S627 PolarHBondContact O-N 3.03Å; M623-S627 PolarHBondContact O-OG 3.35Å; M623-A661 HydrophobicContact CB-CB 3.57Å; M623-A661 HydrophobicContact CG-CB 4.2Å
624	Y	98.3	Very high	97.1	Very high	20 Å²	20	54.1 Å²	54.1	8%	0.078	31%	0.314	C	S	.	.	H	α-helix	trans	-62.2	-42	175.5	-70.1	-22	0	0	0	112.8	E620 Q621 M622 G628 A661 T662 N855 L857	E620-Y624 VanDerWaalsContact O-CG 3.32Å; E620-Y624 PolarHBondContact O-N 3.26Å; Q621-Y624 PolarHBondContact O-N 3.28Å; M622-Y624 VanDerWaalsContact C-N 3.34Å; Y624-G628 PolarHBondContact O-N 2.65Å; Y624-A661 HydrophobicContact CD1-CB 4.08Å; Y624-A661 HydrophobicContact CE1-CB 3.75Å; Y624-T662 PolarHBondContact OH-OG1 3.25Å; Y624-N855 PolarHBondContact OH-ND2 3.36Å; Y624-L857 HydrophobicContact CD1-CB 3.85Å; Y624-L857 HydrophobicContact CD1-CD2 3.85Å; Y624-L857 HydrophobicContact CD1-CG 4.48Å; Y624-L857 HydrophobicContact CE1-CD2 4.26Å; Y624-L857 HydrophobicContact CG-CB 3.91Å
625	L	97.8	Very high	97.2	Very high	96 Å²	96	49.1 Å²	49.1	50%	0.503	28%	0.279	S	S	.	.	H	α-helix	trans	-60	-51.7	172.6	175.9	62.1	0	0	0	111.2	Q621 M622 S627 G628 L629	Q621-L625 PolarHBondContact O-N 3.26Å; Q621-L625 VanDerWaalsContact O-N 3.13Å; M622-L625 HydrophobicContact CE-CD2 4.13Å; M622-L625 PolarHBondContact O-N 3.27Å; L625-S627 VanDerWaalsContact C-N 3.35Å; L625-S627 PolarHBondContact O-N 2.93Å; L625-G628 PolarHBondContact O-N 2.93Å; L625-L629 HydrophobicContact CD1-CD1 4.34Å; L625-L629 HydrophobicContact CD1-CG 4.32Å; L625-L629 HydrophobicContact CG-CD1 4.26Å; L625-L629 WeakPolarHBondContact O-CG 3.19Å; L625-L629 PolarHBondContact O-N 3.29Å
626	A	98.1	Very high	97.3	Very high	30 Å²	30	48.6 Å²	48.6	25%	0.248	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-40.9	-179.4	0	0	0	0	0	112.2	F605 M622 M623 L629 C630	F605-A626 HydrophobicContact CE2-CB 3.51Å; F605-A626 HydrophobicContact CZ-CB 3.5Å; M622-A626 WeakPolarHBondContact O-CB 3.46Å; M622-A626 PolarHBondContact O-N 3.48Å; M623-A626 PolarHBondContact O-N 3.4Å; A626-L629 PolarHBondContact O-N 3.4Å; A626-C630 WeakPolarHBondContact O-CB 3.28Å; A626-C630 PolarHBondContact O-N 2.98Å; A626-C630 PolarHBondContact O-SG 3.23Å; A626-C630 VanDerWaalsContact O-SG 3.34Å
627	S	98.5	Very high	97.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.6	-44.2	173	-80.9	0	0	0	0	112.3	M623 L625 L629 C630 C631 G654 G657 G658	M623-S627 VanDerWaalsContact O-CB 3.28Å; M623-S627 WeakPolarHBondContact O-CB 3.1Å; M623-S627 PolarHBondContact O-N 3.03Å; M623-S627 PolarHBondContact O-OG 3.35Å; L625-S627 VanDerWaalsContact C-N 3.35Å; L625-S627 PolarHBondContact O-N 2.93Å; S627-L629 PolarHBondContact O-N 3.46Å; S627-C630 WeakPolarHBondContact O-CB 3.29Å; S627-C630 PolarHBondContact O-N 3.15Å; S627-C631 PolarHBondContact O-N 2.7Å; S627-C631 PolarHBondContact O-SG 3.23Å; S627-G654 VanDerWaalsContact CB-O 3.23Å; S627-G654 WeakPolarHBondContact CB-O 3.39Å; S627-G654 PolarHBondContact OG-O 3.24Å; S627-G657 VanDerWaalsContact OG-C 3.28Å; S627-G658 PolarHBondContact OG-N 3.49Å
628	G	98.2	Very high	97.3	Very high	3 Å²	3	38.7 Å²	38.7	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-60	-44.1	174.6	0	0	0	0	0	112.2	Y624 L625 C631 V632	Y624-G628 PolarHBondContact O-N 2.65Å; L625-G628 PolarHBondContact O-N 2.93Å; G628-C631 PolarHBondContact O-N 3.07Å; G628-V632 WeakPolarHBondContact O-CG2 3.23Å; G628-V632 PolarHBondContact O-N 2.98Å
629	L	98.4	Very high	97.1	Very high	112 Å²	112	35.9 Å²	35.9	59%	0.586	20%	0.204	S	C	*	.	H	α-helix	trans	-63.6	-40.2	175.7	-68.3	175.2	0	0	0	112.4	L625 A626 S627 V632 G633	L625-L629 HydrophobicContact CD1-CD1 4.34Å; L625-L629 HydrophobicContact CD1-CG 4.32Å; L625-L629 HydrophobicContact CG-CD1 4.26Å; L625-L629 WeakPolarHBondContact O-CG 3.19Å; L625-L629 PolarHBondContact O-N 3.29Å; A626-L629 PolarHBondContact O-N 3.4Å; S627-L629 PolarHBondContact O-N 3.46Å; L629-V632 PolarHBondContact O-N 3.28Å; L629-G633 PolarHBondContact O-N 2.92Å
630	C	98.6	Very high	96.8	Very high	26 Å²	26	36.2 Å²	36.2	18%	0.176	21%	0.209	C	C	.	.	H	α-helix	trans	-62.5	-41	173	-75.3	0	0	0	0	111.8	A626 S627 G633 A634 L650	A626-C630 WeakPolarHBondContact O-CB 3.28Å; A626-C630 PolarHBondContact O-N 2.98Å; A626-C630 PolarHBondContact O-SG 3.23Å; A626-C630 VanDerWaalsContact O-SG 3.34Å; S627-C630 WeakPolarHBondContact O-CB 3.29Å; S627-C630 PolarHBondContact O-N 3.15Å; C630-G633 CarbonylContact O-C 3.37Å; C630-G633 PolarHBondContact O-N 3.27Å; C630-A634 PolarHBondContact O-N 2.99Å; C630-L650 WeakPolarHBondContact CB-O 2.85Å; C630-L650 WeakPolarHBondContact O-CB 3.47Å
631	C	98.3	Very high	96.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66.2	-38.1	174.5	-69.1	0	0	0	0	112.7	I534 S627 G628 A634 V861 L864	I534-C631 HydrophobicContact CD1-CB 4.2Å; I534-C631 HydrophobicContact CG2-CB 4.25Å; S627-C631 PolarHBondContact O-N 2.7Å; S627-C631 PolarHBondContact O-SG 3.23Å; G628-C631 PolarHBondContact O-N 3.07Å; C631-A634 VanDerWaalsContact O-CB 3.23Å; C631-A634 WeakPolarHBondContact O-CB 3.42Å; C631-A634 PolarHBondContact O-N 3.48Å; C631-V861 HydrophobicContact CB-CG2 4.13Å; C631-L864 HydrophobicContact CB-CD2 4.44Å
632	V	98	Very high	96.3	Very high	26 Å²	26	33.7 Å²	33.7	16%	0.158	21%	0.214	C	C	.	.	H	α-helix	trans	-62.4	-46.8	170.7	170.6	0	0	0	0	110.3	V511 G628 L629 A634 L635 A636 L864	V511-V632 HydrophobicContact CG1-CB 4.43Å; V511-V632 HydrophobicContact CG1-CG1 3.62Å; V511-V632 HydrophobicContact CG1-CG2 3.85Å; G628-V632 WeakPolarHBondContact O-CG2 3.23Å; G628-V632 PolarHBondContact O-N 2.98Å; L629-V632 PolarHBondContact O-N 3.28Å; V632-A634 PolarHBondContact O-N 2.86Å; V632-L635 PolarHBondContact O-N 3.44Å; V632-L635 VanDerWaalsContact O-N 3.15Å; V632-A636 WeakPolarHBondContact O-CB 3.27Å; V632-A636 PolarHBondContact O-N 2.85Å; V632-L864 HydrophobicContact CG2-CD2 4.15Å
633	G	97.9	Very high	96.2	Very high	17 Å²	17	30.1 Å²	30.1	18%	0.175	20%	0.199	C	C	.	.	H	α-helix	trans	-58.7	-29	174.5	0	0	0	0	0	113.2	L629 C630 G637	L629-G633 PolarHBondContact O-N 2.92Å; C630-G633 CarbonylContact O-C 3.37Å; C630-G633 PolarHBondContact O-N 3.27Å; G633-G637 PolarHBondContact O-N 3.24Å
634	A	97.9	Very high	96.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.2	-42.8	176.4	0	0	0	0	0	112.4	V530 I534 C630 C631 V632 G647	V530-A634 HydrophobicContact CG1-CB 4.15Å; I534-A634 HydrophobicContact CD1-CB 3.98Å; C630-A634 PolarHBondContact O-N 2.99Å; C631-A634 VanDerWaalsContact O-CB 3.23Å; C631-A634 WeakPolarHBondContact O-CB 3.42Å; C631-A634 PolarHBondContact O-N 3.48Å; V632-A634 PolarHBondContact O-N 2.86Å; A634-G647 WeakPolarHBondContact CA-O 3.33Å; A634-G647 WeakPolarHBondContact CB-O 3.48Å; A634-G647 VanDerWaalsContact O-CA 3.3Å; A634-G647 WeakPolarHBondContact O-CA 3.45Å
635	L	96.7	Very high	96.1	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-79	-42.1	176.8	-83.4	67.9	0	0	0	111.3	T515 V516 L527 V530 T531 I534 V632 G637 L638 L864	T515-L635 HydrophobicContact CG2-CB 3.75Å; V516-L635 HydrophobicContact CG2-CD2 4Å; L527-L635 HydrophobicContact CD1-CB 4.37Å; L527-L635 HydrophobicContact CD1-CD2 3.72Å; L527-L635 HydrophobicContact CD1-CG 3.58Å; V530-L635 HydrophobicContact CG1-CD1 3.72Å; T531-L635 HydrophobicContact CG2-CD2 4.13Å; I534-L635 HydrophobicContact CD1-CD1 3.94Å; V632-L635 PolarHBondContact O-N 3.44Å; V632-L635 VanDerWaalsContact O-N 3.15Å; L635-G637 PolarHBondContact O-N 2.99Å; L635-L638 WeakPolarHBondContact O-CB 3.46Å; L635-L638 PolarHBondContact O-N 2.94Å; L635-L864 HydrophobicContact CD1-CD2 4.1Å; L635-L864 HydrophobicContact CD2-CD1 3.76Å; L635-L864 HydrophobicContact CD2-CD2 4.16Å; L635-L864 HydrophobicContact CD2-CG 3.74Å
636	A	96.7	Very high	96.1	Very high	39 Å²	39	28 Å²	28	32%	0.322	19%	0.187	S	C	.	.	H	α-helix	trans	-60.1	-34.8	177.4	0	0	0	0	0	111.9	T515 V632 L638 S639	T515-A636 HydrophobicContact CG2-CB 3.82Å; V632-A636 WeakPolarHBondContact O-CB 3.27Å; V632-A636 PolarHBondContact O-N 2.85Å; A636-L638 PolarHBondContact O-N 2.72Å; A636-S639 WeakPolarHBondContact O-CB 3.34Å; A636-S639 PolarHBondContact O-N 3Å; A636-S639 VanDerWaalsContact O-N 3.07Å; A636-S639 PolarHBondContact O-OG 3.43Å
637	G	96.2	Very high	96	Very high	7 Å²	7	26.6 Å²	26.6	7%	0.072	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-64.2	-18.8	175.4	0	0	0	0	0	114.1	G633 L635 S639 T643 A644	G633-G637 PolarHBondContact O-N 3.24Å; L635-G637 PolarHBondContact O-N 2.99Å; G637-S639 VanDerWaalsContact C-N 3.26Å; G637-S639 PolarHBondContact O-N 3.26Å; G637-T643 CarbonylContact O-C 3.53Å; G637-T643 WeakPolarHBondContact O-CB 3.34Å; G637-T643 PolarHBondContact O-OG1 3.06Å; G637-A644 WeakPolarHBondContact O-CA 3.4Å; G637-A644 PolarHBondContact O-N 3.47Å
638	L	94.6	Very high	96	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-83.7	2.9	174.4	-58.5	174	0	0	0	113.2	V519 T520 L523 L527 V530 L582 L635 A636 T640 A644	V519-L638 HydrophobicContact CG1-CB 4.02Å; V519-L638 HydrophobicContact CG2-CB 4.27Å; T520-L638 PolarHBondContact N-O 2.96Å; L523-L638 WeakPolarHBondContact CD1-O 3.25Å; L527-L638 HydrophobicContact CB-CD1 4.04Å; L527-L638 HydrophobicContact CD1-CD1 4.15Å; V530-L638 HydrophobicContact CB-CD1 4.44Å; V530-L638 HydrophobicContact CG2-CD1 4.13Å; L582-L638 HydrophobicContact CD1-CD2 4.46Å; L582-L638 HydrophobicContact CD2-CD2 4.22Å; L635-L638 WeakPolarHBondContact O-CB 3.46Å; L635-L638 PolarHBondContact O-N 2.94Å; A636-L638 PolarHBondContact O-N 2.72Å; L638-T640 PolarHBondContact O-N 3.44Å; L638-A644 HydrophobicContact CD2-CB 4Å
639	S	90.7	Very high	96	Very high	47 Å²	47	27.1 Å²	27.1	33%	0.329	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-66.6	-22.6	176.2	57.5	0	0	0	0	114.2	G518 T520 A636 G637	G518-S639 WeakPolarHBondContact O-CA 3.26Å; G518-S639 WeakPolarHBondContact O-CB 3.38Å; T520-S639 PolarHBondContact OG1-O 2.84Å; A636-S639 WeakPolarHBondContact O-CB 3.34Å; A636-S639 PolarHBondContact O-N 3Å; A636-S639 VanDerWaalsContact O-N 3.07Å; A636-S639 PolarHBondContact O-OG 3.43Å; G637-S639 VanDerWaalsContact C-N 3.26Å; G637-S639 PolarHBondContact O-N 3.26Å
640	T	90.2	Very high	96	Very high	67 Å²	67	23.8 Å²	23.8	41%	0.411	16%	0.162	S	C	.	.	S	Bend	trans	-139.1	151.8	173.1	74	0	0	0	0	111	L638 G642 T643 A644	L638-T640 PolarHBondContact O-N 3.44Å; T640-G642 PolarHBondContact O-N 3.13Å; T640-T643 PolarHBondContact O-N 2.86Å; T640-T643 PolarHBondContact O-OG1 3.49Å; T640-T643 PolarHBondContact OG1-N 3.32Å; T640-T643 PolarHBondContact OG1-OG1 3.48Å; T640-A644 PolarHBondContact O-N 2.81Å
641	Q	89.2	Confident	96	Very high	22 Å²	22	22.5 Å²	22.5	10%	0.103	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-32.5	178.3	-167.4	66.6	-69.3	0	0	113	F585 R645 Y984	F585-Q641 VanDerWaalsContact CB-NE2 3.26Å; Q641-R645 PolarHBondContact O-NH1 3.42Å; Q641-Y984 HydrophobicContact CB-CE2 4.38Å; Q641-Y984 HydrophobicContact CG-CD1 3.99Å; Q641-Y984 HydrophobicContact CG-CD2 4.39Å; Q641-Y984 HydrophobicContact CG-CE1 3.87Å; Q641-Y984 HydrophobicContact CG-CE2 4.29Å; Q641-Y984 HydrophobicContact CG-CG 4.26Å
642	G	92.4	Very high	96	Very high	62 Å²	62	26.4 Å²	26.4	64%	0.639	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-32.5	179.5	0	0	0	0	0	113.7	T640	T640-G642 PolarHBondContact O-N 3.13Å
643	T	96.5	Very high	96.1	Very high	49 Å²	49	26 Å²	26	30%	0.301	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-4.1	-178.7	54.8	0	0	0	0	113.7	G637 T640 R645 L646 G647	G637-T643 CarbonylContact O-C 3.53Å; G637-T643 WeakPolarHBondContact O-CB 3.34Å; G637-T643 PolarHBondContact O-OG1 3.06Å; T640-T643 PolarHBondContact O-N 2.86Å; T640-T643 PolarHBondContact O-OG1 3.49Å; T640-T643 PolarHBondContact OG1-N 3.32Å; T640-T643 PolarHBondContact OG1-OG1 3.48Å; T643-R645 VanDerWaalsContact C-N 3.27Å; T643-R645 PolarHBondContact O-N 2.84Å; T643-R645 VanDerWaalsContact O-N 3.13Å; T643-L646 VanDerWaalsContact O-CB 3.31Å; T643-L646 WeakPolarHBondContact O-CB 3.44Å; T643-L646 PolarHBondContact O-N 2.94Å; T643-G647 PolarHBondContact O-N 2.92Å; T643-G647 VanDerWaalsContact O-N 3.15Å
644	A	96	Very high	96.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-57.7	-36.9	-169.8	0	0	0	0	0	113.8	L523 L582 G637 L638 T640 G647 N648	L523-A644 HydrophobicContact CD1-CB 4.07Å; L582-A644 HydrophobicContact CD1-CB 4.42Å; L582-A644 WeakPolarHBondContact CD1-O 3.41Å; L582-A644 HydrophobicContact CD2-CB 3.76Å; G637-A644 WeakPolarHBondContact O-CA 3.4Å; G637-A644 PolarHBondContact O-N 3.47Å; L638-A644 HydrophobicContact CD2-CB 4Å; T640-A644 PolarHBondContact O-N 2.81Å; A644-G647 PolarHBondContact O-N 3.17Å; A644-N648 PolarHBondContact O-N 3.33Å
645	R	96.9	Very high	96.1	Very high	29 Å²	29	25.4 Å²	25.4	11%	0.109	16%	0.162	C	C	.	.	H	α-helix	trans	-71.9	-32.7	178.8	-71.3	84.8	76	-177.5	12.4	112.8	L582 E593 Q641 T643 G647 N648 A649	L582-R645 HydrophobicContact CB-CG 4.36Å; E593-R645 IonicContact OE2-CZ 3.56Å; E593-R645 VanDerWaalsContact OE2-CZ 3.26Å; E593-R645 IonicContact OE2-NE 3.66Å; E593-R645 PolarHBondContact OE2-NE 3.36Å; E593-R645 IonicContact OE2-NH2 2.82Å; E593-R645 PolarHBondContact OE2-NH2 3.47Å; Q641-R645 PolarHBondContact O-NH1 3.42Å; T643-R645 VanDerWaalsContact C-N 3.27Å; T643-R645 PolarHBondContact O-N 2.84Å; T643-R645 VanDerWaalsContact O-N 3.13Å; R645-G647 VanDerWaalsContact C-N 3.27Å; R645-G647 PolarHBondContact O-N 3.5Å; R645-N648 PolarHBondContact O-N 3.3Å; R645-A649 PolarHBondContact O-N 3.27Å; R645-A649 VanDerWaalsContact O-N 3.13Å
646	L	97.6	Very high	96.2	Very high	51 Å²	51	27.6 Å²	27.6	27%	0.267	18%	0.18	S	C	.	.	H	α-helix	trans	-61.6	-40.4	169.1	168.1	66.4	0	0	0	110.2	Y598 T643 N648 A649 L650	Y598-L646 HydrophobicContact CD1-CD1 3.98Å; Y598-L646 HydrophobicContact CE1-CD1 3.49Å; Y598-L646 VanDerWaalsContact CE1-CD1 3.49Å; Y598-L646 HydrophobicContact CE2-CD1 4.41Å; T643-L646 VanDerWaalsContact O-CB 3.31Å; T643-L646 WeakPolarHBondContact O-CB 3.44Å; T643-L646 PolarHBondContact O-N 2.94Å; L646-N648 VanDerWaalsContact C-N 3.33Å; L646-N648 PolarHBondContact O-N 3.4Å; L646-A649 PolarHBondContact O-N 3.43Å; L646-A649 VanDerWaalsContact O-N 3.16Å; L646-L650 HydrophobicContact CD1-CD1 3.94Å; L646-L650 HydrophobicContact CD1-CD2 4.25Å; L646-L650 HydrophobicContact CD1-CG 3.78Å; L646-L650 HydrophobicContact CG-CD1 3.97Å; L646-L650 HydrophobicContact CG-CG 4.23Å; L646-L650 WeakPolarHBondContact O-CG 3.37Å; L646-L650 PolarHBondContact O-N 2.8Å
647	G	97.4	Very high	96.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-53.8	-49.3	174.7	0	0	0	0	0	112.1	A634 T643 A644 R645 A649 L650 G651	A634-G647 WeakPolarHBondContact CA-O 3.33Å; A634-G647 WeakPolarHBondContact CB-O 3.48Å; A634-G647 VanDerWaalsContact O-CA 3.3Å; A634-G647 WeakPolarHBondContact O-CA 3.45Å; T643-G647 PolarHBondContact O-N 2.92Å; T643-G647 VanDerWaalsContact O-N 3.15Å; A644-G647 PolarHBondContact O-N 3.17Å; R645-G647 VanDerWaalsContact C-N 3.27Å; R645-G647 PolarHBondContact O-N 3.5Å; G647-A649 PolarHBondContact O-N 3.43Å; G647-L650 PolarHBondContact O-N 3.47Å; G647-G651 PolarHBondContact O-N 2.81Å
648	N	98.1	Very high	96.3	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-61.4	-42.5	177.1	-163	35.5	0	0	0	112.7	F575 T578 Q579 L582 A644 R645 L646 G651 M652	F575-N648 WeakPolarHBondContact CD1-OD1 3.41Å; T578-N648 HydrophobicContact CG2-CB 4.2Å; T578-N648 WeakPolarHBondContact CG2-OD1 3.47Å; Q579-N648 PolarHBondContact OE1-ND2 3.4Å; L582-N648 HydrophobicContact CD1-CB 3.93Å; A644-N648 PolarHBondContact O-N 3.33Å; R645-N648 PolarHBondContact O-N 3.3Å; L646-N648 VanDerWaalsContact C-N 3.33Å; L646-N648 PolarHBondContact O-N 3.4Å; N648-G651 PolarHBondContact O-N 3.34Å; N648-M652 PolarHBondContact O-N 3.43Å; N648-M652 VanDerWaalsContact O-N 3.08Å
649	A	98.3	Very high	96.5	Very high	13 Å²	13	26.6 Å²	26.6	11%	0.107	17%	0.168	C	C	.	.	H	α-helix	trans	-63.2	-45.3	178.8	0	0	0	0	0	112.8	Y598 R645 L646 G647 G651 M652 I653	Y598-A649 HydrophobicContact CD2-CB 4.15Å; Y598-A649 HydrophobicContact CG-CB 4.18Å; R645-A649 PolarHBondContact O-N 3.27Å; R645-A649 VanDerWaalsContact O-N 3.13Å; L646-A649 PolarHBondContact O-N 3.43Å; L646-A649 VanDerWaalsContact O-N 3.16Å; G647-A649 PolarHBondContact O-N 3.43Å; A649-G651 VanDerWaalsContact C-N 3.31Å; A649-G651 PolarHBondContact O-N 2.97Å; A649-M652 PolarHBondContact O-N 3.02Å; A649-I653 VanDerWaalsContact O-CG1 3.32Å; A649-I653 WeakPolarHBondContact O-CG1 3.39Å; A649-I653 PolarHBondContact O-N 3.44Å
650	L	98.5	Very high	96.8	Very high	42 Å²	42	25.4 Å²	25.4	22%	0.22	16%	0.161	C	C	.	.	H	α-helix	trans	-63.3	-37.9	176.3	-68.4	177.2	0	0	0	111.7	C630 L646 G647 M652 I653 G654	C630-L650 WeakPolarHBondContact CB-O 2.85Å; C630-L650 WeakPolarHBondContact O-CB 3.47Å; L646-L650 HydrophobicContact CD1-CD1 3.94Å; L646-L650 HydrophobicContact CD1-CD2 4.25Å; L646-L650 HydrophobicContact CD1-CG 3.78Å; L646-L650 HydrophobicContact CG-CD1 3.97Å; L646-L650 HydrophobicContact CG-CG 4.23Å; L646-L650 WeakPolarHBondContact O-CG 3.37Å; L646-L650 PolarHBondContact O-N 2.8Å; G647-L650 PolarHBondContact O-N 3.47Å; L650-M652 PolarHBondContact O-N 2.92Å; L650-I653 HydrophobicContact CD2-CD1 4.49Å; L650-I653 PolarHBondContact O-N 2.87Å; L650-G654 PolarHBondContact O-N 3.1Å
651	G	98.2	Very high	97.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.4	-47.1	173.1	0	0	0	0	0	112.2	F575 G647 N648 A649 I653 G654 V655	F575-G651 VanDerWaalsContact CZ-C 3.4Å; F575-G651 WeakPolarHBondContact CZ-O 3.39Å; G647-G651 PolarHBondContact O-N 2.81Å; N648-G651 PolarHBondContact O-N 3.34Å; A649-G651 VanDerWaalsContact C-N 3.31Å; A649-G651 PolarHBondContact O-N 2.97Å; G651-I653 PolarHBondContact O-N 2.84Å; G651-G654 PolarHBondContact O-N 3.22Å; G651-V655 WeakPolarHBondContact O-CG2 3.49Å; G651-V655 PolarHBondContact O-N 3.28Å
652	M	98.6	Very high	97.5	Very high	82 Å²	82	21.3 Å²	21.3	40%	0.404	14%	0.137	S	C	.	.	H	α-helix	trans	-62.1	-43	176.7	-70.8	-174.5	-74.3	0	0	112.1	F575 N648 A649 L650 A656	F575-M652 HydrophobicContact CB-CG 4.36Å; F575-M652 HydrophobicContact CD1-CG 3.44Å; F575-M652 VanDerWaalsContact CD1-CG 3.44Å; F575-M652 HydrophobicContact CD1-SD 4.45Å; F575-M652 HydrophobicContact CD2-CG 4.07Å; F575-M652 HydrophobicContact CE1-CB 4.41Å; F575-M652 HydrophobicContact CE1-CG 3.63Å; F575-M652 HydrophobicContact CE2-CG 4.23Å; F575-M652 HydrophobicContact CG-CG 3.7Å; F575-M652 HydrophobicContact CG-SD 4.47Å; F575-M652 HydrophobicContact CZ-CG 4.04Å; N648-M652 PolarHBondContact O-N 3.43Å; N648-M652 VanDerWaalsContact O-N 3.08Å; A649-M652 PolarHBondContact O-N 3.02Å; L650-M652 PolarHBondContact O-N 2.92Å; M652-A656 VanDerWaalsContact O-CB 3.26Å; M652-A656 WeakPolarHBondContact O-CB 3.47Å; M652-A656 PolarHBondContact O-N 2.99Å
653	I	98.6	Very high	97.7	Very high	18 Å²	18	19.9 Å²	19.9	9%	0.092	12%	0.115	C	C	.	.	H	α-helix	trans	-62.4	-43.7	176.8	-66.8	166.8	0	0	0	110.7	P601 F605 A649 L650 G651 A656 G657	P601-I653 HydrophobicContact CG-CD1 4.22Å; F605-I653 HydrophobicContact CD1-CG2 3.75Å; F605-I653 HydrophobicContact CE1-CG2 4.35Å; A649-I653 VanDerWaalsContact O-CG1 3.32Å; A649-I653 WeakPolarHBondContact O-CG1 3.39Å; A649-I653 PolarHBondContact O-N 3.44Å; L650-I653 HydrophobicContact CD2-CD1 4.49Å; L650-I653 PolarHBondContact O-N 2.87Å; G651-I653 PolarHBondContact O-N 2.84Å; I653-A656 PolarHBondContact O-N 2.74Å; I653-G657 PolarHBondContact O-N 2.97Å
654	G	98.4	Very high	97.5	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-61.9	-48.9	179.1	0	0	0	0	0	112.5	S627 L650 G651 G657 G658	S627-G654 VanDerWaalsContact CB-O 3.23Å; S627-G654 WeakPolarHBondContact CB-O 3.39Å; S627-G654 PolarHBondContact OG-O 3.24Å; L650-G654 PolarHBondContact O-N 3.1Å; G651-G654 PolarHBondContact O-N 3.22Å; G654-G657 PolarHBondContact O-N 3.32Å; G654-G658 PolarHBondContact O-N 3.36Å
655	V	98.6	Very high	97.5	Very high	4 Å²	4	19.8 Å²	19.8	2%	0.024	12%	0.124	C	C	.	.	H	α-helix	trans	-63.9	-45.5	177.9	173.6	0	0	0	0	111.3	I534 L537 I571 F575 G651 G657 G658 L659	I534-V655 HydrophobicContact CG1-CG2 4.39Å; L537-V655 HydrophobicContact CD1-CG2 4.17Å; L537-V655 HydrophobicContact CD2-CB 4.46Å; L537-V655 HydrophobicContact CD2-CG1 4.07Å; L537-V655 HydrophobicContact CD2-CG2 4.42Å; L537-V655 HydrophobicContact CG-CG1 4.46Å; L537-V655 HydrophobicContact CG-CG2 4.13Å; I571-V655 HydrophobicContact CD1-CG1 3.95Å; I571-V655 HydrophobicContact CG1-CG1 4.3Å; I571-V655 HydrophobicContact CG2-CG1 4.01Å; F575-V655 HydrophobicContact CE2-CB 4.09Å; F575-V655 HydrophobicContact CE2-CG1 4.37Å; F575-V655 HydrophobicContact CE2-CG2 3.87Å; F575-V655 HydrophobicContact CZ-CB 4.28Å; F575-V655 HydrophobicContact CZ-CG2 3.77Å; G651-V655 WeakPolarHBondContact O-CG2 3.49Å; G651-V655 PolarHBondContact O-N 3.28Å; V655-G657 PolarHBondContact O-N 2.97Å; V655-G658 PolarHBondContact O-N 3.37Å; V655-L659 HydrophobicContact CG1-CD1 4.08Å; V655-L659 HydrophobicContact CG1-CG 4.49Å; V655-L659 WeakPolarHBondContact O-CG 3.34Å; V655-L659 PolarHBondContact O-N 3.36Å
656	A	98.4	Very high	97.4	Very high	46 Å²	46	21.8 Å²	21.8	38%	0.38	14%	0.136	S	C	.	.	H	α-helix	trans	-60.3	-44.4	177.6	0	0	0	0	0	112.2	V606 M652 I653 G658 A660	V606-A656 HydrophobicContact CG2-CB 4.45Å; M652-A656 VanDerWaalsContact O-CB 3.26Å; M652-A656 WeakPolarHBondContact O-CB 3.47Å; M652-A656 PolarHBondContact O-N 2.99Å; I653-A656 PolarHBondContact O-N 2.74Å; A656-G658 PolarHBondContact O-N 3.28Å; A656-A660 VanDerWaalsContact O-CB 3.27Å; A656-A660 WeakPolarHBondContact O-CB 3.26Å; A656-A660 PolarHBondContact O-N 3.31Å
657	G	98.1	Very high	97.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.3	-38.7	176.2	0	0	0	0	0	113.3	S627 I653 G654 V655 A660 A661	S627-G657 VanDerWaalsContact OG-C 3.28Å; I653-G657 PolarHBondContact O-N 2.97Å; G654-G657 PolarHBondContact O-N 3.32Å; V655-G657 PolarHBondContact O-N 2.97Å; G657-A660 PolarHBondContact O-N 3.49Å; G657-A661 VanDerWaalsContact O-CB 3.3Å; G657-A661 WeakPolarHBondContact O-CB 3.35Å; G657-A661 PolarHBondContact O-N 3.05Å
658	G	97.9	Very high	97.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-68.3	-42	-179.8	0	0	0	0	0	112.5	S627 G654 V655 A656 T662	S627-G658 PolarHBondContact OG-N 3.49Å; G654-G658 PolarHBondContact O-N 3.36Å; V655-G658 PolarHBondContact O-N 3.37Å; A656-G658 PolarHBondContact O-N 3.28Å; G658-T662 WeakPolarHBondContact O-CB 3.26Å; G658-T662 PolarHBondContact O-N 3.01Å; G658-T662 VanDerWaalsContact O-N 3.13Å; G658-T662 PolarHBondContact O-OG1 2.58Å
659	L	98.1	Very high	97.1	Very high	25 Å²	25	29.2 Å²	29.2	13%	0.131	17%	0.174	C	C	.	.	H	α-helix	trans	-66.1	-44.7	173.3	-67.2	175	0	0	0	111.5	A539 V540 L543 I571 V655 A661 T662 L663	A539-L659 HydrophobicContact CB-CD2 3.96Å; V540-L659 HydrophobicContact CG2-CD2 4.11Å; L543-L659 HydrophobicContact CD1-CD2 3.91Å; I571-L659 HydrophobicContact CD1-CD1 4.04Å; V655-L659 HydrophobicContact CG1-CD1 4.08Å; V655-L659 HydrophobicContact CG1-CG 4.49Å; V655-L659 WeakPolarHBondContact O-CG 3.34Å; V655-L659 PolarHBondContact O-N 3.36Å; L659-A661 PolarHBondContact O-N 2.63Å; L659-T662 PolarHBondContact O-N 2.93Å; L659-L663 WeakPolarHBondContact O-CB 3.47Å; L659-L663 WeakPolarHBondContact O-CG 3.22Å; L659-L663 PolarHBondContact O-N 3.08Å
660	A	97.5	Very high	97.1	Very high	22 Å²	22	33.2 Å²	33.2	18%	0.182	20%	0.199	C	C	.	.	H	α-helix	trans	-61.5	-44.6	178.4	0	0	0	0	0	112.1	V606 Y609 A656 G657 T662 L663 G664	V606-A660 HydrophobicContact CG1-CB 3.96Å; Y609-A660 HydrophobicContact CD1-CB 4.37Å; Y609-A660 VanDerWaalsContact CE1-O 3.26Å; Y609-A660 WeakPolarHBondContact CE1-O 3.42Å; A656-A660 VanDerWaalsContact O-CB 3.27Å; A656-A660 WeakPolarHBondContact O-CB 3.26Å; A656-A660 PolarHBondContact O-N 3.31Å; G657-A660 PolarHBondContact O-N 3.49Å; A660-T662 PolarHBondContact O-N 3.31Å; A660-L663 PolarHBondContact O-N 3.29Å; A660-G664 PolarHBondContact O-N 3.14Å
661	A	97.6	Very high	97	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-58.9	-47.7	176.2	0	0	0	0	0	111.5	Y609 M623 Y624 G657 L659 G664 G665	Y609-A661 PolarHBondContact OH-O 3.22Å; Y609-A661 VanDerWaalsContact OH-O 3.12Å; M623-A661 HydrophobicContact CB-CB 3.57Å; M623-A661 HydrophobicContact CG-CB 4.2Å; Y624-A661 HydrophobicContact CD1-CB 4.08Å; Y624-A661 HydrophobicContact CE1-CB 3.75Å; G657-A661 VanDerWaalsContact O-CB 3.3Å; G657-A661 WeakPolarHBondContact O-CB 3.35Å; G657-A661 PolarHBondContact O-N 3.05Å; L659-A661 PolarHBondContact O-N 2.63Å; A661-G664 PolarHBondContact O-N 2.71Å; A661-G665 PolarHBondContact O-N 3.12Å
662	T	96.6	Very high	97	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.018	21%	0.208	C	C	.	.	H	α-helix	trans	-63.4	-48.6	179.9	-53.6	0	0	0	0	111.7	V540 L543 V544 Y624 G658 L659 A660 G664 G665 L666	V540-T662 HydrophobicContact CG1-CG2 3.96Å; V540-T662 WeakPolarHBondContact CG1-OG1 3.18Å; L543-T662 HydrophobicContact CB-CG2 4.28Å; V544-T662 HydrophobicContact CG1-CG2 3.51Å; Y624-T662 PolarHBondContact OH-OG1 3.25Å; G658-T662 WeakPolarHBondContact O-CB 3.26Å; G658-T662 PolarHBondContact O-N 3.01Å; G658-T662 VanDerWaalsContact O-N 3.13Å; G658-T662 PolarHBondContact O-OG1 2.58Å; L659-T662 PolarHBondContact O-N 2.93Å; A660-T662 PolarHBondContact O-N 3.31Å; T662-G664 PolarHBondContact O-N 2.85Å; T662-G665 PolarHBondContact O-N 3.07Å; T662-L666 HydrophobicContact CG2-CD1 4.33Å; T662-L666 VanDerWaalsContact O-CG 3.28Å; T662-L666 WeakPolarHBondContact O-CG 3.23Å; T662-L666 PolarHBondContact O-N 3.29Å
663	L	95.5	Very high	96.9	Very high	33 Å²	33	34.7 Å²	34.7	17%	0.173	21%	0.207	C	C	.	.	H	α-helix	trans	-61.8	-43	177.4	-72.8	165.7	0	0	0	112.1	L543 L659 A660 P668 L673 M676 M680	L543-L663 HydrophobicContact CD1-CD2 4.08Å; L543-L663 HydrophobicContact CD1-CG 4.15Å; L543-L663 HydrophobicContact CD2-CD2 4.02Å; L659-L663 WeakPolarHBondContact O-CB 3.47Å; L659-L663 WeakPolarHBondContact O-CG 3.22Å; L659-L663 PolarHBondContact O-N 3.08Å; A660-L663 PolarHBondContact O-N 3.29Å; L663-P668 WeakPolarHBondContact O-CD 3.41Å; L663-L673 HydrophobicContact CD2-CD1 4.33Å; L663-M676 HydrophobicContact CD2-CB 4.37Å; L663-M676 HydrophobicContact CD2-SD 3.68Å; L663-M680 HydrophobicContact CD1-CE 4.03Å
664	G	93.9	Very high	96.9	Very high	10 Å²	10	36 Å²	36	10%	0.103	22%	0.22	C	C	.	.	H	α-helix	trans	-68.1	-38	-179.4	0	0	0	0	0	113.2	A660 A661 T662 L666 K667	A660-G664 PolarHBondContact O-N 3.14Å; A661-G664 PolarHBondContact O-N 2.71Å; T662-G664 PolarHBondContact O-N 2.85Å; G664-L666 VanDerWaalsContact C-N 3.34Å; G664-L666 PolarHBondContact O-N 2.94Å; G664-K667 VanDerWaalsContact O-CG 3.28Å; G664-K667 WeakPolarHBondContact O-CG 3.28Å; G664-K667 PolarHBondContact O-N 3.01Å
665	G	94.6	Very high	96.8	Very high	37 Å²	37	36.9 Å²	36.9	38%	0.381	22%	0.224	S	C	.	.	H	α-helix	trans	-68	-31.9	178.5	0	0	0	0	0	113.4	A661 T662	A661-G665 PolarHBondContact O-N 3.12Å; T662-G665 PolarHBondContact O-N 3.07Å
666	L	95.1	Very high	96.8	Very high	71 Å²	71	36.8 Å²	36.8	37%	0.372	22%	0.224	S	C	.	.	H	α-helix	trans	-74.2	-25.6	178.7	-68.5	170.3	0	0	0	113.6	L543 V544 T662 G664 M676	L543-L666 WeakPolarHBondContact O-CD1 3.44Å; V544-L666 HydrophobicContact CB-CD2 4.44Å; V544-L666 HydrophobicContact CG1-CD1 4.31Å; V544-L666 HydrophobicContact CG1-CD2 4.33Å; T662-L666 HydrophobicContact CG2-CD1 4.33Å; T662-L666 VanDerWaalsContact O-CG 3.28Å; T662-L666 WeakPolarHBondContact O-CG 3.23Å; T662-L666 PolarHBondContact O-N 3.29Å; G664-L666 VanDerWaalsContact C-N 3.34Å; G664-L666 PolarHBondContact O-N 2.94Å; L666-M676 HydrophobicContact CD1-CE 4.18Å
667	K	94.4	Very high	96.7	Very high	135 Å²	135	37.2 Å²	37.2	59%	0.587	22%	0.224	S	C	*	.			trans	46.7	54.6	-175.8	-57.9	179.9	-175.6	174.9	0	112.6	G664	G664-K667 VanDerWaalsContact O-CG 3.28Å; G664-K667 WeakPolarHBondContact O-CG 3.28Å; G664-K667 PolarHBondContact O-N 3.01Å
668	P	96.3	Very high	96.7	Very high	30 Å²	30	39.1 Å²	39.1	20%	0.195	24%	0.243	C	C	.	.			trans	-63.9	154.2	-174.6	28.4	-36.1	0	0	0	112.2	L663 L672 L673 M676	L663-P668 WeakPolarHBondContact O-CD 3.41Å; P668-L672 HydrophobicContact CB-CB 4.17Å; P668-L672 HydrophobicContact CB-CD2 3.94Å; P668-L672 HydrophobicContact CB-CG 4.01Å; P668-L673 HydrophobicContact CB-CB 4.37Å; P668-L673 HydrophobicContact CG-CB 3.98Å; P668-L673 HydrophobicContact CG-CD1 3.98Å; P668-L673 HydrophobicContact CG-CG 4.46Å; P668-M676 HydrophobicContact CB-SD 4.31Å; P668-M676 HydrophobicContact CG-SD 4.31Å
669	S	97.1	Very high	96.7	Very high	42 Å²	42	39.7 Å²	39.7	29%	0.294	25%	0.249	S	C	.	.			trans	-62.5	157.3	169.2	89.5	0	0	0	0	110.5	E671 L672 L673	S669-E671 WeakPolarHBondContact CB-OE2 3.47Å; S669-E671 PolarHBondContact O-N 3.08Å; S669-E671 PolarHBondContact OG-N 2.73Å; S669-E671 PolarHBondContact OG-OE2 3.46Å; S669-L672 PolarHBondContact O-N 2.87Å; S669-L672 VanDerWaalsContact O-N 3.17Å; S669-L672 PolarHBondContact OG-N 3.24Å; S669-L673 WeakPolarHBondContact O-CB 3.46Å; S669-L673 PolarHBondContact O-N 3.24Å
670	P	97.2	Very high	96.7	Very high	97 Å²	97	40.1 Å²	40.1	63%	0.63	25%	0.25	S	S	*	.	H	α-helix	trans	-54.1	-36.4	178.4	-27.4	36.2	0	0	0	113.6	A674	P670-A674 WeakPolarHBondContact O-CB 3.37Å; P670-A674 PolarHBondContact O-N 3Å
671	E	97.4	Very high	96.7	Very high	64 Å²	64	41.9 Å²	41.9	30%	0.299	26%	0.264	S	S	.	.	H	α-helix	trans	-68.2	-46.8	178.5	-56.5	79	-170.3	0	0	111.9	H549 Y550 S669 A674 Q675	H549-E671 HydrophobicContact CB-CB 4.1Å; Y550-E671 HydrophobicContact CD1-CB 4.26Å; Y550-E671 HydrophobicContact CD2-CB 3.82Å; Y550-E671 HydrophobicContact CD2-CG 3.75Å; Y550-E671 HydrophobicContact CE1-CB 4.22Å; Y550-E671 HydrophobicContact CE1-CG 4.36Å; Y550-E671 HydrophobicContact CE2-CB 3.76Å; Y550-E671 HydrophobicContact CE2-CG 3.26Å; Y550-E671 HydrophobicContact CG-CB 4.07Å; Y550-E671 HydrophobicContact CG-CG 4.47Å; S669-E671 WeakPolarHBondContact CB-OE2 3.47Å; S669-E671 PolarHBondContact O-N 3.08Å; S669-E671 PolarHBondContact OG-N 2.73Å; S669-E671 PolarHBondContact OG-OE2 3.46Å; E671-A674 WeakPolarHBondContact O-CB 3.46Å; E671-A674 PolarHBondContact O-N 2.83Å; E671-Q675 PolarHBondContact O-N 2.99Å
672	L	96.8	Very high	96.8	Very high	20 Å²	20	46.7 Å²	46.7	11%	0.105	29%	0.29	C	S	.	.	H	α-helix	trans	-66.5	-39.8	177.3	178.9	58.6	0	0	0	111.3	P668 S669 A674 Q675 M676	P668-L672 HydrophobicContact CB-CB 4.17Å; P668-L672 HydrophobicContact CB-CD2 3.94Å; P668-L672 HydrophobicContact CB-CG 4.01Å; S669-L672 PolarHBondContact O-N 2.87Å; S669-L672 VanDerWaalsContact O-N 3.17Å; S669-L672 PolarHBondContact OG-N 3.24Å; L672-A674 VanDerWaalsContact C-N 3.28Å; L672-A674 PolarHBondContact O-N 3.31Å; L672-Q675 WeakPolarHBondContact O-CB 3.29Å; L672-Q675 PolarHBondContact O-N 3.13Å; L672-Q675 VanDerWaalsContact O-N 3.16Å; L672-M676 HydrophobicContact CD1-CE 4.16Å; L672-M676 HydrophobicContact CD2-CE 4.1Å; L672-M676 HydrophobicContact CG-CE 3.93Å; L672-M676 HydrophobicContact CG-SD 4.39Å; L672-M676 WeakPolarHBondContact O-CG 3.5Å; L672-M676 PolarHBondContact O-N 3.36Å
673	L	97.3	Very high	96.8	Very high	71 Å²	71	46.6 Å²	46.6	37%	0.372	29%	0.289	S	S	.	.	H	α-helix	trans	-62	-38	174.4	-176.5	60.2	0	0	0	111.6	L663 P668 S669 M676 S677	L663-L673 HydrophobicContact CD2-CD1 4.33Å; P668-L673 HydrophobicContact CB-CB 4.37Å; P668-L673 HydrophobicContact CG-CB 3.98Å; P668-L673 HydrophobicContact CG-CD1 3.98Å; P668-L673 HydrophobicContact CG-CG 4.46Å; S669-L673 WeakPolarHBondContact O-CB 3.46Å; S669-L673 PolarHBondContact O-N 3.24Å; L673-M676 PolarHBondContact O-N 3.09Å; L673-S677 VanDerWaalsContact O-CB 3.24Å; L673-S677 WeakPolarHBondContact O-CB 3.31Å; L673-S677 PolarHBondContact O-N 2.75Å; L673-S677 PolarHBondContact O-OG 3.29Å
674	A	97.5	Very high	96.9	Very high	46 Å²	46	45.6 Å²	45.6	38%	0.38	29%	0.287	S	S	.	.	H	α-helix	trans	-64.5	-40.3	174.3	0	0	0	0	0	111.6	Y550 P670 E671 L672 G678	Y550-A674 HydrophobicContact CD1-CB 4.18Å; Y550-A674 HydrophobicContact CE1-CB 3.88Å; P670-A674 WeakPolarHBondContact O-CB 3.37Å; P670-A674 PolarHBondContact O-N 3Å; E671-A674 WeakPolarHBondContact O-CB 3.46Å; E671-A674 PolarHBondContact O-N 2.83Å; L672-A674 VanDerWaalsContact C-N 3.28Å; L672-A674 PolarHBondContact O-N 3.31Å; A674-G678 PolarHBondContact O-N 3.4Å
675	Q	97.8	Very high	97.1	Very high	19 Å²	19	49 Å²	49	9%	0.089	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-51	173.7	-173.7	-165.9	31.6	0	0	111.8	M546 H549 P552 E671 L672 S677 G678 A679	M546-Q675 HydrophobicContact CE-CG 3.95Å; H549-Q675 PolarHBondContact O-OE1 3.27Å; P552-Q675 VanDerWaalsContact CD-NE2 3.26Å; P552-Q675 VanDerWaalsContact N-NE2 3.18Å; E671-Q675 PolarHBondContact O-N 2.99Å; L672-Q675 WeakPolarHBondContact O-CB 3.29Å; L672-Q675 PolarHBondContact O-N 3.13Å; L672-Q675 VanDerWaalsContact O-N 3.16Å; Q675-S677 PolarHBondContact O-N 3.2Å; Q675-G678 PolarHBondContact O-N 2.91Å; Q675-A679 PolarHBondContact O-N 3.25Å
676	M	98	Very high	97.3	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-56.8	-48.8	177.4	-71	175	170.3	0	0	111.2	L543 M546 L663 L666 P668 L672 L673 G678 A679 M680	L543-M676 HydrophobicContact CD2-CB 3.78Å; L543-M676 HydrophobicContact CD2-CE 4.49Å; L543-M676 HydrophobicContact CD2-CG 3.67Å; L543-M676 HydrophobicContact CD2-SD 3.97Å; L543-M676 VanDerWaalsContact O-CE 3.32Å; L543-M676 WeakPolarHBondContact O-CE 3.47Å; M546-M676 HydrophobicContact CB-CE 3.78Å; M546-M676 HydrophobicContact CE-CB 4.36Å; M546-M676 HydrophobicContact CE-CG 3.78Å; M546-M676 HydrophobicContact SD-CG 4.14Å; L663-M676 HydrophobicContact CD2-CB 4.37Å; L663-M676 HydrophobicContact CD2-SD 3.68Å; L666-M676 HydrophobicContact CD1-CE 4.18Å; P668-M676 HydrophobicContact CB-SD 4.31Å; P668-M676 HydrophobicContact CG-SD 4.31Å; L672-M676 HydrophobicContact CD1-CE 4.16Å; L672-M676 HydrophobicContact CD2-CE 4.1Å; L672-M676 HydrophobicContact CG-CE 3.93Å; L672-M676 HydrophobicContact CG-SD 4.39Å; L672-M676 WeakPolarHBondContact O-CG 3.5Å; L672-M676 PolarHBondContact O-N 3.36Å; L673-M676 PolarHBondContact O-N 3.09Å; M676-G678 PolarHBondContact O-N 3.43Å; M676-A679 PolarHBondContact O-N 3.29Å; M676-M680 WeakPolarHBondContact O-CG 3.32Å; M676-M680 PolarHBondContact O-N 3.06Å; M676-M680 VanDerWaalsContact O-N 3.07Å
677	S	97.1	Very high	97.4	Very high	55 Å²	55	47 Å²	47	39%	0.385	29%	0.286	S	S	.	.	H	α-helix	trans	-64.3	-40.8	179.2	-57.4	0	0	0	0	111.9	L673 Q675 M680 A681	L673-S677 VanDerWaalsContact O-CB 3.24Å; L673-S677 WeakPolarHBondContact O-CB 3.31Å; L673-S677 PolarHBondContact O-N 2.75Å; L673-S677 PolarHBondContact O-OG 3.29Å; Q675-S677 PolarHBondContact O-N 3.2Å; S677-M680 PolarHBondContact O-N 3.4Å; S677-A681 WeakPolarHBondContact O-CB 3.33Å; S677-A681 PolarHBondContact O-N 3.26Å
678	G	97.6	Very high	97.5	Very high	40 Å²	40	44.5 Å²	44.5	41%	0.412	28%	0.279	S	S	.	.	H	α-helix	trans	-63.8	-44.3	177.5	0	0	0	0	0	112.9	A674 Q675 M676 A681 L682	A674-G678 PolarHBondContact O-N 3.4Å; Q675-G678 PolarHBondContact O-N 2.91Å; M676-G678 PolarHBondContact O-N 3.43Å; G678-A681 PolarHBondContact O-N 3.5Å; G678-L682 WeakPolarHBondContact O-CB 3.35Å; G678-L682 PolarHBondContact O-N 3.48Å
679	A	97.7	Very high	97.5	Very high	13 Å²	13	46 Å²	46	11%	0.107	29%	0.287	C	S	.	.	H	α-helix	trans	-61.6	-47.5	176.1	0	0	0	0	0	111.6	V561 Q675 M676 G683	V561-A679 HydrophobicContact CG1-CB 4.3Å; Q675-A679 PolarHBondContact O-N 3.25Å; M676-A679 PolarHBondContact O-N 3.29Å; A679-G683 PolarHBondContact O-N 2.9Å
680	M	98.1	Very high	97.5	Very high	34 Å²	34	47.1 Å²	47.1	17%	0.167	29%	0.289	C	S	.	.	H	α-helix	trans	-65.4	-42.3	178.1	-67.7	-172.5	-67	0	0	112.5	L543 S568 L663 M676 S677 G683 G684	L543-M680 HydrophobicContact CD1-SD 4.13Å; L543-M680 HydrophobicContact CD2-SD 4.42Å; S568-M680 WeakPolarHBondContact CB-O 3.36Å; S568-M680 WeakPolarHBondContact OG-CA 3.28Å; S568-M680 WeakPolarHBondContact OG-CG 3.25Å; L663-M680 HydrophobicContact CD1-CE 4.03Å; M676-M680 WeakPolarHBondContact O-CG 3.32Å; M676-M680 PolarHBondContact O-N 3.06Å; M676-M680 VanDerWaalsContact O-N 3.07Å; S677-M680 PolarHBondContact O-N 3.4Å; M680-G683 PolarHBondContact O-N 2.81Å; M680-G684 PolarHBondContact O-N 3.26Å
681	A	98.1	Very high	97.3	Very high	58 Å²	58	42.5 Å²	42.5	48%	0.479	26%	0.259	S	S	.	.	H	α-helix	trans	-64.4	-42.3	179.4	0	0	0	0	0	111.9	S677 G678 T685	S677-A681 WeakPolarHBondContact O-CB 3.33Å; S677-A681 PolarHBondContact O-N 3.26Å; G678-A681 PolarHBondContact O-N 3.5Å; A681-T685 VanDerWaalsContact O-CB 3.31Å; A681-T685 WeakPolarHBondContact O-CB 3.25Å; A681-T685 PolarHBondContact O-N 3.49Å; A681-T685 PolarHBondContact O-OG1 3.4Å
682	L	98.1	Very high	97.2	Very high	102 Å²	102	47.2 Å²	47.2	53%	0.534	28%	0.279	S	S	.	.	H	α-helix	trans	-66.1	-47.6	177.3	-173.8	66.2	0	0	0	111.2	F565 G678 T685 I686	F565-L682 HydrophobicContact CD2-CB 4.37Å; F565-L682 HydrophobicContact CD2-CD2 4.36Å; F565-L682 HydrophobicContact CD2-CG 4.43Å; F565-L682 HydrophobicContact CE2-CB 4.17Å; F565-L682 HydrophobicContact CE2-CD2 3.87Å; F565-L682 HydrophobicContact CE2-CG 3.8Å; G678-L682 WeakPolarHBondContact O-CB 3.35Å; G678-L682 PolarHBondContact O-N 3.48Å; L682-T685 PolarHBondContact O-N 3.03Å; L682-I686 HydrophobicContact CG-CD1 4.37Å; L682-I686 WeakPolarHBondContact O-CG1 3.08Å; L682-I686 PolarHBondContact O-N 3.33Å; L682-I686 VanDerWaalsContact O-N 3.1Å
683	G	97.9	Very high	97	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.9	-48.7	176.8	0	0	0	0	0	111.7	V569 A679 M680 T685 I686 G687	V569-G683 WeakPolarHBondContact CA-O 3.5Å; V569-G683 WeakPolarHBondContact CG2-O 3.46Å; A679-G683 PolarHBondContact O-N 2.9Å; M680-G683 PolarHBondContact O-N 2.81Å; G683-T685 VanDerWaalsContact C-N 3.34Å; G683-T685 PolarHBondContact O-N 2.89Å; G683-I686 PolarHBondContact O-N 3.24Å; G683-G687 PolarHBondContact O-N 2.96Å
684	G	97.8	Very high	96.8	Very high	12 Å²	12	53.7 Å²	53.7	12%	0.124	30%	0.299	C	S	.	.	H	α-helix	trans	-59.6	-41.8	177.3	0	0	0	0	0	112.9	A572 M680 I686 G687 L688	A572-G684 WeakPolarHBondContact CB-O 3.4Å; M680-G684 PolarHBondContact O-N 3.26Å; G684-I686 VanDerWaalsContact C-N 3.34Å; G684-I686 PolarHBondContact O-N 2.86Å; G684-G687 PolarHBondContact O-N 2.95Å; G684-L688 WeakPolarHBondContact O-CG 3.4Å; G684-L688 PolarHBondContact O-N 3.34Å
685	T	98.1	Very high	96.6	Very high	83 Å²	83	56.1 Å²	56.1	51%	0.509	30%	0.302	S	S	.	.	H	α-helix	trans	-62	-41.7	177	-60.4	0	0	0	0	112	A681 L682 G683 T689	A681-T685 VanDerWaalsContact O-CB 3.31Å; A681-T685 WeakPolarHBondContact O-CB 3.25Å; A681-T685 PolarHBondContact O-N 3.49Å; A681-T685 PolarHBondContact O-OG1 3.4Å; L682-T685 PolarHBondContact O-N 3.03Å; G683-T685 VanDerWaalsContact C-N 3.34Å; G683-T685 PolarHBondContact O-N 2.89Å; T685-T689 WeakPolarHBondContact O-CB 3.46Å; T685-T689 PolarHBondContact O-N 3.1Å; T685-T689 PolarHBondContact O-OG1 3.5Å
686	I	97.9	Very high	96.2	Very high	64 Å²	64	55.3 Å²	55.3	33%	0.328	30%	0.299	S	S	.	.	H	α-helix	trans	-64.4	-47.3	175.3	-68.7	167.9	0	0	0	110.1	F565 V569 L682 G683 G684 L688 T689 I690	F565-I686 HydrophobicContact CE2-CD1 3.84Å; F565-I686 HydrophobicContact CZ-CD1 3.63Å; V569-I686 HydrophobicContact CG1-CG2 4.37Å; V569-I686 HydrophobicContact CG2-CB 4.41Å; V569-I686 HydrophobicContact CG2-CG2 4.37Å; L682-I686 HydrophobicContact CG-CD1 4.37Å; L682-I686 WeakPolarHBondContact O-CG1 3.08Å; L682-I686 PolarHBondContact O-N 3.33Å; L682-I686 VanDerWaalsContact O-N 3.1Å; G683-I686 PolarHBondContact O-N 3.24Å; G684-I686 VanDerWaalsContact C-N 3.34Å; G684-I686 PolarHBondContact O-N 2.86Å; I686-L688 PolarHBondContact O-N 2.78Å; I686-T689 PolarHBondContact O-N 3.09Å; I686-I690 HydrophobicContact CG2-CD1 3.68Å; I686-I690 HydrophobicContact CG2-CG1 4.38Å; I686-I690 WeakPolarHBondContact O-CG1 3.41Å; I686-I690 PolarHBondContact O-N 3.18Å
687	G	96.7	Very high	95.7	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-55.2	-50.7	177.3	0	0	0	0	0	112.7	V569 G683 G684 T689 I690 A691	V569-G687 WeakPolarHBondContact O-CA 3.46Å; G683-G687 PolarHBondContact O-N 2.96Å; G684-G687 PolarHBondContact O-N 2.95Å; G687-T689 VanDerWaalsContact C-N 3.33Å; G687-T689 PolarHBondContact O-N 3.15Å; G687-I690 PolarHBondContact O-N 3.09Å; G687-A691 VanDerWaalsContact O-CB 3.24Å; G687-A691 WeakPolarHBondContact O-CB 3.5Å; G687-A691 PolarHBondContact O-N 3.46Å
688	L	97.3	Very high	95.4	Very high	83 Å²	83	57.8 Å²	57.8	44%	0.435	31%	0.311	S	S	.	.	H	α-helix	trans	-60	-42.2	176.6	-68.9	172.8	0	0	0	112.2	A572 L576 G684 I686 K692	A572-L688 HydrophobicContact CB-CD2 4.09Å; A572-L688 HydrophobicContact CB-CG 3.89Å; L576-L688 HydrophobicContact CB-CD2 4.17Å; L576-L688 HydrophobicContact CD2-CD2 4Å; L576-L688 WeakPolarHBondContact CD2-O 3.33Å; G684-L688 WeakPolarHBondContact O-CG 3.4Å; G684-L688 PolarHBondContact O-N 3.34Å; I686-L688 PolarHBondContact O-N 2.78Å; L688-K692 VanDerWaalsContact O-CB 3.26Å; L688-K692 WeakPolarHBondContact O-CB 3.44Å; L688-K692 PolarHBondContact O-N 2.89Å
689	T	97.1	Very high	95	Very high	61 Å²	61	56 Å²	56	37%	0.374	29%	0.292	S	S	.	.	H	α-helix	trans	-65.8	-43	-178.7	-59.8	0	0	0	0	111.5	T685 I686 G687 R693	T685-T689 WeakPolarHBondContact O-CB 3.46Å; T685-T689 PolarHBondContact O-N 3.1Å; T685-T689 PolarHBondContact O-OG1 3.5Å; I686-T689 PolarHBondContact O-N 3.09Å; G687-T689 VanDerWaalsContact C-N 3.33Å; G687-T689 PolarHBondContact O-N 3.15Å; T689-R693 WeakPolarHBondContact O-CG 3.33Å; T689-R693 PolarHBondContact O-N 2.9Å
690	I	95.4	Very high	94.7	Very high	67 Å²	67	55.4 Å²	55.4	34%	0.344	29%	0.287	S	S	.	.	H	α-helix	trans	-64.7	-54.5	176.2	-67.2	170	0	0	0	109.6	I686 G687 K692 R693 I694 L702	I686-I690 HydrophobicContact CG2-CD1 3.68Å; I686-I690 HydrophobicContact CG2-CG1 4.38Å; I686-I690 WeakPolarHBondContact O-CG1 3.41Å; I686-I690 PolarHBondContact O-N 3.18Å; G687-I690 PolarHBondContact O-N 3.09Å; I690-K692 PolarHBondContact O-N 3.4Å; I690-R693 PolarHBondContact O-N 3Å; I690-I694 HydrophobicContact CG2-CG2 4.33Å; I690-I694 WeakPolarHBondContact O-CG2 3.42Å; I690-I694 PolarHBondContact O-N 3.16Å; I690-L702 HydrophobicContact CG2-CD1 3.71Å
691	A	93.5	Very high	94.4	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59.1	-31.7	-177.1	0	0	0	0	0	113.8	G573 L576 V577 R580 G687 I694	G573-A691 WeakPolarHBondContact O-CB 3.49Å; L576-A691 HydrophobicContact CB-CB 3.95Å; L576-A691 HydrophobicContact CD2-CB 3.84Å; L576-A691 HydrophobicContact CG-CB 4.15Å; V577-A691 HydrophobicContact CG2-CB 3.62Å; R580-A691 PolarHBondContact NH1-O 3.07Å; G687-A691 VanDerWaalsContact O-CB 3.24Å; G687-A691 WeakPolarHBondContact O-CB 3.5Å; G687-A691 PolarHBondContact O-N 3.46Å; A691-I694 WeakPolarHBondContact O-CG1 3.25Å
692	K	94.4	Very high	94.1	Very high	162 Å²	162	52.5 Å²	52.5	70%	0.704	26%	0.264	S	S	*	.	H	α-helix	trans	-74	-30.5	177	-169.6	171.5	-178.6	175.5	0	113.3	L576 L688 I690	L576-K692 HydrophobicContact CD2-CB 4Å; L688-K692 VanDerWaalsContact O-CB 3.26Å; L688-K692 WeakPolarHBondContact O-CB 3.44Å; L688-K692 PolarHBondContact O-N 2.89Å; I690-K692 PolarHBondContact O-N 3.4Å
693	R	94.4	Very high	93.8	Very high	199 Å²	199	47.8 Å²	47.8	75%	0.751	24%	0.239	S	C	*	.	H	α-helix	trans	-89.5	-24	-173	-70.9	179.6	-179.1	-170	2	113.8	T689 I690	T689-R693 WeakPolarHBondContact O-CG 3.33Å; T689-R693 PolarHBondContact O-N 2.9Å; I690-R693 PolarHBondContact O-N 3Å
694	I	91.9	Very high	93.6	Very high	28 Å²	28	47.9 Å²	47.9	14%	0.144	24%	0.239	C	C	.	.			trans	-69.5	145.8	-177.5	60.3	129.1	0	0	0	112.9	V577 R580 I690 A691 L699 L702	V577-I694 HydrophobicContact CG2-CD1 4.06Å; R580-I694 PolarHBondContact NH1-O 2.88Å; R580-I694 PolarHBondContact NH2-O 3.17Å; R580-I694 VanDerWaalsContact NH2-O 3.13Å; I690-I694 HydrophobicContact CG2-CG2 4.33Å; I690-I694 WeakPolarHBondContact O-CG2 3.42Å; I690-I694 PolarHBondContact O-N 3.16Å; A691-I694 WeakPolarHBondContact O-CG1 3.25Å; I694-L699 HydrophobicContact CD1-CD1 4.43Å; I694-L702 HydrophobicContact CD1-CD2 3.36Å; I694-L702 HydrophobicContact CG1-CD2 3.84Å; I694-L702 HydrophobicContact CG2-CD2 4.31Å
695	Q	92.7	Very high	93.4	Very high	98 Å²	98	48.5 Å²	48.5	46%	0.458	24%	0.244	S	C	.	.			trans	-83.7	153.6	169.5	-58.9	-65.2	-60	0	0	109.7	S697 D698	Q695-S697 VanDerWaalsContact C-N 3.28Å; Q695-S697 PolarHBondContact O-N 3.37Å; Q695-D698 WeakPolarHBondContact O-CB 3.23Å; Q695-D698 PolarHBondContact O-N 3.13Å
696	I	90	Very high	93.1	Very high	2 Å²	2	45 Å²	45	1%	0.01	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-69.1	-28.8	-179.5	-59.1	-53.6	0	0	0	112.1	M581 M584 D698 L699 V975 L976	M581-I696 HydrophobicContact CG-CD1 4.24Å; M584-I696 HydrophobicContact CE-CD1 3.82Å; M584-I696 HydrophobicContact CE-CG1 3.45Å; M584-I696 VanDerWaalsContact CE-CG1 3.45Å; M584-I696 HydrophobicContact SD-CD1 4.3Å; M584-I696 HydrophobicContact SD-CG1 3.87Å; I696-D698 PolarHBondContact O-N 3.28Å; I696-L699 WeakPolarHBondContact O-CB 3.44Å; I696-L699 PolarHBondContact O-N 3.38Å; I696-L699 VanDerWaalsContact O-N 3.15Å; I696-V975 HydrophobicContact CG2-CB 4.44Å; I696-V975 HydrophobicContact CG2-CG1 3.66Å; I696-L976 HydrophobicContact CB-CD2 4.26Å; I696-L976 HydrophobicContact CG2-CD2 3.91Å
697	S	87.4	Confident	92.8	Very high	45 Å²	45	41.9 Å²	41.9	32%	0.315	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-58.9	-26.6	170.6	58.9	0	0	0	0	113.2	Q695 Q972	Q695-S697 VanDerWaalsContact C-N 3.28Å; Q695-S697 PolarHBondContact O-N 3.37Å; S697-Q972 PolarHBondContact O-NE2 3.42Å
698	D	91.3	Very high	92.8	Very high	63 Å²	63	42.3 Å²	42.3	34%	0.337	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-94.8	7.3	-177.3	-65.8	-29.1	0	0	0	113.3	Q695 I696 P700 Q701 L702	Q695-D698 WeakPolarHBondContact O-CB 3.23Å; Q695-D698 PolarHBondContact O-N 3.13Å; I696-D698 PolarHBondContact O-N 3.28Å; D698-P700 VanDerWaalsContact C-CD 3.45Å; D698-Q701 VanDerWaalsContact C-CD 3.42Å; D698-Q701 VanDerWaalsContact C-OE1 3.31Å; D698-Q701 HydrophobicContact CB-CG 4.5Å; D698-Q701 WeakPolarHBondContact O-CG 3.5Å; D698-Q701 PolarHBondContact O-NE2 3.3Å; D698-Q701 PolarHBondContact O-OE1 2.88Å; D698-Q701 VanDerWaalsContact O-OE1 3.09Å; D698-Q701 PolarHBondContact OD1-NE2 3.33Å; D698-L702 PolarHBondContact O-N 3.22Å
699	L	89.9	Confident	92.8	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-59.7	-41.6	-179.6	-175	65	0	0	0	114.1	V577 M581 I694 I696 Q701 L702 V703 M969	V577-L699 HydrophobicContact CG1-CD1 3.38Å; M581-L699 HydrophobicContact CE-CD2 4.32Å; M581-L699 HydrophobicContact SD-CD2 3.31Å; M581-L699 WeakPolarHBondContact SD-CD2 3.2Å; I694-L699 HydrophobicContact CD1-CD1 4.43Å; I696-L699 WeakPolarHBondContact O-CB 3.44Å; I696-L699 PolarHBondContact O-N 3.38Å; I696-L699 VanDerWaalsContact O-N 3.15Å; L699-Q701 VanDerWaalsContact C-N 3.32Å; L699-Q701 PolarHBondContact O-N 3.44Å; L699-L702 PolarHBondContact O-N 3.2Å; L699-L702 VanDerWaalsContact O-N 3.12Å; L699-V703 HydrophobicContact CD1-CG2 4.14Å; L699-V703 HydrophobicContact CG-CG2 4.17Å; L699-V703 WeakPolarHBondContact O-CG2 3.37Å; L699-V703 PolarHBondContact O-N 3.28Å; L699-M969 HydrophobicContact CD2-CE 4.23Å; L699-M969 HydrophobicContact CD2-SD 3.99Å; L699-M969 HydrophobicContact CG-CE 4.49Å; L699-M969 HydrophobicContact CG-SD 4.01Å
700	P	91.3	Very high	92.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.8	-41.3	-176.9	-24.9	34.8	0	0	0	113.2	D698 A704 L763 I835 R968 M969	D698-P700 VanDerWaalsContact C-CD 3.45Å; P700-A704 PolarHBondContact O-N 2.86Å; P700-A704 VanDerWaalsContact O-N 3.09Å; P700-L763 HydrophobicContact CB-CD1 4.14Å; P700-I835 HydrophobicContact CB-CD1 4.28Å; P700-R968 HydrophobicContact CG-CB 4.12Å; P700-M969 HydrophobicContact CB-CB 4.21Å; P700-M969 HydrophobicContact CG-CB 3.84Å; P700-M969 HydrophobicContact CG-SD 4.44Å
701	Q	91.5	Very high	92.8	Very high	17 Å²	17	34.2 Å²	34.2	8%	0.079	16%	0.164	C	C	.	.	H	α-helix	trans	-72.2	-33.9	177.6	63.2	-96.1	35.1	0	0	112.5	D698 L699 A704 A705 Y760 L763	D698-Q701 VanDerWaalsContact C-CD 3.42Å; D698-Q701 VanDerWaalsContact C-OE1 3.31Å; D698-Q701 HydrophobicContact CB-CG 4.5Å; D698-Q701 WeakPolarHBondContact O-CG 3.5Å; D698-Q701 PolarHBondContact O-NE2 3.3Å; D698-Q701 PolarHBondContact O-OE1 2.88Å; D698-Q701 VanDerWaalsContact O-OE1 3.09Å; D698-Q701 PolarHBondContact OD1-NE2 3.33Å; L699-Q701 VanDerWaalsContact C-N 3.32Å; L699-Q701 PolarHBondContact O-N 3.44Å; Q701-A704 PolarHBondContact O-N 3.29Å; Q701-A705 WeakPolarHBondContact O-CB 3.42Å; Q701-A705 PolarHBondContact O-N 2.91Å; Q701-Y760 HydrophobicContact CB-CD2 3.73Å; Q701-Y760 HydrophobicContact CB-CE2 4.03Å; Q701-Y760 HydrophobicContact CG-CD2 4.5Å; Q701-Y760 HydrophobicContact CG-CE2 4.33Å; Q701-Y760 WeakPolarHBondContact O-CD2 3.45Å; Q701-L763 HydrophobicContact CB-CB 4.15Å
702	L	91.6	Very high	93	Very high	15 Å²	15	36.6 Å²	36.6	8%	0.079	18%	0.176	C	C	.	.	H	α-helix	trans	-65	-42.8	175.2	-177.9	65	0	0	0	111.1	V577 I690 I694 D698 L699 A704 A705 F706	V577-L702 HydrophobicContact CG2-CD2 3.84Å; I690-L702 HydrophobicContact CG2-CD1 3.71Å; I694-L702 HydrophobicContact CD1-CD2 3.36Å; I694-L702 HydrophobicContact CG1-CD2 3.84Å; I694-L702 HydrophobicContact CG2-CD2 4.31Å; D698-L702 PolarHBondContact O-N 3.22Å; L699-L702 PolarHBondContact O-N 3.2Å; L699-L702 VanDerWaalsContact O-N 3.12Å; L702-A704 VanDerWaalsContact C-N 3.34Å; L702-A704 PolarHBondContact O-N 2.99Å; L702-A705 WeakPolarHBondContact O-CB 3.34Å; L702-A705 PolarHBondContact O-N 2.92Å; L702-A705 VanDerWaalsContact O-N 3.12Å; L702-F706 HydrophobicContact CD1-CD1 4.29Å; L702-F706 HydrophobicContact CD1-CE1 3.74Å; L702-F706 HydrophobicContact CD1-CE2 4.03Å; L702-F706 HydrophobicContact CD1-CZ 3.6Å; L702-F706 HydrophobicContact CD2-CE2 3.8Å; L702-F706 HydrophobicContact CD2-CZ 3.91Å; L702-F706 HydrophobicContact CG-CD2 4.13Å; L702-F706 HydrophobicContact CG-CE1 4.31Å; L702-F706 HydrophobicContact CG-CE2 3.68Å; L702-F706 HydrophobicContact CG-CZ 3.79Å; L702-F706 PolarHBondContact O-N 2.91Å
703	V	91	Very high	93.2	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.018	14%	0.143	C	C	.	.	H	α-helix	trans	-58.4	-47.1	175.2	165.9	0	0	0	0	110.7	M528 L699 A705 F706 H707 I835 M969	M528-V703 HydrophobicContact CE-CG1 4.17Å; L699-V703 HydrophobicContact CD1-CG2 4.14Å; L699-V703 HydrophobicContact CG-CG2 4.17Å; L699-V703 WeakPolarHBondContact O-CG2 3.37Å; L699-V703 PolarHBondContact O-N 3.28Å; V703-A705 VanDerWaalsContact C-N 3.33Å; V703-A705 PolarHBondContact O-N 2.83Å; V703-F706 PolarHBondContact O-N 3.49Å; V703-H707 VanDerWaalsContact CG1-CE1 3.47Å; V703-H707 WeakPolarHBondContact CG1-CE1 3.44Å; V703-H707 PolarHBondContact O-N 3.23Å; V703-H707 VanDerWaalsContact O-N 3.12Å; V703-I835 HydrophobicContact CG1-CG2 3.63Å; V703-M969 HydrophobicContact CG2-CE 3.89Å; V703-M969 HydrophobicContact CG2-SD 4.22Å
704	A	93.4	Very high	93.4	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.008	11%	0.107	C	C	.	.	H	α-helix	trans	-59.6	-42.1	173.9	0	0	0	0	0	111.9	P700 Q701 L702 F706 H707 S708 S756 A759	P700-A704 PolarHBondContact O-N 2.86Å; P700-A704 VanDerWaalsContact O-N 3.09Å; Q701-A704 PolarHBondContact O-N 3.29Å; L702-A704 VanDerWaalsContact C-N 3.34Å; L702-A704 PolarHBondContact O-N 2.99Å; A704-F706 PolarHBondContact O-N 3.26Å; A704-H707 PolarHBondContact O-N 2.9Å; A704-S708 PolarHBondContact O-N 3.2Å; A704-S756 VanDerWaalsContact O-CB 3.28Å; A704-S756 WeakPolarHBondContact O-CB 3.15Å; A704-A759 HydrophobicContact CB-CB 4.31Å
705	A	94.4	Very high	93.7	Very high	26 Å²	26	18.8 Å²	18.8	22%	0.215	11%	0.105	C	C	.	.	H	α-helix	trans	-62.9	-40	176.9	0	0	0	0	0	112.6	Q701 L702 V703 S708 L709 Y760	Q701-A705 WeakPolarHBondContact O-CB 3.42Å; Q701-A705 PolarHBondContact O-N 2.91Å; L702-A705 WeakPolarHBondContact O-CB 3.34Å; L702-A705 PolarHBondContact O-N 2.92Å; L702-A705 VanDerWaalsContact O-N 3.12Å; V703-A705 VanDerWaalsContact C-N 3.33Å; V703-A705 PolarHBondContact O-N 2.83Å; A705-S708 PolarHBondContact O-N 3.42Å; A705-S708 PolarHBondContact O-OG 2.69Å; A705-L709 PolarHBondContact O-N 2.75Å; A705-Y760 HydrophobicContact CB-CD2 4.22Å
706	F	91.4	Very high	93.9	Very high	8 Å²	8	15 Å²	15	4%	0.035	9%	0.087	C	C	.	.	H	α-helix	trans	-67.1	-38.9	178.3	-71.3	-22.1	0	0	0	113.2	V569 N570 L702 V703 A704 S708 L709 V710	V569-F706 HydrophobicContact CG1-CE1 4.45Å; N570-F706 PolarHBondContact ND2-O 3.31Å; N570-F706 WeakPolarHBondContact OD1-CA 3.29Å; N570-F706 WeakPolarHBondContact OD1-CB 3.37Å; N570-F706 WeakPolarHBondContact OD1-CD1 3.26Å; N570-F706 WeakPolarHBondContact OD1-CG 3.38Å; N570-F706 PolarHBondContact OD1-O 2.84Å; L702-F706 HydrophobicContact CD1-CD1 4.29Å; L702-F706 HydrophobicContact CD1-CE1 3.74Å; L702-F706 HydrophobicContact CD1-CE2 4.03Å; L702-F706 HydrophobicContact CD1-CZ 3.6Å; L702-F706 HydrophobicContact CD2-CE2 3.8Å; L702-F706 HydrophobicContact CD2-CZ 3.91Å; L702-F706 HydrophobicContact CG-CD2 4.13Å; L702-F706 HydrophobicContact CG-CE1 4.31Å; L702-F706 HydrophobicContact CG-CE2 3.68Å; L702-F706 HydrophobicContact CG-CZ 3.79Å; L702-F706 PolarHBondContact O-N 2.91Å; V703-F706 PolarHBondContact O-N 3.49Å; A704-F706 PolarHBondContact O-N 3.26Å; F706-S708 PolarHBondContact O-N 3.31Å; F706-L709 HydrophobicContact CD1-CD1 4.37Å; F706-L709 WeakPolarHBondContact O-CB 3.09Å; F706-L709 PolarHBondContact O-N 3.13Å; F706-L709 VanDerWaalsContact O-N 3.14Å; F706-V710 PolarHBondContact O-N 3.38Å
707	H	92.3	Very high	94.3	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-59.9	-35.6	174.1	-60.4	159.9	0	0	0	112.1	N532 V703 A704 L709 V710 G711 T752 S756 I835	N532-H707 PolarHBondContact ND2-CD2 3.01Å; N532-H707 PolarHBondContact ND2-NE2 3.39Å; N532-H707 PolarHBondContact OD1-CD2 3.04Å; N532-H707 PolarHBondContact OD1-NE2 3.44Å; V703-H707 VanDerWaalsContact CG1-CE1 3.47Å; V703-H707 WeakPolarHBondContact CG1-CE1 3.44Å; V703-H707 PolarHBondContact O-N 3.23Å; V703-H707 VanDerWaalsContact O-N 3.12Å; A704-H707 PolarHBondContact O-N 2.9Å; H707-L709 VanDerWaalsContact C-N 3.32Å; H707-L709 PolarHBondContact O-N 2.92Å; H707-V710 PolarHBondContact O-N 2.96Å; H707-G711 PolarHBondContact O-N 3.11Å; H707-T752 HydrophobicContact CB-CG2 4.45Å; H707-S756 WeakPolarHBondContact CB-OG 3.47Å; H707-I835 PolarHBondContact CE1-O 3.25Å
708	S	96.1	Very high	94.8	Very high	9 Å²	9	12.7 Å²	12.7	6%	0.063	7%	0.072	C	C	.	.	H	α-helix	trans	-65.1	-38.4	178	83.1	0	0	0	0	111.7	A704 A705 F706 V710 G711 L712 F753	A704-S708 PolarHBondContact O-N 3.2Å; A705-S708 PolarHBondContact O-N 3.42Å; A705-S708 PolarHBondContact O-OG 2.69Å; F706-S708 PolarHBondContact O-N 3.31Å; S708-V710 PolarHBondContact O-N 2.93Å; S708-G711 PolarHBondContact O-N 3.48Å; S708-L712 WeakPolarHBondContact O-CB 3.39Å; S708-L712 PolarHBondContact O-N 2.93Å; S708-F753 WeakPolarHBondContact CB-O 3.3Å; S708-F753 WeakPolarHBondContact O-CD2 3.44Å
709	L	97.1	Very high	95.1	Very high	41 Å²	41	11 Å²	11	22%	0.215	6%	0.063	C	C	.	.	H	α-helix	trans	-63.5	-38.7	175.1	-60.7	-176.3	0	0	0	112.3	I566 V569 A705 F706 H707 A713	I566-L709 HydrophobicContact CB-CB 4.47Å; I566-L709 HydrophobicContact CB-CD2 4.39Å; I566-L709 WeakPolarHBondContact CD1-O 3.48Å; V569-L709 HydrophobicContact CB-CD1 4.16Å; V569-L709 HydrophobicContact CG1-CD1 3.92Å; A705-L709 PolarHBondContact O-N 2.75Å; F706-L709 HydrophobicContact CD1-CD1 4.37Å; F706-L709 WeakPolarHBondContact O-CB 3.09Å; F706-L709 PolarHBondContact O-N 3.13Å; F706-L709 VanDerWaalsContact O-N 3.14Å; H707-L709 VanDerWaalsContact C-N 3.32Å; H707-L709 PolarHBondContact O-N 2.92Å; L709-A713 WeakPolarHBondContact O-CB 3.13Å; L709-A713 PolarHBondContact O-N 3.27Å
710	V	96.8	Very high	95.5	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-64	-47.8	173.9	-174.8	0	0	0	0	110.9	S535 T538 N570 F706 H707 S708 L712 A713 A714 L846	S535-V710 WeakPolarHBondContact OG-CG2 3.25Å; T538-V710 HydrophobicContact CG2-CG1 3.9Å; N570-V710 WeakPolarHBondContact ND2-CG2 3.41Å; F706-V710 PolarHBondContact O-N 3.38Å; H707-V710 PolarHBondContact O-N 2.96Å; S708-V710 PolarHBondContact O-N 2.93Å; V710-L712 VanDerWaalsContact C-N 3.3Å; V710-L712 PolarHBondContact O-N 3.26Å; V710-A713 PolarHBondContact O-N 3.29Å; V710-A714 PolarHBondContact O-N 3.39Å; V710-L846 HydrophobicContact CG1-CD1 3.56Å
711	G	96.9	Very high	95.8	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-60	-40.7	179.4	0	0	0	0	0	112.5	H707 S708 V715 G749	H707-G711 PolarHBondContact O-N 3.11Å; S708-G711 PolarHBondContact O-N 3.48Å; G711-V715 WeakPolarHBondContact O-CG2 3.28Å; G711-V715 PolarHBondContact O-N 3.15Å; G711-G749 CarbonylContact C-O 3.5Å; G711-G749 WeakPolarHBondContact CA-O 3.43Å; G711-G749 CarbonylContact O-C 3.59Å; G711-G749 VanDerWaalsContact O-CA 3.3Å; G711-G749 WeakPolarHBondContact O-CA 3.23Å
712	L	98.1	Very high	96.1	Very high	49 Å²	49	10.9 Å²	10.9	26%	0.257	6%	0.063	S	C	.	.	H	α-helix	trans	-66.8	-44.2	175	-177.4	60.6	0	0	0	111.8	I566 S708 V710 A714 V715 L716 F753	I566-L712 HydrophobicContact CD1-CB 4.07Å; I566-L712 HydrophobicContact CD1-CD2 4.05Å; I566-L712 HydrophobicContact CD1-CG 3.96Å; S708-L712 WeakPolarHBondContact O-CB 3.39Å; S708-L712 PolarHBondContact O-N 2.93Å; V710-L712 VanDerWaalsContact C-N 3.3Å; V710-L712 PolarHBondContact O-N 3.26Å; L712-A714 VanDerWaalsContact C-N 3.31Å; L712-A714 PolarHBondContact O-N 3.41Å; L712-V715 PolarHBondContact O-N 3.46Å; L712-L716 HydrophobicContact CD1-CD1 4.43Å; L712-L716 HydrophobicContact CD1-CG 4.31Å; L712-L716 HydrophobicContact CG-CD1 4.03Å; L712-L716 HydrophobicContact CG-CG 4.37Å; L712-L716 VanDerWaalsContact O-CG 3.23Å; L712-L716 WeakPolarHBondContact O-CG 3.46Å; L712-L716 PolarHBondContact O-N 3.03Å; L712-F753 HydrophobicContact CB-CD2 3.85Å; L712-F753 HydrophobicContact CB-CE2 4.27Å; L712-F753 HydrophobicContact CB-CG 4.43Å; L712-F753 HydrophobicContact CD2-CE2 4.2Å
713	A	97.9	Very high	96.4	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-56.8	-45.9	176.9	0	0	0	0	0	111.4	T538 S563 I566 L709 V710 V715 L716 T717	T538-A713 HydrophobicContact CG2-CB 4.4Å; S563-A713 PolarHBondContact OG-O 3.45Å; I566-A713 HydrophobicContact CD1-CB 3.87Å; I566-A713 HydrophobicContact CG1-CB 4.01Å; L709-A713 WeakPolarHBondContact O-CB 3.13Å; L709-A713 PolarHBondContact O-N 3.27Å; V710-A713 PolarHBondContact O-N 3.29Å; A713-V715 PolarHBondContact O-N 2.87Å; A713-L716 WeakPolarHBondContact O-CB 3.22Å; A713-L716 PolarHBondContact O-N 3.32Å; A713-L716 VanDerWaalsContact O-N 3.17Å; A713-T717 PolarHBondContact O-N 3.3Å; A713-T717 PolarHBondContact O-OG1 3.4Å; A713-T717 VanDerWaalsContact O-OG1 3.13Å
714	A	97.6	Very high	96.6	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-61.3	-42.4	177.8	0	0	0	0	0	113	V710 L712 T717 C718 A845	V710-A714 PolarHBondContact O-N 3.39Å; L712-A714 VanDerWaalsContact C-N 3.31Å; L712-A714 PolarHBondContact O-N 3.41Å; A714-T717 PolarHBondContact O-N 3.45Å; A714-C718 WeakPolarHBondContact O-CB 3.45Å; A714-C718 PolarHBondContact O-N 3.19Å; A714-C718 PolarHBondContact O-SG 3.37Å; A714-A845 HydrophobicContact CB-CB 3.85Å
715	V	98.4	Very high	96.7	Very high	16 Å²	16	17.7 Å²	17.7	10%	0.097	10%	0.095	C	C	.	.	H	α-helix	trans	-61.1	-45.7	174	170.3	0	0	0	0	110.7	G711 L712 A713 C718 V719 T746	G711-V715 WeakPolarHBondContact O-CG2 3.28Å; G711-V715 PolarHBondContact O-N 3.15Å; L712-V715 PolarHBondContact O-N 3.46Å; A713-V715 PolarHBondContact O-N 2.87Å; V715-C718 PolarHBondContact O-N 2.87Å; V715-V719 HydrophobicContact CG1-CG2 4.42Å; V715-V719 WeakPolarHBondContact O-CB 3.36Å; V715-V719 VanDerWaalsContact O-CG2 3.29Å; V715-V719 WeakPolarHBondContact O-CG2 3.3Å; V715-V719 PolarHBondContact O-N 3.45Å; V715-T746 HydrophobicContact CG1-CG2 4.31Å; V715-T746 HydrophobicContact CG2-CG2 4.47Å; V715-T746 WeakPolarHBondContact CG2-O 3.45Å
716	L	98.4	Very high	96.8	Very high	17 Å²	17	19.7 Å²	19.7	9%	0.089	10%	0.098	C	C	.	.	H	α-helix	trans	-62.5	-44.4	179.7	-65.8	170.6	0	0	0	111.5	L559 L562 I566 L712 A713 A720	L559-L716 HydrophobicContact CB-CD2 4.44Å; L559-L716 HydrophobicContact CD2-CD2 3.65Å; L562-L716 HydrophobicContact CB-CD1 4.07Å; L562-L716 HydrophobicContact CD2-CD1 3.67Å; L562-L716 HydrophobicContact CD2-CD2 4.23Å; L562-L716 HydrophobicContact CG-CD1 3.68Å; I566-L716 HydrophobicContact CD1-CD1 4.03Å; L712-L716 HydrophobicContact CD1-CD1 4.43Å; L712-L716 HydrophobicContact CD1-CG 4.31Å; L712-L716 HydrophobicContact CG-CD1 4.03Å; L712-L716 HydrophobicContact CG-CG 4.37Å; L712-L716 VanDerWaalsContact O-CG 3.23Å; L712-L716 WeakPolarHBondContact O-CG 3.46Å; L712-L716 PolarHBondContact O-N 3.03Å; A713-L716 WeakPolarHBondContact O-CB 3.22Å; A713-L716 PolarHBondContact O-N 3.32Å; A713-L716 VanDerWaalsContact O-N 3.17Å; L716-A720 WeakPolarHBondContact O-CB 3.31Å; L716-A720 PolarHBondContact O-N 3.36Å
717	T	98	Very high	97	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.3	-51.7	176.9	-55.4	0	0	0	0	111	L545 S563 A713 A714 V719 A720 E721 E849 L853	L545-T717 HydrophobicContact CD1-CG2 3.62Å; S563-T717 PolarHBondContact OG-OG1 2.94Å; A713-T717 PolarHBondContact O-N 3.3Å; A713-T717 PolarHBondContact O-OG1 3.4Å; A713-T717 VanDerWaalsContact O-OG1 3.13Å; A714-T717 PolarHBondContact O-N 3.45Å; T717-V719 VanDerWaalsContact C-N 3.32Å; T717-V719 PolarHBondContact O-N 3.42Å; T717-A720 PolarHBondContact O-N 3.35Å; T717-E721 WeakPolarHBondContact O-CB 3.23Å; T717-E721 PolarHBondContact O-N 2.92Å; T717-E849 VanDerWaalsContact CB-OE1 3.29Å; T717-E849 WeakPolarHBondContact CB-OE1 3.46Å; T717-E849 HydrophobicContact CG2-CG 3.86Å; T717-E849 WeakPolarHBondContact CG2-OE1 3.47Å; T717-E849 PolarHBondContact OG1-OE1 3.45Å; T717-L853 HydrophobicContact CG2-CD1 4.3Å
718	C	98.1	Very high	97	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.9	-40.5	-176.7	-67	0	0	0	0	112.6	A714 V715 Y722 A742 T746 L852	A714-C718 WeakPolarHBondContact O-CB 3.45Å; A714-C718 PolarHBondContact O-N 3.19Å; A714-C718 PolarHBondContact O-SG 3.37Å; V715-C718 PolarHBondContact O-N 2.87Å; C718-Y722 PolarHBondContact O-N 3.28Å; C718-Y722 VanDerWaalsContact O-N 3.15Å; C718-A742 HydrophobicContact CB-CB 4.3Å; C718-A742 WeakPolarHBondContact CB-O 3.46Å; C718-T746 VanDerWaalsContact CB-OG1 3.3Å; C718-T746 WeakPolarHBondContact CB-OG1 3.13Å; C718-L852 HydrophobicContact CB-CD2 4.4Å
719	V	98	Very high	96.9	Very high	27 Å²	27	29.2 Å²	29.2	16%	0.164	15%	0.148	C	C	.	.	H	α-helix	trans	-70.1	-42.8	177	173.8	0	0	0	0	110.8	L559 V715 T717 E721 Y722 M723 I805	L559-V719 HydrophobicContact CD1-CG1 4.03Å; V715-V719 HydrophobicContact CG1-CG2 4.42Å; V715-V719 WeakPolarHBondContact O-CB 3.36Å; V715-V719 VanDerWaalsContact O-CG2 3.29Å; V715-V719 WeakPolarHBondContact O-CG2 3.3Å; V715-V719 PolarHBondContact O-N 3.45Å; T717-V719 VanDerWaalsContact C-N 3.32Å; T717-V719 PolarHBondContact O-N 3.42Å; V719-E721 PolarHBondContact O-N 2.91Å; V719-Y722 PolarHBondContact O-N 3.37Å; V719-M723 HydrophobicContact CG1-SD 4.09Å; V719-M723 VanDerWaalsContact O-CG 3.24Å; V719-M723 WeakPolarHBondContact O-CG 3.45Å; V719-M723 PolarHBondContact O-N 3Å; V719-M723 VanDerWaalsContact O-N 3.11Å; V719-I805 HydrophobicContact CG1-CD1 3.96Å
720	A	97.9	Very high	96.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.2	-44.5	178.2	0	0	0	0	0	111.9	L545 P556 L559 L716 T717 M723 I724	L545-A720 HydrophobicContact CD1-CB 4.04Å; P556-A720 HydrophobicContact CB-CB 4.04Å; L559-A720 HydrophobicContact CB-CB 4.02Å; L559-A720 HydrophobicContact CD1-CB 4.27Å; L716-A720 WeakPolarHBondContact O-CB 3.31Å; L716-A720 PolarHBondContact O-N 3.36Å; T717-A720 PolarHBondContact O-N 3.35Å; A720-M723 WeakPolarHBondContact O-CB 3.35Å; A720-M723 PolarHBondContact O-N 3.44Å; A720-I724 WeakPolarHBondContact O-CG1 3.37Å; A720-I724 PolarHBondContact O-N 3.48Å
721	E	97.6	Very high	96	Very high	14 Å²	14	37.7 Å²	37.7	7%	0.065	21%	0.212	C	C	.	.	H	α-helix	trans	-66.7	-41.2	179.8	-169.1	163.1	172.8	0	0	112.2	L545 T717 V719 M723 I724 E725 L852 L853	L545-E721 HydrophobicContact CD1-CB 3.88Å; L545-E721 HydrophobicContact CD2-CB 4.35Å; L545-E721 HydrophobicContact CD2-CG 4.32Å; T717-E721 WeakPolarHBondContact O-CB 3.23Å; T717-E721 PolarHBondContact O-N 2.92Å; V719-E721 PolarHBondContact O-N 2.91Å; E721-M723 PolarHBondContact O-N 3.45Å; E721-I724 PolarHBondContact O-N 3.21Å; E721-E725 HydrophobicContact CG-CG 4.29Å; E721-E725 WeakPolarHBondContact O-CB 3.27Å; E721-E725 PolarHBondContact O-N 3.49Å; E721-L852 HydrophobicContact CB-CD2 4.13Å; E721-L852 HydrophobicContact CG-CD2 4.3Å; E721-L852 HydrophobicContact CG-CG 4.33Å; E721-L852 WeakPolarHBondContact OE2-CD2 3.15Å; E721-L852 WeakPolarHBondContact OE2-CG 3.22Å; E721-L853 VanDerWaalsContact CD-CD2 3.41Å; E721-L853 WeakPolarHBondContact OE1-CD2 3.12Å; E721-L853 WeakPolarHBondContact OE2-CD2 3.32Å; E721-L853 WeakPolarHBondContact OE2-CG 3.45Å
722	Y	97.4	Very high	95.7	Very high	3 Å²	3	40.5 Å²	40.5	1%	0.012	23%	0.227	C	C	.	.	H	α-helix	trans	-56.4	-41.2	171.8	178	-93.2	0	0	0	111.7	C718 V719 Y726 F729 K739 Y795 Y801 G804 I805 L808	C718-Y722 PolarHBondContact O-N 3.28Å; C718-Y722 VanDerWaalsContact O-N 3.15Å; V719-Y722 PolarHBondContact O-N 3.37Å; Y722-Y726 HydrophobicContact CE1-CD2 4.36Å; Y722-Y726 AromaticContact CZ-CD2 3.94Å; Y722-Y726 VanDerWaalsContact O-CB 3.23Å; Y722-Y726 WeakPolarHBondContact O-CB 3.41Å; Y722-Y726 PolarHBondContact O-N 3.15Å; Y722-Y726 VanDerWaalsContact O-N 3.08Å; Y722-Y726 WeakPolarHBondContact OH-CD2 3.36Å; Y722-F729 AromaticContact CD2-CE2 3.74Å; Y722-F729 HydrophobicContact CD2-CE2 3.74Å; Y722-F729 HydrophobicContact CD2-CZ 4.06Å; Y722-F729 AromaticContact CE2-CE2 3.6Å; Y722-F729 HydrophobicContact CE2-CE2 3.6Å; Y722-F729 HydrophobicContact CE2-CZ 4.35Å; Y722-K739 HydrophobicContact CE2-CG 4.4Å; Y722-Y795 HydrophobicContact CD2-CE2 4.3Å; Y722-Y795 WeakPolarHBondContact CD2-OH 3.29Å; Y722-Y795 AromaticContact CE2-CE2 3.82Å; Y722-Y795 HydrophobicContact CE2-CE2 3.82Å; Y722-Y795 AromaticContact CE2-CZ 3.94Å; Y722-Y795 WeakPolarHBondContact CE2-OH 3.41Å; Y722-Y801 HydrophobicContact CE1-CD2 4.17Å; Y722-Y801 HydrophobicContact CE1-CE2 4.19Å; Y722-G804 WeakPolarHBondContact OH-CA 3.35Å; Y722-I805 HydrophobicContact CD1-CD1 4.12Å; Y722-I805 HydrophobicContact CE1-CB 4.31Å; Y722-I805 HydrophobicContact CE1-CD1 4.49Å; Y722-L808 HydrophobicContact CD1-CD1 3.75Å; Y722-L808 HydrophobicContact CD2-CD1 3.97Å; Y722-L808 HydrophobicContact CE1-CD1 4.49Å; Y722-L808 HydrophobicContact CG-CD1 3.46Å; Y722-L808 VanDerWaalsContact CG-CD1 3.46Å
723	M	97.3	Very high	95.2	Very high	42 Å²	42	43.5 Å²	43.5	21%	0.207	25%	0.25	C	C	.	.	H	α-helix	trans	-68.8	-36.5	178.8	-65.5	171.3	75.9	0	0	112.8	A555 P556 L559 V719 A720 E721 Y801 I805	A555-M723 HydrophobicContact CB-CE 3.77Å; P556-M723 HydrophobicContact CB-CB 4.11Å; P556-M723 HydrophobicContact CG-CB 4.22Å; L559-M723 HydrophobicContact CD1-SD 4.05Å; V719-M723 HydrophobicContact CG1-SD 4.09Å; V719-M723 VanDerWaalsContact O-CG 3.24Å; V719-M723 WeakPolarHBondContact O-CG 3.45Å; V719-M723 PolarHBondContact O-N 3Å; V719-M723 VanDerWaalsContact O-N 3.11Å; A720-M723 WeakPolarHBondContact O-CB 3.35Å; A720-M723 PolarHBondContact O-N 3.44Å; E721-M723 PolarHBondContact O-N 3.45Å; M723-Y801 WeakPolarHBondContact CE-OH 3.46Å; M723-Y801 HydrophobicContact CG-CE2 4.49Å; M723-I805 HydrophobicContact CG-CD1 4.06Å; M723-I805 HydrophobicContact SD-CD1 4.48Å
724	I	95.9	Very high	94.9	Very high	53 Å²	53	43.9 Å²	43.9	27%	0.272	25%	0.253	S	S	.	.	H	α-helix	trans	-72.5	-46.7	179.7	-71.1	164.9	0	0	0	110.9	L545 P556 A720 E721 P727	L545-I724 HydrophobicContact CB-CD1 4.04Å; L545-I724 HydrophobicContact CD2-CD1 3.88Å; L545-I724 HydrophobicContact CG-CD1 4.43Å; P556-I724 HydrophobicContact CB-CD1 3.86Å; P556-I724 HydrophobicContact CB-CG1 3.67Å; P556-I724 HydrophobicContact CG-CD1 4.4Å; P556-I724 HydrophobicContact CG-CG1 3.81Å; A720-I724 WeakPolarHBondContact O-CG1 3.37Å; A720-I724 PolarHBondContact O-N 3.48Å; E721-I724 PolarHBondContact O-N 3.21Å; I724-P727 WeakPolarHBondContact O-CD 3.44Å
725	E	95.4	Very high	94.7	Very high	66 Å²	66	44.3 Å²	44.3	31%	0.308	26%	0.256	S	S	.	.	H	α-helix	trans	-88.1	-8.4	-172.8	-68.3	-57.4	146.4	0	0	114.3	E721 P727 H728 F729	E721-E725 HydrophobicContact CG-CG 4.29Å; E721-E725 WeakPolarHBondContact O-CB 3.27Å; E721-E725 PolarHBondContact O-N 3.49Å; E725-P727 VanDerWaalsContact C-CD 3.42Å; E725-P727 VanDerWaalsContact C-N 3.34Å; E725-H728 WeakPolarHBondContact O-CB 3.45Å; E725-H728 PolarHBondContact O-N 3.21Å; E725-H728 IonicContact OE2-CE1 3.4Å; E725-H728 IonicContact OE2-CG 3.43Å; E725-H728 IonicContact OE2-ND1 3.48Å; E725-H728 PolarHBondContact OE2-ND1 3.44Å; E725-F729 HydrophobicContact CB-CE1 3.92Å; E725-F729 HydrophobicContact CB-CZ 4.11Å; E725-F729 PolarHBondContact O-N 3.44Å
726	Y	95.9	Very high	94.5	Very high	69 Å²	69	48 Å²	48	27%	0.271	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-48.6	-45.7	-179.6	175	-93.4	0	0	0	114.7	Y722 H728 F729 P799 Y801	Y722-Y726 HydrophobicContact CE1-CD2 4.36Å; Y722-Y726 AromaticContact CZ-CD2 3.94Å; Y722-Y726 VanDerWaalsContact O-CB 3.23Å; Y722-Y726 WeakPolarHBondContact O-CB 3.41Å; Y722-Y726 PolarHBondContact O-N 3.15Å; Y722-Y726 VanDerWaalsContact O-N 3.08Å; Y722-Y726 WeakPolarHBondContact OH-CD2 3.36Å; Y726-H728 PolarHBondContact O-N 3.42Å; Y726-F729 HydrophobicContact CD2-CD2 4.04Å; Y726-F729 HydrophobicContact CD2-CE2 4.27Å; Y726-F729 PolarHBondContact O-N 3.26Å; Y726-P799 VanDerWaalsContact CE2-O 3.23Å; Y726-P799 WeakPolarHBondContact CE2-O 3.33Å; Y726-P799 PolarHBondContact OH-O 3.24Å; Y726-Y801 AromaticContact CD1-CD2 3.73Å; Y726-Y801 HydrophobicContact CD1-CD2 3.73Å; Y726-Y801 HydrophobicContact CD1-CG 4.32Å; Y726-Y801 AromaticContact CD2-CD2 3.76Å; Y726-Y801 HydrophobicContact CD2-CD2 3.76Å; Y726-Y801 HydrophobicContact CD2-CG 4.49Å; Y726-Y801 HydrophobicContact CE1-CD2 4.13Å; Y726-Y801 HydrophobicContact CE1-CG 4.29Å; Y726-Y801 HydrophobicContact CE2-CD2 4.13Å; Y726-Y801 HydrophobicContact CE2-CG 4.42Å; Y726-Y801 VanDerWaalsContact CE2-N 3.29Å; Y726-Y801 AromaticContact CG-CD2 3.55Å; Y726-Y801 HydrophobicContact CG-CD2 3.55Å; Y726-Y801 HydrophobicContact CG-CE2 4.35Å; Y726-Y801 HydrophobicContact CG-CG 4.44Å; Y726-Y801 VanDerWaalsContact CZ-CA 3.45Å; Y726-Y801 PolarHBondContact OH-N 2.88Å
727	P	94.9	Very high	94.3	Very high	89 Å²	89	48.7 Å²	48.7	58%	0.578	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-62.9	-23.1	178.7	-21.7	34.9	0	0	0	113.9	I724 E725	I724-P727 WeakPolarHBondContact O-CD 3.44Å; E725-P727 VanDerWaalsContact C-CD 3.42Å; E725-P727 VanDerWaalsContact C-N 3.34Å
728	H	93.9	Very high	94.1	Very high	95 Å²	95	49.8 Å²	49.8	44%	0.44	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-89.7	-15.7	-175.5	-52.7	124.7	0	0	0	113.5	E725 Y726 A730 T731 D732	E725-H728 WeakPolarHBondContact O-CB 3.45Å; E725-H728 PolarHBondContact O-N 3.21Å; E725-H728 IonicContact OE2-CE1 3.4Å; E725-H728 IonicContact OE2-CG 3.43Å; E725-H728 IonicContact OE2-ND1 3.48Å; E725-H728 PolarHBondContact OE2-ND1 3.44Å; Y726-H728 PolarHBondContact O-N 3.42Å; H728-A730 PolarHBondContact O-N 3.03Å; H728-A730 VanDerWaalsContact O-N 3.1Å; H728-T731 PolarHBondContact O-N 2.96Å; H728-T731 PolarHBondContact O-OG1 3Å; H728-D732 PolarHBondContact O-N 3.22Å; H728-D732 VanDerWaalsContact O-N 3.16Å
729	F	92.9	Very high	94	Very high	32 Å²	32	50.4 Å²	50.4	14%	0.14	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-25.4	-177.5	-67.1	-29.6	0	0	0	114.5	Y722 E725 Y726 T731 A735 T738 K739	Y722-F729 AromaticContact CD2-CE2 3.74Å; Y722-F729 HydrophobicContact CD2-CE2 3.74Å; Y722-F729 HydrophobicContact CD2-CZ 4.06Å; Y722-F729 AromaticContact CE2-CE2 3.6Å; Y722-F729 HydrophobicContact CE2-CE2 3.6Å; Y722-F729 HydrophobicContact CE2-CZ 4.35Å; E725-F729 HydrophobicContact CB-CE1 3.92Å; E725-F729 HydrophobicContact CB-CZ 4.11Å; E725-F729 PolarHBondContact O-N 3.44Å; Y726-F729 HydrophobicContact CD2-CD2 4.04Å; Y726-F729 HydrophobicContact CD2-CE2 4.27Å; Y726-F729 PolarHBondContact O-N 3.26Å; F729-T731 PolarHBondContact O-N 3.47Å; F729-A735 HydrophobicContact CB-CB 3.89Å; F729-A735 HydrophobicContact CD1-CB 3.7Å; F729-A735 HydrophobicContact CG-CB 4.1Å; F729-A735 WeakPolarHBondContact O-CB 3.46Å; F729-T738 HydrophobicContact CE1-CG2 4.11Å; F729-K739 HydrophobicContact CD2-CD 4.25Å; F729-K739 HydrophobicContact CD2-CG 4.43Å; F729-K739 HydrophobicContact CE1-CG 4.42Å; F729-K739 HydrophobicContact CE2-CD 4.28Å; F729-K739 HydrophobicContact CE2-CG 4.02Å; F729-K739 HydrophobicContact CZ-CG 4.02Å
730	A	87.5	Confident	94	Very high	98 Å²	98	52.1 Å²	52.1	81%	0.81	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-25.6	178.1	0	0	0	0	0	113.1	H728	H728-A730 PolarHBondContact O-N 3.03Å; H728-A730 VanDerWaalsContact O-N 3.1Å
731	T	87.4	Confident	93.9	Very high	121 Å²	121	52.8 Å²	52.8	74%	0.742	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.1	-9.1	-173.2	50	0	0	0	0	113.9	H728 F729	H728-T731 PolarHBondContact O-N 2.96Å; H728-T731 PolarHBondContact O-OG1 3Å; F729-T731 PolarHBondContact O-N 3.47Å
732	D	90.2	Very high	93.9	Very high	59 Å²	59	52.2 Å²	52.2	32%	0.316	30%	0.298	S	S	.	.			trans	-92.9	116.8	-177.4	-179.2	11.4	0	0	0	112.1	H728 A734 A735	H728-D732 PolarHBondContact O-N 3.22Å; H728-D732 VanDerWaalsContact O-N 3.16Å; D732-A734 PolarHBondContact O-N 2.81Å; D732-A734 VanDerWaalsContact O-N 3.16Å; D732-A734 WeakPolarHBondContact OD1-CB 3.41Å; D732-A734 PolarHBondContact OD1-N 2.79Å; D732-A735 HydrophobicContact CB-CB 4.27Å; D732-A735 VanDerWaalsContact O-CB 3.24Å; D732-A735 WeakPolarHBondContact O-CB 3.4Å; D732-A735 PolarHBondContact O-N 3.37Å; D732-A735 VanDerWaalsContact O-N 3.08Å
733	P	88.1	Confident	94	Very high	113 Å²	113	52.5 Å²	52.5	73%	0.734	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-18.4	174.4	26.6	-35.2	0	0	0	113.7
734	A	92.6	Very high	94	Very high	8 Å²	8	54.5 Å²	54.5	7%	0.066	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	0.9	176.2	0	0	0	0	0	114.1	P494 D732 N736 L737 T738	P494-A734 HydrophobicContact CB-CB 4.22Å; P494-A734 HydrophobicContact CG-CB 4.2Å; D732-A734 PolarHBondContact O-N 2.81Å; D732-A734 VanDerWaalsContact O-N 3.16Å; D732-A734 WeakPolarHBondContact OD1-CB 3.41Å; D732-A734 PolarHBondContact OD1-N 2.79Å; A734-N736 PolarHBondContact O-N 2.97Å; A734-L737 WeakPolarHBondContact O-CB 3.42Å; A734-L737 PolarHBondContact O-N 2.96Å; A734-T738 PolarHBondContact O-N 2.9Å
735	A	92.4	Very high	94.1	Very high	8 Å²	8	52 Å²	52	7%	0.066	30%	0.297	C	S	.	.	H	α-helix	trans	-51	-40	-174.6	0	0	0	0	0	113.9	F729 D732 L737 T738 K739	F729-A735 HydrophobicContact CB-CB 3.89Å; F729-A735 HydrophobicContact CD1-CB 3.7Å; F729-A735 HydrophobicContact CG-CB 4.1Å; F729-A735 WeakPolarHBondContact O-CB 3.46Å; D732-A735 HydrophobicContact CB-CB 4.27Å; D732-A735 VanDerWaalsContact O-CB 3.24Å; D732-A735 WeakPolarHBondContact O-CB 3.4Å; D732-A735 PolarHBondContact O-N 3.37Å; D732-A735 VanDerWaalsContact O-N 3.08Å; A735-L737 PolarHBondContact O-N 3.28Å; A735-T738 PolarHBondContact O-N 2.9Å; A735-K739 WeakPolarHBondContact O-CB 3.44Å; A735-K739 WeakPolarHBondContact O-CG 3.27Å; A735-K739 PolarHBondContact O-N 3.3Å
736	N	94.4	Very high	94.2	Very high	94 Å²	94	48.8 Å²	48.8	50%	0.503	28%	0.282	S	S	.	.	H	α-helix	trans	-64.9	-37.4	178.9	-76	-28.9	0	0	0	112.8	A734 I740 M796	A734-N736 PolarHBondContact O-N 2.97Å; N736-I740 WeakPolarHBondContact O-CB 3.26Å; N736-I740 WeakPolarHBondContact O-CD1 3.34Å; N736-I740 WeakPolarHBondContact O-CG1 3.38Å; N736-I740 PolarHBondContact O-N 3.44Å; N736-M796 HydrophobicContact CB-CE 3.67Å; N736-M796 WeakPolarHBondContact OD1-CE 3.41Å
737	L	94.1	Very high	94.4	Very high	32 Å²	32	48 Å²	48	17%	0.168	28%	0.279	C	S	.	.	H	α-helix	trans	-65.9	-48.8	176.9	173.5	67.4	0	0	0	110.2	P494 F498 A734 A735 K739 I740 V741	P494-L737 HydrophobicContact CG-CB 3.88Å; P494-L737 HydrophobicContact CG-CD2 3.58Å; P494-L737 HydrophobicContact CG-CG 4.33Å; F498-L737 HydrophobicContact CB-CD2 3.89Å; F498-L737 HydrophobicContact CD2-CD1 3.78Å; F498-L737 HydrophobicContact CD2-CD2 3.49Å; F498-L737 VanDerWaalsContact CD2-CD2 3.49Å; F498-L737 HydrophobicContact CD2-CG 4.28Å; F498-L737 HydrophobicContact CE2-CD1 3.66Å; F498-L737 HydrophobicContact CE2-CD2 4.26Å; F498-L737 HydrophobicContact CG-CD2 3.87Å; F498-L737 HydrophobicContact CZ-CD1 4.41Å; A734-L737 WeakPolarHBondContact O-CB 3.42Å; A734-L737 PolarHBondContact O-N 2.96Å; A735-L737 PolarHBondContact O-N 3.28Å; L737-K739 VanDerWaalsContact C-N 3.29Å; L737-K739 PolarHBondContact O-N 3.26Å; L737-I740 PolarHBondContact O-N 3.07Å; L737-I740 VanDerWaalsContact O-N 3.16Å; L737-V741 HydrophobicContact CD1-CG2 3.84Å; L737-V741 HydrophobicContact CG-CG2 4.32Å; L737-V741 VanDerWaalsContact O-CG2 3.31Å; L737-V741 WeakPolarHBondContact O-CG2 3.35Å; L737-V741 PolarHBondContact O-N 3.11Å
738	T	94.2	Very high	94.5	Very high	23 Å²	23	45.5 Å²	45.5	14%	0.141	26%	0.26	C	S	.	.	H	α-helix	trans	-55.7	-46.1	177.6	-52.7	0	0	0	0	110.9	F729 A734 A735 V741 A742 L852	F729-T738 HydrophobicContact CE1-CG2 4.11Å; A734-T738 PolarHBondContact O-N 2.9Å; A735-T738 PolarHBondContact O-N 2.9Å; T738-V741 PolarHBondContact O-N 3.39Å; T738-A742 VanDerWaalsContact O-CB 3.32Å; T738-A742 WeakPolarHBondContact O-CB 3.46Å; T738-A742 PolarHBondContact O-N 3.42Å; T738-L852 HydrophobicContact CG2-CD1 3.61Å; T738-L852 WeakPolarHBondContact O-CD1 3.45Å
739	K	96.4	Very high	94.7	Very high	12 Å²	12	41 Å²	41	5%	0.052	24%	0.239	C	C	.	.	H	α-helix	trans	-59.2	-52	174.3	-74.9	-179.3	67.6	175.9	0	112.3	Y722 F729 A735 L737 V741 A742 Y743 Y795 M796	Y722-K739 HydrophobicContact CE2-CG 4.4Å; F729-K739 HydrophobicContact CD2-CD 4.25Å; F729-K739 HydrophobicContact CD2-CG 4.43Å; F729-K739 HydrophobicContact CE1-CG 4.42Å; F729-K739 HydrophobicContact CE2-CD 4.28Å; F729-K739 HydrophobicContact CE2-CG 4.02Å; F729-K739 HydrophobicContact CZ-CG 4.02Å; A735-K739 WeakPolarHBondContact O-CB 3.44Å; A735-K739 WeakPolarHBondContact O-CG 3.27Å; A735-K739 PolarHBondContact O-N 3.3Å; L737-K739 VanDerWaalsContact C-N 3.29Å; L737-K739 PolarHBondContact O-N 3.26Å; K739-V741 VanDerWaalsContact C-N 3.33Å; K739-V741 PolarHBondContact O-N 2.96Å; K739-A742 PolarHBondContact O-N 2.91Å; K739-Y743 WeakPolarHBondContact O-CB 3.47Å; K739-Y743 PolarHBondContact O-N 3.2Å; K739-Y795 HydrophobicContact CB-CE1 3.64Å; K739-Y795 WeakPolarHBondContact CE-O 3.35Å; K739-Y795 HydrophobicContact CG-CE1 4.29Å; K739-Y795 PolarHBondContact NZ-O 2.96Å; K739-Y795 WeakPolarHBondContact O-CE1 3.25Å; K739-M796 HydrophobicContact CB-SD 4.05Å
740	I	96.7	Very high	95	Very high	64 Å²	64	39.5 Å²	39.5	33%	0.328	23%	0.234	S	C	.	.	H	α-helix	trans	-57.3	-47.7	-179	-72.4	164.1	0	0	0	110.8	N736 L737 Y743 L744 M792 M796	N736-I740 WeakPolarHBondContact O-CB 3.26Å; N736-I740 WeakPolarHBondContact O-CD1 3.34Å; N736-I740 WeakPolarHBondContact O-CG1 3.38Å; N736-I740 PolarHBondContact O-N 3.44Å; L737-I740 PolarHBondContact O-N 3.07Å; L737-I740 VanDerWaalsContact O-N 3.16Å; I740-Y743 PolarHBondContact O-N 2.86Å; I740-L744 HydrophobicContact CG2-CD1 4.01Å; I740-L744 WeakPolarHBondContact O-CG 3.43Å; I740-L744 PolarHBondContact O-N 3.1Å; I740-M792 HydrophobicContact CG1-SD 4.46Å; I740-M792 HydrophobicContact CG2-CE 4.44Å; I740-M796 HydrophobicContact CD1-CE 3.95Å; I740-M796 HydrophobicContact CG1-CE 3.84Å; I740-M796 HydrophobicContact CG1-SD 3.87Å
741	V	97.1	Very high	95.5	Very high	13 Å²	13	35.3 Å²	35.3	8%	0.079	20%	0.198	C	C	.	.	H	α-helix	trans	-67	-41.4	-177.7	178.8	0	0	0	0	111.1	L737 T738 K739 Y743 L744 G745 A848 F851 L852	L737-V741 HydrophobicContact CD1-CG2 3.84Å; L737-V741 HydrophobicContact CG-CG2 4.32Å; L737-V741 VanDerWaalsContact O-CG2 3.31Å; L737-V741 WeakPolarHBondContact O-CG2 3.35Å; L737-V741 PolarHBondContact O-N 3.11Å; T738-V741 PolarHBondContact O-N 3.39Å; K739-V741 VanDerWaalsContact C-N 3.33Å; K739-V741 PolarHBondContact O-N 2.96Å; V741-Y743 VanDerWaalsContact C-N 3.33Å; V741-Y743 PolarHBondContact O-N 3.06Å; V741-L744 PolarHBondContact O-N 2.93Å; V741-G745 PolarHBondContact O-N 3.38Å; V741-A848 HydrophobicContact CG1-CB 4.13Å; V741-A848 WeakPolarHBondContact CG1-O 3.44Å; V741-F851 HydrophobicContact CG1-CB 3.79Å; V741-F851 HydrophobicContact CG2-CB 4.14Å; V741-L852 HydrophobicContact CB-CD1 4.17Å; V741-L852 HydrophobicContact CG1-CB 3.85Å; V741-L852 HydrophobicContact CG1-CD1 4.28Å
742	A	97.7	Very high	96	Very high	2 Å²	2	29.6 Å²	29.6	2%	0.017	16%	0.163	C	C	.	.	H	α-helix	trans	-61.1	-40.5	175.4	0	0	0	0	0	112.3	C718 T738 K739 T746 L852	C718-A742 HydrophobicContact CB-CB 4.3Å; C718-A742 WeakPolarHBondContact CB-O 3.46Å; T738-A742 VanDerWaalsContact O-CB 3.32Å; T738-A742 WeakPolarHBondContact O-CB 3.46Å; T738-A742 PolarHBondContact O-N 3.42Å; K739-A742 PolarHBondContact O-N 2.91Å; A742-T746 VanDerWaalsContact O-CB 3.31Å; A742-T746 WeakPolarHBondContact O-CB 3.37Å; A742-T746 PolarHBondContact O-N 3.06Å; A742-T746 PolarHBondContact O-OG1 3.38Å; A742-L852 HydrophobicContact CB-CD1 3.88Å; A742-L852 HydrophobicContact CB-CD2 4.2Å
743	Y	98.4	Very high	96.4	Very high	10 Å²	10	29.9 Å²	29.9	4%	0.039	16%	0.161	C	C	.	.	H	α-helix	trans	-64.5	-45.8	176.6	-167.5	-82.3	0	0	0	111.7	K739 I740 V741 T746 Y747 S788 G791 M792 Y795 L808 V811	K739-Y743 WeakPolarHBondContact O-CB 3.47Å; K739-Y743 PolarHBondContact O-N 3.2Å; I740-Y743 PolarHBondContact O-N 2.86Å; V741-Y743 VanDerWaalsContact C-N 3.33Å; V741-Y743 PolarHBondContact O-N 3.06Å; Y743-T746 PolarHBondContact O-N 3.22Å; Y743-Y747 PolarHBondContact O-N 2.99Å; Y743-S788 WeakPolarHBondContact CE1-O 3.4Å; Y743-S788 PolarHBondContact OH-O 3.27Å; Y743-G791 VanDerWaalsContact OH-C 3.3Å; Y743-G791 WeakPolarHBondContact OH-CA 3.09Å; Y743-M792 HydrophobicContact CD1-CE 3.31Å; Y743-M792 HydrophobicContact CD1-SD 3.9Å; Y743-M792 HydrophobicContact CD2-SD 4.19Å; Y743-M792 HydrophobicContact CE1-CB 4.35Å; Y743-M792 HydrophobicContact CE1-CE 4.04Å; Y743-M792 HydrophobicContact CE1-SD 4.46Å; Y743-M792 HydrophobicContact CG-CE 3.65Å; Y743-M792 HydrophobicContact CG-SD 3.74Å; Y743-M792 PolarHBondContact OH-N 3.26Å; Y743-Y795 AromaticContact CD2-CD1 3.67Å; Y743-Y795 HydrophobicContact CD2-CD1 3.67Å; Y743-Y795 HydrophobicContact CD2-CD2 4.38Å; Y743-Y795 AromaticContact CD2-CE1 3.99Å; Y743-Y795 HydrophobicContact CD2-CE1 3.99Å; Y743-Y795 AromaticContact CD2-CG 3.88Å; Y743-Y795 HydrophobicContact CD2-CG 3.88Å; Y743-Y795 HydrophobicContact CE2-CD1 4.43Å; Y743-Y795 HydrophobicContact CE2-CG 4.28Å; Y743-Y795 HydrophobicContact CG-CD1 4.28Å; Y743-Y795 HydrophobicContact CG-CE1 4.4Å; Y743-L808 HydrophobicContact CD2-CD2 4.14Å; Y743-V811 HydrophobicContact CD1-CG2 4.3Å; Y743-V811 HydrophobicContact CD2-CG1 4.11Å; Y743-V811 HydrophobicContact CE1-CB 4.09Å; Y743-V811 HydrophobicContact CE1-CG1 4.34Å; Y743-V811 HydrophobicContact CE1-CG2 3.57Å; Y743-V811 HydrophobicContact CE2-CB 3.88Å; Y743-V811 HydrophobicContact CE2-CG1 3.83Å; Y743-V811 HydrophobicContact CE2-CG2 4.31Å; Y743-V811 HydrophobicContact CG-CG1 4.46Å; Y743-V811 WeakPolarHBondContact OH-CB 3.33Å
744	L	98	Very high	96.8	Very high	83 Å²	83	24.9 Å²	24.9	44%	0.435	13%	0.129	S	C	.	.	H	α-helix	trans	-66.2	-44.1	178.2	-67.9	176.2	0	0	0	111.9	I740 V741 T746 Y747 I748 M792	I740-L744 HydrophobicContact CG2-CD1 4.01Å; I740-L744 WeakPolarHBondContact O-CG 3.43Å; I740-L744 PolarHBondContact O-N 3.1Å; V741-L744 PolarHBondContact O-N 2.93Å; L744-T746 VanDerWaalsContact C-N 3.32Å; L744-T746 PolarHBondContact O-N 3.4Å; L744-Y747 PolarHBondContact O-N 3.05Å; L744-I748 VanDerWaalsContact O-CG1 3.28Å; L744-I748 WeakPolarHBondContact O-CG1 3.34Å; L744-I748 PolarHBondContact O-N 3.21Å; L744-M792 HydrophobicContact CD2-CE 4.39Å; L744-M792 HydrophobicContact CG-CE 4.41Å
745	G	97.8	Very high	97	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.3	-41.8	175.6	0	0	0	0	0	112.1	V741 I748 G749	V741-G745 PolarHBondContact O-N 3.38Å; G745-I748 PolarHBondContact O-N 3.43Å; G745-G749 PolarHBondContact O-N 3.04Å
746	T	98.5	Very high	97.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.1	-43.4	174.9	-58.6	0	0	0	0	111.9	V715 C718 A742 Y743 L744 G750 V811	V715-T746 HydrophobicContact CG1-CG2 4.31Å; V715-T746 HydrophobicContact CG2-CG2 4.47Å; V715-T746 WeakPolarHBondContact CG2-O 3.45Å; C718-T746 VanDerWaalsContact CB-OG1 3.3Å; C718-T746 WeakPolarHBondContact CB-OG1 3.13Å; A742-T746 VanDerWaalsContact O-CB 3.31Å; A742-T746 WeakPolarHBondContact O-CB 3.37Å; A742-T746 PolarHBondContact O-N 3.06Å; A742-T746 PolarHBondContact O-OG1 3.38Å; Y743-T746 PolarHBondContact O-N 3.22Å; L744-T746 VanDerWaalsContact C-N 3.32Å; L744-T746 PolarHBondContact O-N 3.4Å; T746-G750 PolarHBondContact O-N 2.99Å; T746-V811 HydrophobicContact CG2-CG1 3.87Å
747	Y	98.6	Very high	97.4	Very high	51 Å²	51	24 Å²	24	20%	0.2	12%	0.122	C	C	.	.	H	α-helix	trans	-63.4	-50.4	177.1	175.5	-96	0	0	0	111.9	Y743 L744 G749 G750 V751 V811 S815 M818	Y743-Y747 PolarHBondContact O-N 2.99Å; L744-Y747 PolarHBondContact O-N 3.05Å; Y747-G749 PolarHBondContact O-N 3.13Å; Y747-G750 PolarHBondContact O-N 2.67Å; Y747-V751 HydrophobicContact CE1-CG2 4.24Å; Y747-V751 HydrophobicContact CE2-CG2 4.33Å; Y747-V751 WeakPolarHBondContact O-CG2 3.37Å; Y747-V751 PolarHBondContact O-N 3.38Å; Y747-V811 HydrophobicContact CD2-CG2 3.81Å; Y747-V811 HydrophobicContact CG-CG2 4.32Å; Y747-S815 VanDerWaalsContact O-CB 3.23Å; Y747-S815 WeakPolarHBondContact O-CB 3.38Å; Y747-M818 HydrophobicContact CE2-CE 3.8Å; Y747-M818 HydrophobicContact CE2-SD 4.32Å; Y747-M818 WeakPolarHBondContact OH-CE 3.49Å; Y747-M818 PolarHBondContact OH-SD 3.42Å
748	I	98.1	Very high	97.6	Very high	37 Å²	37	23.3 Å²	23.3	19%	0.19	12%	0.119	C	C	.	.	H	α-helix	trans	-63.3	-44.5	-179	-63.3	166.2	0	0	0	110.2	L744 G745 G750 V751 T752 Y841 W844 A845	L744-I748 VanDerWaalsContact O-CG1 3.28Å; L744-I748 WeakPolarHBondContact O-CG1 3.34Å; L744-I748 PolarHBondContact O-N 3.21Å; G745-I748 PolarHBondContact O-N 3.43Å; I748-G750 PolarHBondContact O-N 3.19Å; I748-V751 PolarHBondContact O-N 3.47Å; I748-T752 WeakPolarHBondContact O-CB 3.49Å; I748-T752 PolarHBondContact O-N 3.24Å; I748-T752 PolarHBondContact O-OG1 3.29Å; I748-Y841 VanDerWaalsContact CG2-O 3.26Å; I748-Y841 WeakPolarHBondContact CG2-O 3.3Å; I748-W844 HydrophobicContact CD1-CB 4.44Å; I748-A845 HydrophobicContact CG2-CB 3.99Å
749	G	97.9	Very high	97.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-62.1	-41.9	177.7	0	0	0	0	0	112.6	G711 G745 Y747 T752 F753	G711-G749 CarbonylContact C-O 3.5Å; G711-G749 WeakPolarHBondContact CA-O 3.43Å; G711-G749 CarbonylContact O-C 3.59Å; G711-G749 VanDerWaalsContact O-CA 3.3Å; G711-G749 WeakPolarHBondContact O-CA 3.23Å; G745-G749 PolarHBondContact O-N 3.04Å; Y747-G749 PolarHBondContact O-N 3.13Å; G749-T752 PolarHBondContact O-N 3.31Å; G749-F753 WeakPolarHBondContact O-CB 3.27Å; G749-F753 PolarHBondContact O-N 3.28Å
750	G	98.2	Very high	97.6	Very high	2 Å²	2	25.3 Å²	25.3	2%	0.021	12%	0.124	C	C	.	.	H	α-helix	trans	-64.6	-43.9	177.4	0	0	0	0	0	113.7	T746 Y747 I748 T752 S754 S815	T746-G750 PolarHBondContact O-N 2.99Å; Y747-G750 PolarHBondContact O-N 2.67Å; I748-G750 PolarHBondContact O-N 3.19Å; G750-T752 VanDerWaalsContact C-N 3.33Å; G750-S754 PolarHBondContact O-N 3.41Å; G750-S754 PolarHBondContact O-OG 3.33Å; G750-S815 WeakPolarHBondContact CA-OG 3.49Å
751	V	98.1	Very high	97.6	Very high	10 Å²	10	22.5 Å²	22.5	6%	0.061	11%	0.111	C	C	.	.	H	α-helix	trans	-61.3	-44.7	172.9	175.5	0	0	0	0	110.5	Y747 I748 G755 Y841	Y747-V751 HydrophobicContact CE1-CG2 4.24Å; Y747-V751 HydrophobicContact CE2-CG2 4.33Å; Y747-V751 WeakPolarHBondContact O-CG2 3.37Å; Y747-V751 PolarHBondContact O-N 3.38Å; I748-V751 PolarHBondContact O-N 3.47Å; V751-G755 PolarHBondContact O-N 2.88Å; V751-Y841 HydrophobicContact CG1-CD2 4.11Å; V751-Y841 HydrophobicContact CG1-CE2 4.02Å
752	T	97.9	Very high	97.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.2	-45.5	-177.9	-55.5	0	0	0	0	111.4	H707 I748 G749 G750 S756 Y841	H707-T752 HydrophobicContact CB-CG2 4.45Å; I748-T752 WeakPolarHBondContact O-CB 3.49Å; I748-T752 PolarHBondContact O-N 3.24Å; I748-T752 PolarHBondContact O-OG1 3.29Å; G749-T752 PolarHBondContact O-N 3.31Å; G750-T752 VanDerWaalsContact C-N 3.33Å; T752-S756 WeakPolarHBondContact O-CB 3.4Å; T752-S756 PolarHBondContact O-N 2.9Å; T752-S756 VanDerWaalsContact O-N 3.08Å; T752-S756 PolarHBondContact O-OG 3.35Å; T752-Y841 VanDerWaalsContact OG1-CB 3.26Å; T752-Y841 WeakPolarHBondContact OG1-CB 3.24Å
753	F	98.3	Very high	97.1	Very high	65 Å²	65	23 Å²	23	29%	0.285	11%	0.112	S	C	.	.	H	α-helix	trans	-57.5	-57.5	178.9	171.3	-112.5	0	0	0	111.8	S708 L712 G749 L757	S708-F753 WeakPolarHBondContact CB-O 3.3Å; S708-F753 WeakPolarHBondContact O-CD2 3.44Å; L712-F753 HydrophobicContact CB-CD2 3.85Å; L712-F753 HydrophobicContact CB-CE2 4.27Å; L712-F753 HydrophobicContact CB-CG 4.43Å; L712-F753 HydrophobicContact CD2-CE2 4.2Å; G749-F753 WeakPolarHBondContact O-CB 3.27Å; G749-F753 PolarHBondContact O-N 3.28Å; F753-L757 PolarHBondContact O-N 3.05Å
754	S	98.1	Very high	96.8	Very high	9 Å²	9	26.7 Å²	26.7	6%	0.063	13%	0.13	C	C	.	.	H	α-helix	trans	-76.2	-38.3	-172.2	73.4	0	0	0	0	112.8	G750 S756 L757 V758 A816 G819 V820	G750-S754 PolarHBondContact O-N 3.41Å; G750-S754 PolarHBondContact O-OG 3.33Å; S754-S756 VanDerWaalsContact C-N 3.32Å; S754-S756 PolarHBondContact O-N 2.95Å; S754-L757 PolarHBondContact O-N 3.38Å; S754-V758 WeakPolarHBondContact O-CG2 3.35Å; S754-V758 PolarHBondContact O-N 3.24Å; S754-V758 VanDerWaalsContact O-N 3.09Å; S754-A816 WeakPolarHBondContact CB-O 3.42Å; S754-A816 WeakPolarHBondContact OG-CA 3.45Å; S754-A816 PolarHBondContact OG-O 3.06Å; S754-G819 WeakPolarHBondContact OG-CA 3.49Å; S754-V820 PolarHBondContact OG-N 3.32Å
755	G	97	Very high	96.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61	-44	175.8	0	0	0	0	0	111.4	V751 L757 V758 A759 T823 L838	V751-G755 PolarHBondContact O-N 2.88Å; G755-L757 VanDerWaalsContact C-N 3.31Å; G755-L757 PolarHBondContact O-N 3.03Å; G755-V758 PolarHBondContact O-N 3.4Å; G755-A759 PolarHBondContact O-N 2.93Å; G755-T823 VanDerWaalsContact CA-OG1 3.31Å; G755-T823 WeakPolarHBondContact CA-OG1 3.37Å; G755-T823 WeakPolarHBondContact O-CG2 3.44Å; G755-L838 VanDerWaalsContact C-CD1 3.49Å
756	S	97.2	Very high	96.3	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	17%	0.167	C	C	.	.	H	α-helix	trans	-66.3	-34.4	179.3	-62.8	0	0	0	0	112.3	A704 H707 T752 S754 A759 Y760 L838	A704-S756 VanDerWaalsContact O-CB 3.28Å; A704-S756 WeakPolarHBondContact O-CB 3.15Å; H707-S756 WeakPolarHBondContact CB-OG 3.47Å; T752-S756 WeakPolarHBondContact O-CB 3.4Å; T752-S756 PolarHBondContact O-N 2.9Å; T752-S756 VanDerWaalsContact O-N 3.08Å; T752-S756 PolarHBondContact O-OG 3.35Å; S754-S756 VanDerWaalsContact C-N 3.32Å; S754-S756 PolarHBondContact O-N 2.95Å; S756-A759 PolarHBondContact O-N 2.93Å; S756-Y760 WeakPolarHBondContact O-CB 3.45Å; S756-Y760 PolarHBondContact O-N 3.02Å; S756-L838 WeakPolarHBondContact OG-CD1 3.5Å
757	L	97.7	Very high	96.1	Very high	91 Å²	91	35 Å²	35	48%	0.476	19%	0.187	S	C	.	.	H	α-helix	trans	-68.3	-37.7	175.8	-163	68.3	0	0	0	112.3	F753 S754 G755 G761	F753-L757 PolarHBondContact O-N 3.05Å; S754-L757 PolarHBondContact O-N 3.38Å; G755-L757 VanDerWaalsContact C-N 3.31Å; G755-L757 PolarHBondContact O-N 3.03Å; L757-G761 PolarHBondContact O-N 2.98Å
758	V	97	Very high	95.7	Very high	16 Å²	16	38.4 Å²	38.4	10%	0.097	21%	0.209	C	C	.	.	H	α-helix	trans	-67.9	-41.8	172.8	177.1	0	0	0	0	110.9	S754 G755 G761 K762 L767 V820 T823 A824	S754-V758 WeakPolarHBondContact O-CG2 3.35Å; S754-V758 PolarHBondContact O-N 3.24Å; S754-V758 VanDerWaalsContact O-N 3.09Å; G755-V758 PolarHBondContact O-N 3.4Å; V758-G761 PolarHBondContact O-N 3.49Å; V758-K762 PolarHBondContact O-N 3.07Å; V758-L767 HydrophobicContact CG1-CD1 4.08Å; V758-V820 HydrophobicContact CG2-CB 4.29Å; V758-V820 HydrophobicContact CG2-CG1 4.15Å; V758-V820 HydrophobicContact CG2-CG2 4Å; V758-T823 HydrophobicContact CB-CG2 3.94Å; V758-T823 HydrophobicContact CG1-CG2 3.84Å; V758-A824 HydrophobicContact CG1-CB 4.31Å
759	A	95.3	Very high	95.1	Very high	1 Å²	1	40 Å²	40	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-59.2	-47.5	175.1	0	0	0	0	0	111.3	A704 G755 S756 G761 K762 L763 T823 M831	A704-A759 HydrophobicContact CB-CB 4.31Å; G755-A759 PolarHBondContact O-N 2.93Å; S756-A759 PolarHBondContact O-N 2.93Å; A759-G761 PolarHBondContact O-N 3.37Å; A759-K762 PolarHBondContact O-N 3.13Å; A759-L763 WeakPolarHBondContact O-CB 3.36Å; A759-L763 VanDerWaalsContact O-CG 3.28Å; A759-L763 WeakPolarHBondContact O-CG 3.43Å; A759-L763 PolarHBondContact O-N 3.48Å; A759-T823 HydrophobicContact CB-CG2 4.31Å; A759-M831 HydrophobicContact CB-CG 4.41Å; A759-M831 HydrophobicContact CB-SD 3.61Å
760	Y	96.2	Very high	94.4	Very high	76 Å²	76	42.3 Å²	42.3	30%	0.298	24%	0.242	S	C	.	.	H	α-helix	trans	-53.3	-52	171.4	168.8	-96	0	0	0	111.5	Q701 A705 S756 K762 L763 Q764 I766	Q701-Y760 HydrophobicContact CB-CD2 3.73Å; Q701-Y760 HydrophobicContact CB-CE2 4.03Å; Q701-Y760 HydrophobicContact CG-CD2 4.5Å; Q701-Y760 HydrophobicContact CG-CE2 4.33Å; Q701-Y760 WeakPolarHBondContact O-CD2 3.45Å; A705-Y760 HydrophobicContact CB-CD2 4.22Å; S756-Y760 WeakPolarHBondContact O-CB 3.45Å; S756-Y760 PolarHBondContact O-N 3.02Å; Y760-K762 VanDerWaalsContact C-N 3.3Å; Y760-K762 PolarHBondContact O-N 3.46Å; Y760-L763 PolarHBondContact O-N 3.41Å; Y760-Q764 VanDerWaalsContact O-CB 3.23Å; Y760-Q764 WeakPolarHBondContact O-CB 3.31Å; Y760-Q764 PolarHBondContact O-N 3.09Å; Y760-I766 HydrophobicContact CE1-CD1 3.96Å
761	G	95.8	Very high	93.9	Very high	5 Å²	5	45.3 Å²	45.3	5%	0.052	26%	0.261	C	S	.	.	H	α-helix	trans	-58.9	-39	-178.9	0	0	0	0	0	113.3	L757 V758 A759 G765 I766 L767	L757-G761 PolarHBondContact O-N 2.98Å; V758-G761 PolarHBondContact O-N 3.49Å; A759-G761 PolarHBondContact O-N 3.37Å; G761-G765 PolarHBondContact O-N 3.11Å; G761-I766 PolarHBondContact O-N 2.77Å; G761-L767 PolarHBondContact O-N 2.81Å
762	K	93.3	Very high	93.5	Very high	15 Å²	15	50 Å²	50	7%	0.065	29%	0.286	C	S	.	.	H	α-helix	trans	-72.4	-41.9	177.1	-75.2	-168.8	174.1	-142.8	0	112.9	V758 A759 Y760 G765 L767 A770 A824 I826 M831	V758-K762 PolarHBondContact O-N 3.07Å; A759-K762 PolarHBondContact O-N 3.13Å; Y760-K762 VanDerWaalsContact C-N 3.3Å; Y760-K762 PolarHBondContact O-N 3.46Å; K762-G765 PolarHBondContact O-N 2.94Å; K762-L767 HydrophobicContact CG-CB 3.85Å; K762-L767 HydrophobicContact CG-CD1 4.34Å; K762-A770 PolarHBondContact NZ-O 3.38Å; K762-A824 PolarHBondContact NZ-O 3.32Å; K762-I826 PolarHBondContact NZ-O 2.93Å; K762-M831 HydrophobicContact CB-CE 4.13Å; K762-M831 HydrophobicContact CD-CE 3.5Å; K762-M831 HydrophobicContact CG-CE 4.39Å
763	L	91.4	Very high	93	Very high	12 Å²	12	54 Å²	54	6%	0.063	31%	0.306	C	S	.	.	H	α-helix	trans	-68	-38.9	179.5	-69.1	165.3	0	0	0	112.1	P700 Q701 A759 Y760 G765 M831 I835 R968	P700-L763 HydrophobicContact CB-CD1 4.14Å; Q701-L763 HydrophobicContact CB-CB 4.15Å; A759-L763 WeakPolarHBondContact O-CB 3.36Å; A759-L763 VanDerWaalsContact O-CG 3.28Å; A759-L763 WeakPolarHBondContact O-CG 3.43Å; A759-L763 PolarHBondContact O-N 3.48Å; Y760-L763 PolarHBondContact O-N 3.41Å; L763-G765 PolarHBondContact O-N 3.34Å; L763-M831 HydrophobicContact CD1-CG 4.11Å; L763-M831 HydrophobicContact CD2-CB 4.18Å; L763-M831 HydrophobicContact CD2-CG 3.85Å; L763-M831 HydrophobicContact CG-CG 3.84Å; L763-I835 HydrophobicContact CD1-CD1 3.56Å; L763-I835 HydrophobicContact CD1-CG1 4.26Å; L763-R968 PolarHBondContact O-NH1 2.97Å
764	Q	92.8	Very high	92.6	Very high	87 Å²	87	54.6 Å²	54.6	41%	0.407	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-16.1	177	-167.4	60.8	27.8	0	0	112.8	Y760 I766	Y760-Q764 VanDerWaalsContact O-CB 3.23Å; Y760-Q764 WeakPolarHBondContact O-CB 3.31Å; Y760-Q764 PolarHBondContact O-N 3.09Å; Q764-I766 VanDerWaalsContact C-N 3.35Å; Q764-I766 HydrophobicContact CB-CD1 4.13Å; Q764-I766 HydrophobicContact CB-CG1 4.13Å; Q764-I766 HydrophobicContact CG-CD1 3.81Å; Q764-I766 HydrophobicContact CG-CG1 3.9Å
765	G	90.6	Very high	92.2	Very high	60 Å²	60	60.4 Å²	60.4	62%	0.619	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	14.5	-176.3	0	0	0	0	0	114.4	G761 K762 L763	G761-G765 PolarHBondContact O-N 3.11Å; K762-G765 PolarHBondContact O-N 2.94Å; L763-G765 PolarHBondContact O-N 3.34Å
766	I	94.6	Very high	91.8	Very high	116 Å²	116	63 Å²	63	60%	0.595	38%	0.377	S	S	*	.	S	Bend	trans	-71.5	-38.8	171.6	-60.3	169.5	0	0	0	109.6	Y760 G761 Q764	Y760-I766 HydrophobicContact CE1-CD1 3.96Å; G761-I766 PolarHBondContact O-N 2.77Å; Q764-I766 VanDerWaalsContact C-N 3.35Å; Q764-I766 HydrophobicContact CB-CD1 4.13Å; Q764-I766 HydrophobicContact CB-CG1 4.13Å; Q764-I766 HydrophobicContact CG-CD1 3.81Å; Q764-I766 HydrophobicContact CG-CG1 3.9Å
767	L	93.7	Very high	91.5	Very high	80 Å²	80	65.2 Å²	65.2	42%	0.419	39%	0.385	S	S	.	.	S	Bend	trans	-102.7	152	173.5	-62.4	174.5	0	0	0	110.3	V758 G761 K762 S769	V758-L767 HydrophobicContact CG1-CD1 4.08Å; G761-L767 PolarHBondContact O-N 2.81Å; K762-L767 HydrophobicContact CG-CB 3.85Å; K762-L767 HydrophobicContact CG-CD1 4.34Å; L767-S769 PolarHBondContact O-N 3.15Å
768	N	90.1	Very high	91.1	Very high	124 Å²	124	65.5 Å²	65.5	66%	0.663	38%	0.384	S	S	*	.			trans	-63.5	132	174.5	-167.7	-20.3	0	0	0	110.4	A770	N768-A770 PolarHBondContact O-N 3.38Å; N768-A770 PolarHBondContact OD1-N 3.33Å
769	S	85.2	Confident	90.9	Very high	71 Å²	71	68.3 Å²	68.3	50%	0.497	41%	0.408	S	S	.	.	S	Bend	trans	-67.1	-18.2	177.5	67.2	0	0	0	0	113.8	L767 G827 G828	L767-S769 PolarHBondContact O-N 3.15Å; S769-G827 CarbonylContact O-C 3.59Å; S769-G828 PolarHBondContact O-N 3.21Å
770	A	84.6	Confident	90.9	Very high	47 Å²	47	71.9 Å²	71.9	39%	0.388	43%	0.427	S	S	.	.	S	Bend	trans	-63.3	148.1	174.3	0	0	0	0	0	111.8	K762 N768 L772	K762-A770 PolarHBondContact NZ-O 3.38Å; N768-A770 PolarHBondContact O-N 3.38Å; N768-A770 PolarHBondContact OD1-N 3.33Å; A770-L772 PolarHBondContact O-N 3.49Å
771	P	87.4	Confident	90.8	Very high	65 Å²	65	69.1 Å²	69.1	42%	0.422	42%	0.417	S	S	.	.			trans	-67.1	125.6	173.1	28	-33.4	0	0	0	110.3	L773 A825	P771-L773 HydrophobicContact CB-CD2 4.14Å; P771-L773 PolarHBondContact O-N 2.9Å; P771-A825 WeakPolarHBondContact CB-O 3.36Å
772	L	89.4	Confident	90.7	Very high	110 Å²	110	71.7 Å²	71.7	58%	0.576	44%	0.438	S	S	*	.			trans	-87.2	106.1	175.5	179.7	65.5	0	0	0	109.4	A770 A824 A825	A770-L772 PolarHBondContact O-N 3.49Å; L772-A824 HydrophobicContact CB-CB 4.43Å; L772-A824 PolarHBondContact N-O 2.97Å; L772-A825 WeakPolarHBondContact O-CA 3.38Å
773	L	87.1	Confident	90.9	Very high	82 Å²	82	72.9 Å²	72.9	43%	0.429	45%	0.454	S	S	.	.			trans	-98.7	105.2	-176.1	-55.1	-175	0	0	0	111.1	P771 A825	P771-L773 HydrophobicContact CB-CD2 4.14Å; P771-L773 PolarHBondContact O-N 2.9Å; L773-A825 HydrophobicContact CD2-CB 4.43Å
774	L	89.3	Confident	91.2	Very high	78 Å²	78	73.1 Å²	73.1	41%	0.408	46%	0.456	S	S	.	.			trans	-74.7	142	173.6	-65.2	170.1	0	0	0	111.4	G776 R777 L780 T821	L774-G776 PolarHBondContact O-N 2.83Å; L774-R777 HydrophobicContact CB-CB 4.29Å; L774-R777 WeakPolarHBondContact O-CB 3.33Å; L774-R777 PolarHBondContact O-N 2.93Å; L774-L780 HydrophobicContact CD1-CD2 4.16Å; L774-T821 HydrophobicContact CD1-CG2 4.47Å
775	P	91.1	Very high	91.3	Very high	131 Å²	131	72.9 Å²	72.9	85%	0.851	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	129.5	169.7	-22.9	33.4	0	0	0	110.8	R777	P775-R777 VanDerWaalsContact C-N 3.3Å; P775-R777 PolarHBondContact O-N 2.9Å
776	G	88.9	Confident	91.7	Very high	55 Å²	55	73 Å²	73	57%	0.567	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	21.3	179.5	0	0	0	0	0	115.4	L774 H778 A779 L780	L774-G776 PolarHBondContact O-N 2.83Å; G776-H778 PolarHBondContact O-N 3.32Å; G776-A779 WeakPolarHBondContact O-CB 3.34Å; G776-A779 PolarHBondContact O-N 3.26Å; G776-L780 PolarHBondContact O-N 2.85Å; G776-L780 VanDerWaalsContact O-N 3.09Å
777	R	89.4	Confident	91.8	Very high	47 Å²	47	69.8 Å²	69.8	18%	0.177	44%	0.443	C	S	.	.	H	α-helix	trans	-48.3	-36.6	-175.7	71.4	-177.8	-168.9	-111.9	8.5	115.3	L774 P775 L780 N781 L889 G890	L774-R777 HydrophobicContact CB-CB 4.29Å; L774-R777 WeakPolarHBondContact O-CB 3.33Å; L774-R777 PolarHBondContact O-N 2.93Å; P775-R777 VanDerWaalsContact C-N 3.3Å; P775-R777 PolarHBondContact O-N 2.9Å; R777-L780 PolarHBondContact O-N 3.4Å; R777-N781 WeakPolarHBondContact O-CB 3.47Å; R777-N781 VanDerWaalsContact O-CG 3.3Å; R777-N781 PolarHBondContact O-N 3.01Å; R777-N781 PolarHBondContact O-ND2 2.8Å; R777-L889 PolarHBondContact NH2-O 3.48Å; R777-G890 PolarHBondContact NH2-O 3.44Å
778	H	90.1	Very high	92	Very high	98 Å²	98	66.1 Å²	66.1	45%	0.454	42%	0.424	S	S	.	.	H	α-helix	trans	-69	-40.3	-179.8	-63.2	-66.6	0	0	0	111.6	G776 N781 A782 L889	G776-H778 PolarHBondContact O-N 3.32Å; H778-N781 PolarHBondContact O-N 3.02Å; H778-A782 WeakPolarHBondContact O-CB 3.34Å; H778-A782 PolarHBondContact O-N 2.84Å; H778-L889 PolarHBondContact CE1-O 3.17Å
779	A	93.6	Very high	92.3	Very high	74 Å²	74	65 Å²	65	61%	0.612	42%	0.421	S	S	*	.	H	α-helix	trans	-66.4	-40.2	174.3	0	0	0	0	0	111.2	G776 G783	G776-A779 WeakPolarHBondContact O-CB 3.34Å; G776-A779 PolarHBondContact O-N 3.26Å; A779-G783 PolarHBondContact O-N 3.38Å
780	L	94.3	Very high	92.9	Very high	76 Å²	76	63.4 Å²	63.4	40%	0.398	42%	0.415	S	S	.	.	H	α-helix	trans	-60.1	-51.7	174.1	177.4	63.3	0	0	0	111.5	L774 G776 R777 A782 G783 L784 T821	L774-L780 HydrophobicContact CD1-CD2 4.16Å; G776-L780 PolarHBondContact O-N 2.85Å; G776-L780 VanDerWaalsContact O-N 3.09Å; R777-L780 PolarHBondContact O-N 3.4Å; L780-A782 PolarHBondContact O-N 3.17Å; L780-G783 PolarHBondContact O-N 2.93Å; L780-L784 HydrophobicContact CD1-CD1 4.26Å; L780-L784 HydrophobicContact CD1-CG 4.27Å; L780-L784 HydrophobicContact CG-CD1 4.1Å; L780-L784 WeakPolarHBondContact O-CG 3.31Å; L780-L784 PolarHBondContact O-N 3.35Å; L780-T821 HydrophobicContact CD2-CG2 4.06Å
781	N	93.5	Very high	93.4	Very high	19 Å²	19	62 Å²	62	10%	0.102	41%	0.405	C	S	.	.	H	α-helix	trans	-65.2	-39.7	-179.1	-70.6	-25.1	0	0	0	112	R777 H778 G783 L784 L785 T821 L822	R777-N781 WeakPolarHBondContact O-CB 3.47Å; R777-N781 VanDerWaalsContact O-CG 3.3Å; R777-N781 PolarHBondContact O-N 3.01Å; R777-N781 PolarHBondContact O-ND2 2.8Å; H778-N781 PolarHBondContact O-N 3.02Å; N781-G783 VanDerWaalsContact C-N 3.34Å; N781-L784 PolarHBondContact O-N 2.87Å; N781-L785 WeakPolarHBondContact O-CB 3.26Å; N781-L785 PolarHBondContact O-N 3.43Å; N781-T821 WeakPolarHBondContact OD1-CB 3.32Å; N781-T821 PolarHBondContact OD1-OG1 3.25Å; N781-L822 HydrophobicContact CB-CD2 4.48Å; N781-L822 WeakPolarHBondContact ND2-CD2 3.23Å
782	A	94.7	Very high	93.9	Very high	59 Å²	59	60.6 Å²	60.6	49%	0.488	39%	0.394	S	S	.	.	H	α-helix	trans	-62.9	-41.1	173.5	0	0	0	0	0	111.7	H778 L780 L785 A786	H778-A782 WeakPolarHBondContact O-CB 3.34Å; H778-A782 PolarHBondContact O-N 2.84Å; L780-A782 PolarHBondContact O-N 3.17Å; A782-L785 PolarHBondContact O-N 3.47Å; A782-A786 VanDerWaalsContact O-CB 3.28Å; A782-A786 WeakPolarHBondContact O-CB 3.49Å; A782-A786 PolarHBondContact O-N 2.7Å
783	G	97.4	Very high	94.2	Very high	39 Å²	39	59.3 Å²	59.3	40%	0.402	39%	0.39	S	S	.	.	H	α-helix	trans	-64.5	-44.4	175.2	0	0	0	0	0	112.8	A779 L780 N781 L785 A786 A787	A779-G783 PolarHBondContact O-N 3.38Å; L780-G783 PolarHBondContact O-N 2.93Å; N781-G783 VanDerWaalsContact C-N 3.34Å; G783-L785 VanDerWaalsContact C-N 3.33Å; G783-L785 PolarHBondContact O-N 3.42Å; G783-A786 PolarHBondContact O-N 3.42Å; G783-A787 WeakPolarHBondContact O-CB 3.39Å; G783-A787 PolarHBondContact O-N 2.79Å
784	L	97	Very high	94.7	Very high	18 Å²	18	58.3 Å²	58.3	9%	0.094	39%	0.389	C	S	.	.	H	α-helix	trans	-61.4	-42	175.2	-70.5	170	0	0	0	111.4	L780 N781 S788 L814 I817 M818 T821	L780-L784 HydrophobicContact CD1-CD1 4.26Å; L780-L784 HydrophobicContact CD1-CG 4.27Å; L780-L784 HydrophobicContact CG-CD1 4.1Å; L780-L784 WeakPolarHBondContact O-CG 3.31Å; L780-L784 PolarHBondContact O-N 3.35Å; N781-L784 PolarHBondContact O-N 2.87Å; L784-S788 WeakPolarHBondContact O-CB 3.26Å; L784-S788 PolarHBondContact O-N 3.33Å; L784-S788 PolarHBondContact O-OG 2.84Å; L784-L814 HydrophobicContact CD2-CD2 3.78Å; L784-I817 HydrophobicContact CD1-CG2 3.89Å; L784-I817 HydrophobicContact CD2-CG2 4.16Å; L784-M818 VanDerWaalsContact C-CE 3.5Å; L784-M818 HydrophobicContact CB-CE 3.76Å; L784-M818 HydrophobicContact CD1-CB 4.34Å; L784-T821 HydrophobicContact CD1-CG2 4.47Å
785	L	96.4	Very high	95	Very high	82 Å²	82	54.6 Å²	54.6	43%	0.429	37%	0.369	S	S	.	.	H	α-helix	trans	-66.3	-46	176.3	-178.3	63	0	0	0	111.4	N781 A782 G783 A787 S788 V789 M818	N781-L785 WeakPolarHBondContact O-CB 3.26Å; N781-L785 PolarHBondContact O-N 3.43Å; A782-L785 PolarHBondContact O-N 3.47Å; G783-L785 VanDerWaalsContact C-N 3.33Å; G783-L785 PolarHBondContact O-N 3.42Å; L785-A787 VanDerWaalsContact C-N 3.33Å; L785-A787 PolarHBondContact O-N 2.95Å; L785-S788 PolarHBondContact O-N 3.32Å; L785-S788 VanDerWaalsContact O-N 3.17Å; L785-V789 HydrophobicContact CD1-CG2 4.15Å; L785-V789 HydrophobicContact CG-CG2 4.45Å; L785-V789 WeakPolarHBondContact O-CG2 3.27Å; L785-V789 PolarHBondContact O-N 3.46Å; L785-M818 HydrophobicContact CB-CE 4.23Å
786	A	97.6	Very high	95.2	Very high	63 Å²	63	50.6 Å²	50.6	52%	0.521	34%	0.34	S	S	.	.	H	α-helix	trans	-60.6	-41.6	177	0	0	0	0	0	111.9	A782 G783 G790	A782-A786 VanDerWaalsContact O-CB 3.28Å; A782-A786 WeakPolarHBondContact O-CB 3.49Å; A782-A786 PolarHBondContact O-N 2.7Å; G783-A786 PolarHBondContact O-N 3.42Å; A786-G790 WeakPolarHBondContact O-CA 3.46Å; A786-G790 PolarHBondContact O-N 3.21Å
787	A	97.6	Very high	95.5	Very high	48 Å²	48	54.4 Å²	54.4	40%	0.397	35%	0.346	S	S	.	.	H	α-helix	trans	-65.6	-39.4	174.6	0	0	0	0	0	112.1	G783 L785 G791 L814	G783-A787 WeakPolarHBondContact O-CB 3.39Å; G783-A787 PolarHBondContact O-N 2.79Å; L785-A787 VanDerWaalsContact C-N 3.33Å; L785-A787 PolarHBondContact O-N 2.95Å; A787-G791 PolarHBondContact O-N 3.37Å; A787-L814 HydrophobicContact CB-CD1 4.04Å
788	S	97.5	Very high	95.7	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.021	35%	0.352	C	S	.	.	H	α-helix	trans	-68.1	-41.5	177.5	-55.7	0	0	0	0	111.9	Y743 L784 L785	Y743-S788 WeakPolarHBondContact CE1-O 3.4Å; Y743-S788 PolarHBondContact OH-O 3.27Å; L784-S788 WeakPolarHBondContact O-CB 3.26Å; L784-S788 PolarHBondContact O-N 3.33Å; L784-S788 PolarHBondContact O-OG 2.84Å; L785-S788 PolarHBondContact O-N 3.32Å; L785-S788 VanDerWaalsContact O-N 3.17Å
789	V	96.9	Very high	95.8	Very high	100 Å²	100	55 Å²	55	61%	0.606	36%	0.361	S	S	*	.	H	α-helix	trans	-71.7	-45.5	176.5	173.5	0	0	0	0	110.7	L785 G791 M792	L785-V789 HydrophobicContact CD1-CG2 4.15Å; L785-V789 HydrophobicContact CG-CG2 4.45Å; L785-V789 WeakPolarHBondContact O-CG2 3.27Å; L785-V789 PolarHBondContact O-N 3.46Å; V789-G791 VanDerWaalsContact C-N 3.28Å; V789-G791 PolarHBondContact O-N 2.85Å; V789-M792 WeakPolarHBondContact O-CB 3.46Å; V789-M792 PolarHBondContact O-N 2.85Å
790	G	96.3	Very high	96	Very high	37 Å²	37	53.4 Å²	53.4	38%	0.381	35%	0.346	S	S	.	.	H	α-helix	trans	-64.8	-31	179.1	0	0	0	0	0	113.2	A786 M792 V793 P794	A786-G790 WeakPolarHBondContact O-CA 3.46Å; A786-G790 PolarHBondContact O-N 3.21Å; G790-M792 PolarHBondContact O-N 3.35Å; G790-M792 VanDerWaalsContact O-N 3.17Å; G790-V793 WeakPolarHBondContact O-CB 3.31Å; G790-V793 PolarHBondContact O-N 3.05Å; G790-P794 VanDerWaalsContact O-CD 3.23Å; G790-P794 WeakPolarHBondContact O-CD 3.43Å
791	G	96.6	Very high	96	Very high	17 Å²	17	53.5 Å²	53.5	18%	0.175	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-17.3	176.7	0	0	0	0	0	114.5	Y743 A787 V789 V793 P794 Y795	Y743-G791 VanDerWaalsContact OH-C 3.3Å; Y743-G791 WeakPolarHBondContact OH-CA 3.09Å; A787-G791 PolarHBondContact O-N 3.37Å; V789-G791 VanDerWaalsContact C-N 3.28Å; V789-G791 PolarHBondContact O-N 2.85Å; G791-V793 VanDerWaalsContact C-N 3.32Å; G791-P794 WeakPolarHBondContact O-CD 3.4Å; G791-P794 WeakPolarHBondContact O-CG 3.48Å; G791-Y795 WeakPolarHBondContact O-CB 3.18Å; G791-Y795 PolarHBondContact O-N 2.98Å
792	M	96.2	Very high	96.2	Very high	37 Å²	37	57 Å²	57	18%	0.182	36%	0.363	C	S	.	.	H	α-helix	trans	-66.5	-32.8	171.1	-173.3	72.7	82.4	0	0	112	I740 Y743 L744 V789 G790 Y795 M796	I740-M792 HydrophobicContact CG1-SD 4.46Å; I740-M792 HydrophobicContact CG2-CE 4.44Å; Y743-M792 HydrophobicContact CD1-CE 3.31Å; Y743-M792 HydrophobicContact CD1-SD 3.9Å; Y743-M792 HydrophobicContact CD2-SD 4.19Å; Y743-M792 HydrophobicContact CE1-CB 4.35Å; Y743-M792 HydrophobicContact CE1-CE 4.04Å; Y743-M792 HydrophobicContact CE1-SD 4.46Å; Y743-M792 HydrophobicContact CG-CE 3.65Å; Y743-M792 HydrophobicContact CG-SD 3.74Å; Y743-M792 PolarHBondContact OH-N 3.26Å; L744-M792 HydrophobicContact CD2-CE 4.39Å; L744-M792 HydrophobicContact CG-CE 4.41Å; V789-M792 WeakPolarHBondContact O-CB 3.46Å; V789-M792 PolarHBondContact O-N 2.85Å; G790-M792 PolarHBondContact O-N 3.35Å; G790-M792 VanDerWaalsContact O-N 3.17Å; M792-Y795 WeakPolarHBondContact O-CB 3.45Å; M792-Y795 PolarHBondContact O-N 2.85Å; M792-Y795 HydrophobicContact SD-CD1 3.9Å; M792-M796 HydrophobicContact CG-CG 3.97Å; M792-M796 WeakPolarHBondContact O-CB 3.28Å; M792-M796 VanDerWaalsContact O-CG 3.25Å; M792-M796 WeakPolarHBondContact O-CG 3.31Å; M792-M796 PolarHBondContact O-N 3.17Å; M792-M796 HydrophobicContact SD-CG 4.09Å; M792-M796 HydrophobicContact SD-SD 4.35Å
793	V	96.9	Very high	96.3	Very high	83 Å²	83	56 Å²	56	50%	0.503	35%	0.352	S	S	.	.	H	α-helix	trans	-62.2	-56.1	-177.1	178.2	0	0	0	0	112.4	G790 G791 Y795 M796 I797	G790-V793 WeakPolarHBondContact O-CB 3.31Å; G790-V793 PolarHBondContact O-N 3.05Å; G791-V793 VanDerWaalsContact C-N 3.32Å; V793-Y795 PolarHBondContact O-N 2.78Å; V793-M796 PolarHBondContact O-N 2.97Å; V793-I797 HydrophobicContact CG1-CD1 3.59Å; V793-I797 HydrophobicContact CG1-CG1 4.46Å; V793-I797 WeakPolarHBondContact O-CG1 3.47Å; V793-I797 PolarHBondContact O-N 3.34Å
794	P	96.5	Very high	96.2	Very high	61 Å²	61	54.2 Å²	54.2	40%	0.396	33%	0.332	S	S	.	.	H	α-helix	trans	-64.3	-30.4	175.8	26.1	-34.1	0	0	0	112.1	G790 G791 M796 D798	G790-P794 VanDerWaalsContact O-CD 3.23Å; G790-P794 WeakPolarHBondContact O-CD 3.43Å; G791-P794 WeakPolarHBondContact O-CD 3.4Å; G791-P794 WeakPolarHBondContact O-CG 3.48Å; P794-M796 VanDerWaalsContact C-N 3.31Å; P794-M796 PolarHBondContact O-N 3.38Å; P794-D798 PolarHBondContact O-N 2.91Å
795	Y	96.9	Very high	96.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-63.1	-35.9	175.3	-178.9	-112.7	0	0	0	112.8	Y722 K739 Y743 G791 M792 V793 G804 C807 L808	Y722-Y795 HydrophobicContact CD2-CE2 4.3Å; Y722-Y795 WeakPolarHBondContact CD2-OH 3.29Å; Y722-Y795 AromaticContact CE2-CE2 3.82Å; Y722-Y795 HydrophobicContact CE2-CE2 3.82Å; Y722-Y795 AromaticContact CE2-CZ 3.94Å; Y722-Y795 WeakPolarHBondContact CE2-OH 3.41Å; K739-Y795 HydrophobicContact CB-CE1 3.64Å; K739-Y795 WeakPolarHBondContact CE-O 3.35Å; K739-Y795 HydrophobicContact CG-CE1 4.29Å; K739-Y795 PolarHBondContact NZ-O 2.96Å; K739-Y795 WeakPolarHBondContact O-CE1 3.25Å; Y743-Y795 AromaticContact CD2-CD1 3.67Å; Y743-Y795 HydrophobicContact CD2-CD1 3.67Å; Y743-Y795 HydrophobicContact CD2-CD2 4.38Å; Y743-Y795 AromaticContact CD2-CE1 3.99Å; Y743-Y795 HydrophobicContact CD2-CE1 3.99Å; Y743-Y795 AromaticContact CD2-CG 3.88Å; Y743-Y795 HydrophobicContact CD2-CG 3.88Å; Y743-Y795 HydrophobicContact CE2-CD1 4.43Å; Y743-Y795 HydrophobicContact CE2-CG 4.28Å; Y743-Y795 HydrophobicContact CG-CD1 4.28Å; Y743-Y795 HydrophobicContact CG-CE1 4.4Å; G791-Y795 WeakPolarHBondContact O-CB 3.18Å; G791-Y795 PolarHBondContact O-N 2.98Å; M792-Y795 WeakPolarHBondContact O-CB 3.45Å; M792-Y795 PolarHBondContact O-N 2.85Å; M792-Y795 HydrophobicContact SD-CD1 3.9Å; V793-Y795 PolarHBondContact O-N 2.78Å; Y795-G804 WeakPolarHBondContact CE2-O 3.23Å; Y795-C807 HydrophobicContact CD2-CB 3.6Å; Y795-C807 HydrophobicContact CG-CB 4.11Å; Y795-L808 HydrophobicContact CE2-CD1 4.39Å; Y795-L808 HydrophobicContact CE2-CD2 4.28Å; Y795-L808 HydrophobicContact CE2-CG 3.9Å
796	M	95.6	Very high	96.3	Very high	47 Å²	47	55.2 Å²	55.2	23%	0.232	34%	0.341	C	S	.	.	H	α-helix	trans	-87	-38.6	-178	-68	-58.1	-68.7	0	0	113.5	N736 K739 I740 M792 V793 P794	N736-M796 HydrophobicContact CB-CE 3.67Å; N736-M796 WeakPolarHBondContact OD1-CE 3.41Å; K739-M796 HydrophobicContact CB-SD 4.05Å; I740-M796 HydrophobicContact CD1-CE 3.95Å; I740-M796 HydrophobicContact CG1-CE 3.84Å; I740-M796 HydrophobicContact CG1-SD 3.87Å; M792-M796 HydrophobicContact CG-CG 3.97Å; M792-M796 WeakPolarHBondContact O-CB 3.28Å; M792-M796 VanDerWaalsContact O-CG 3.25Å; M792-M796 WeakPolarHBondContact O-CG 3.31Å; M792-M796 PolarHBondContact O-N 3.17Å; M792-M796 HydrophobicContact SD-CG 4.09Å; M792-M796 HydrophobicContact SD-SD 4.35Å; V793-M796 PolarHBondContact O-N 2.97Å; P794-M796 VanDerWaalsContact C-N 3.31Å; P794-M796 PolarHBondContact O-N 3.38Å
797	I	95	Very high	96.3	Very high	135 Å²	135	53 Å²	53	69%	0.692	32%	0.321	S	S	*	.	H	α-helix	trans	-77	-33.5	-173.3	-64.6	174.1	0	0	0	112.2	V793	V793-I797 HydrophobicContact CG1-CD1 3.59Å; V793-I797 HydrophobicContact CG1-CG1 4.46Å; V793-I797 WeakPolarHBondContact O-CG1 3.47Å; V793-I797 PolarHBondContact O-N 3.34Å
798	D	93.2	Very high	96.3	Very high	57 Å²	57	50.7 Å²	50.7	31%	0.305	30%	0.302	S	S	.	.			trans	-94.4	122	-178.8	-170.1	-6.1	0	0	0	111.2	P794 S800 T803	P794-D798 PolarHBondContact O-N 2.91Å; D798-S800 PolarHBondContact O-N 3.33Å; D798-S800 WeakPolarHBondContact OD1-CB 3.21Å; D798-S800 PolarHBondContact OD1-N 3.41Å; D798-T803 HydrophobicContact CB-CG2 3.86Å; D798-T803 WeakPolarHBondContact OD2-CB 3.31Å; D798-T803 WeakPolarHBondContact OD2-CG2 3.33Å; D798-T803 PolarHBondContact OD2-OG1 2.99Å
799	P	92.9	Very high	96.3	Very high	101 Å²	101	52.6 Å²	52.6	66%	0.656	32%	0.322	S	S	*	.			trans	-76.8	-5.2	174.8	32.4	-36.2	0	0	0	113.6	Y726	Y726-P799 VanDerWaalsContact CE2-O 3.23Å; Y726-P799 WeakPolarHBondContact CE2-O 3.33Å; Y726-P799 PolarHBondContact OH-O 3.24Å
800	S	96.3	Very high	96.3	Very high	40 Å²	40	50.5 Å²	50.5	28%	0.28	31%	0.312	S	S	.	.			trans	-64.4	132.7	-177.5	177.2	0	0	0	0	114	D798 T802 T803 G804	D798-S800 PolarHBondContact O-N 3.33Å; D798-S800 WeakPolarHBondContact OD1-CB 3.21Å; D798-S800 PolarHBondContact OD1-N 3.41Å; S800-T802 VanDerWaalsContact C-N 3.32Å; S800-T802 PolarHBondContact O-N 3.33Å; S800-T802 PolarHBondContact OG-N 2.86Å; S800-T803 PolarHBondContact O-N 3.38Å; S800-G804 PolarHBondContact O-N 3.48Å
801	Y	95.5	Very high	96.4	Very high	77 Å²	77	48.8 Å²	48.8	30%	0.302	29%	0.294	S	S	.	.	H	α-helix	trans	-55	-48.8	175.4	-178.9	-106.5	0	0	0	111.5	Y722 M723 Y726 T803 G804 I805	Y722-Y801 HydrophobicContact CE1-CD2 4.17Å; Y722-Y801 HydrophobicContact CE1-CE2 4.19Å; M723-Y801 WeakPolarHBondContact CE-OH 3.46Å; M723-Y801 HydrophobicContact CG-CE2 4.49Å; Y726-Y801 AromaticContact CD1-CD2 3.73Å; Y726-Y801 HydrophobicContact CD1-CD2 3.73Å; Y726-Y801 HydrophobicContact CD1-CG 4.32Å; Y726-Y801 AromaticContact CD2-CD2 3.76Å; Y726-Y801 HydrophobicContact CD2-CD2 3.76Å; Y726-Y801 HydrophobicContact CD2-CG 4.49Å; Y726-Y801 HydrophobicContact CE1-CD2 4.13Å; Y726-Y801 HydrophobicContact CE1-CG 4.29Å; Y726-Y801 HydrophobicContact CE2-CD2 4.13Å; Y726-Y801 HydrophobicContact CE2-CG 4.42Å; Y726-Y801 VanDerWaalsContact CE2-N 3.29Å; Y726-Y801 AromaticContact CG-CD2 3.55Å; Y726-Y801 HydrophobicContact CG-CD2 3.55Å; Y726-Y801 HydrophobicContact CG-CE2 4.35Å; Y726-Y801 HydrophobicContact CG-CG 4.44Å; Y726-Y801 VanDerWaalsContact CZ-CA 3.45Å; Y726-Y801 PolarHBondContact OH-N 2.88Å; Y801-T803 VanDerWaalsContact C-N 3.33Å; Y801-T803 PolarHBondContact O-N 3.45Å; Y801-G804 PolarHBondContact O-N 3.13Å; Y801-I805 HydrophobicContact CD1-CG2 4.44Å; Y801-I805 HydrophobicContact CE1-CG2 4.21Å; Y801-I805 WeakPolarHBondContact O-CG2 3.47Å; Y801-I805 PolarHBondContact O-N 3.4Å
802	T	97	Very high	96.5	Very high	93 Å²	93	49.5 Å²	49.5	57%	0.571	30%	0.297	S	S	*	.	H	α-helix	trans	-61.5	-43.4	-176.4	-56.1	0	0	0	0	111	S800 I805 T806	S800-T802 VanDerWaalsContact C-N 3.32Å; S800-T802 PolarHBondContact O-N 3.33Å; S800-T802 PolarHBondContact OG-N 2.86Å; T802-I805 WeakPolarHBondContact O-CG2 3.23Å; T802-T806 WeakPolarHBondContact O-CB 3.47Å; T802-T806 PolarHBondContact O-N 2.88Å; T802-T806 PolarHBondContact O-OG1 3.29Å
803	T	96.4	Very high	96.6	Very high	39 Å²	39	50.1 Å²	50.1	24%	0.239	31%	0.308	C	S	.	.	H	α-helix	trans	-64.5	-48.5	177	-56.8	0	0	0	0	110	D798 S800 Y801 I805 T806 C807	D798-T803 HydrophobicContact CB-CG2 3.86Å; D798-T803 WeakPolarHBondContact OD2-CB 3.31Å; D798-T803 WeakPolarHBondContact OD2-CG2 3.33Å; D798-T803 PolarHBondContact OD2-OG1 2.99Å; S800-T803 PolarHBondContact O-N 3.38Å; Y801-T803 VanDerWaalsContact C-N 3.33Å; Y801-T803 PolarHBondContact O-N 3.45Å; T803-I805 PolarHBondContact O-N 3.13Å; T803-T806 PolarHBondContact O-N 3.26Å; T803-C807 WeakPolarHBondContact O-CB 3.37Å; T803-C807 PolarHBondContact O-N 2.98Å; T803-C807 PolarHBondContact O-SG 2.79Å; T803-C807 VanDerWaalsContact O-SG 3.32Å
804	G	96.2	Very high	96.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65.7	-43.3	-176.2	0	0	0	0	0	114.2	Y722 Y795 S800 Y801 T806 C807 L808	Y722-G804 WeakPolarHBondContact OH-CA 3.35Å; Y795-G804 WeakPolarHBondContact CE2-O 3.23Å; S800-G804 PolarHBondContact O-N 3.48Å; Y801-G804 PolarHBondContact O-N 3.13Å; G804-T806 VanDerWaalsContact C-N 3.34Å; G804-T806 PolarHBondContact O-N 3.48Å; G804-C807 WeakPolarHBondContact O-CB 3.43Å; G804-C807 PolarHBondContact O-N 2.84Å; G804-L808 PolarHBondContact O-N 3.39Å
805	I	96.8	Very high	96.7	Very high	44 Å²	44	45.3 Å²	45.3	23%	0.226	28%	0.276	C	S	.	.	H	α-helix	trans	-68.1	-34.9	176.2	-161.6	65.4	0	0	0	111.6	V719 Y722 M723 Y801 T802 T803 L808 G809	V719-I805 HydrophobicContact CG1-CD1 3.96Å; Y722-I805 HydrophobicContact CD1-CD1 4.12Å; Y722-I805 HydrophobicContact CE1-CB 4.31Å; Y722-I805 HydrophobicContact CE1-CD1 4.49Å; M723-I805 HydrophobicContact CG-CD1 4.06Å; M723-I805 HydrophobicContact SD-CD1 4.48Å; Y801-I805 HydrophobicContact CD1-CG2 4.44Å; Y801-I805 HydrophobicContact CE1-CG2 4.21Å; Y801-I805 WeakPolarHBondContact O-CG2 3.47Å; Y801-I805 PolarHBondContact O-N 3.4Å; T802-I805 WeakPolarHBondContact O-CG2 3.23Å; T803-I805 PolarHBondContact O-N 3.13Å; I805-L808 PolarHBondContact O-N 3.31Å; I805-G809 PolarHBondContact O-N 3.32Å
806	T	97.6	Very high	96.8	Very high	78 Å²	78	46.6 Å²	46.6	48%	0.479	29%	0.286	S	S	.	.	H	α-helix	trans	-65.4	-40.8	174.2	-61.1	0	0	0	0	110.9	T802 T803 G804 G809 S810	T802-T806 WeakPolarHBondContact O-CB 3.47Å; T802-T806 PolarHBondContact O-N 2.88Å; T802-T806 PolarHBondContact O-OG1 3.29Å; T803-T806 PolarHBondContact O-N 3.26Å; G804-T806 VanDerWaalsContact C-N 3.34Å; G804-T806 PolarHBondContact O-N 3.48Å; T806-G809 PolarHBondContact O-N 3.48Å; T806-S810 VanDerWaalsContact O-CB 3.23Å; T806-S810 WeakPolarHBondContact O-CB 3.47Å; T806-S810 PolarHBondContact O-N 3.08Å; T806-S810 PolarHBondContact O-OG 3.01Å
807	C	97.9	Very high	96.9	Very high	15 Å²	15	48.4 Å²	48.4	10%	0.101	30%	0.296	C	S	.	.	H	α-helix	trans	-63.6	-42.3	174.5	-76	0	0	0	0	112.1	Y795 T803 G804 S810 V811	Y795-C807 HydrophobicContact CD2-CB 3.6Å; Y795-C807 HydrophobicContact CG-CB 4.11Å; T803-C807 WeakPolarHBondContact O-CB 3.37Å; T803-C807 PolarHBondContact O-N 2.98Å; T803-C807 PolarHBondContact O-SG 2.79Å; T803-C807 VanDerWaalsContact O-SG 3.32Å; G804-C807 WeakPolarHBondContact O-CB 3.43Å; G804-C807 PolarHBondContact O-N 2.84Å; C807-S810 PolarHBondContact O-N 2.77Å; C807-V811 PolarHBondContact O-N 3.33Å
808	L	97.3	Very high	97	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.5	-43.6	174.6	-74.9	-180	0	0	0	112.3	Y722 Y743 Y795 G804 I805 S810 V811 S812	Y722-L808 HydrophobicContact CD1-CD1 3.75Å; Y722-L808 HydrophobicContact CD2-CD1 3.97Å; Y722-L808 HydrophobicContact CE1-CD1 4.49Å; Y722-L808 HydrophobicContact CG-CD1 3.46Å; Y722-L808 VanDerWaalsContact CG-CD1 3.46Å; Y743-L808 HydrophobicContact CD2-CD2 4.14Å; Y795-L808 HydrophobicContact CE2-CD1 4.39Å; Y795-L808 HydrophobicContact CE2-CD2 4.28Å; Y795-L808 HydrophobicContact CE2-CG 3.9Å; G804-L808 PolarHBondContact O-N 3.39Å; I805-L808 PolarHBondContact O-N 3.31Å; L808-S810 VanDerWaalsContact C-N 3.33Å; L808-S810 PolarHBondContact O-N 3.32Å; L808-V811 HydrophobicContact CD2-CG1 4.5Å; L808-V811 WeakPolarHBondContact O-CG1 3.36Å; L808-V811 PolarHBondContact O-N 3.05Å; L808-S812 WeakPolarHBondContact O-CB 3.34Å; L808-S812 PolarHBondContact O-N 2.86Å
809	G	97.6	Very high	97.1	Very high	43 Å²	43	39.7 Å²	39.7	44%	0.443	25%	0.251	S	S	.	.	H	α-helix	trans	-62	-40.9	173.3	0	0	0	0	0	112.3	I805 T806 S812 A813	I805-G809 PolarHBondContact O-N 3.32Å; T806-G809 PolarHBondContact O-N 3.48Å; G809-S812 PolarHBondContact O-N 3.44Å; G809-A813 WeakPolarHBondContact O-CB 3.45Å; G809-A813 PolarHBondContact O-N 3.49Å
810	S	97.9	Very high	97.3	Very high	57 Å²	57	37.9 Å²	37.9	40%	0.399	24%	0.238	S	C	.	.	H	α-helix	trans	-65.6	-46.4	178.2	-61.3	0	0	0	0	111.7	T806 C807 L808 S812 A813 L814	T806-S810 VanDerWaalsContact O-CB 3.23Å; T806-S810 WeakPolarHBondContact O-CB 3.47Å; T806-S810 PolarHBondContact O-N 3.08Å; T806-S810 PolarHBondContact O-OG 3.01Å; C807-S810 PolarHBondContact O-N 2.77Å; L808-S810 VanDerWaalsContact C-N 3.33Å; L808-S810 PolarHBondContact O-N 3.32Å; S810-S812 VanDerWaalsContact C-N 3.35Å; S810-A813 PolarHBondContact O-N 3.39Å; S810-L814 WeakPolarHBondContact O-CB 3.3Å; S810-L814 VanDerWaalsContact O-CG 3.24Å; S810-L814 WeakPolarHBondContact O-CG 3.33Å; S810-L814 PolarHBondContact O-N 2.98Å
811	V	98.4	Very high	97.2	Very high	0 Å²	0	37 Å²	37	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-68.5	-34.8	178.6	74.2	0	0	0	0	111.7	Y743 T746 Y747 C807 L808 L814 S815	Y743-V811 HydrophobicContact CD1-CG2 4.3Å; Y743-V811 HydrophobicContact CD2-CG1 4.11Å; Y743-V811 HydrophobicContact CE1-CB 4.09Å; Y743-V811 HydrophobicContact CE1-CG1 4.34Å; Y743-V811 HydrophobicContact CE1-CG2 3.57Å; Y743-V811 HydrophobicContact CE2-CB 3.88Å; Y743-V811 HydrophobicContact CE2-CG1 3.83Å; Y743-V811 HydrophobicContact CE2-CG2 4.31Å; Y743-V811 HydrophobicContact CG-CG1 4.46Å; Y743-V811 WeakPolarHBondContact OH-CB 3.33Å; T746-V811 HydrophobicContact CG2-CG1 3.87Å; Y747-V811 HydrophobicContact CD2-CG2 3.81Å; Y747-V811 HydrophobicContact CG-CG2 4.32Å; C807-V811 PolarHBondContact O-N 3.33Å; L808-V811 HydrophobicContact CD2-CG1 4.5Å; L808-V811 WeakPolarHBondContact O-CG1 3.36Å; L808-V811 PolarHBondContact O-N 3.05Å; V811-L814 PolarHBondContact O-N 2.98Å; V811-S815 WeakPolarHBondContact O-CB 3.35Å; V811-S815 PolarHBondContact O-N 3.22Å; V811-S815 PolarHBondContact O-OG 2.96Å
812	S	98	Very high	97.1	Very high	32 Å²	32	35 Å²	35	22%	0.224	23%	0.225	C	C	.	.	H	α-helix	trans	-61	-44.9	171.5	-178.9	0	0	0	0	111.6	L808 G809 S810 S815 A816	L808-S812 WeakPolarHBondContact O-CB 3.34Å; L808-S812 PolarHBondContact O-N 2.86Å; G809-S812 PolarHBondContact O-N 3.44Å; S810-S812 VanDerWaalsContact C-N 3.35Å; S812-S815 WeakPolarHBondContact CA-OG 3.49Å; S812-S815 PolarHBondContact O-OG 3.28Å; S812-A816 VanDerWaalsContact O-CB 3.24Å; S812-A816 WeakPolarHBondContact O-CB 3.41Å; S812-A816 PolarHBondContact O-N 3.15Å
813	A	98.2	Very high	97	Very high	51 Å²	51	30.9 Å²	30.9	42%	0.421	20%	0.2	S	C	.	.	H	α-helix	trans	-66.4	-46	176.2	0	0	0	0	0	112.5	G809 S810 A816 I817	G809-A813 WeakPolarHBondContact O-CB 3.45Å; G809-A813 PolarHBondContact O-N 3.49Å; S810-A813 PolarHBondContact O-N 3.39Å; A813-A816 PolarHBondContact O-N 3.33Å; A813-I817 VanDerWaalsContact O-CG1 3.25Å; A813-I817 WeakPolarHBondContact O-CG1 3.47Å; A813-I817 PolarHBondContact O-N 3.48Å
814	L	98.2	Very high	96.9	Very high	43 Å²	43	29.7 Å²	29.7	23%	0.225	19%	0.194	C	C	.	.	H	α-helix	trans	-63.5	-44.1	179.7	-72.1	170.8	0	0	0	111.9	L784 A787 S810 V811 I817 M818	L784-L814 HydrophobicContact CD2-CD2 3.78Å; A787-L814 HydrophobicContact CB-CD1 4.04Å; S810-L814 WeakPolarHBondContact O-CB 3.3Å; S810-L814 VanDerWaalsContact O-CG 3.24Å; S810-L814 WeakPolarHBondContact O-CG 3.33Å; S810-L814 PolarHBondContact O-N 2.98Å; V811-L814 PolarHBondContact O-N 2.98Å; L814-I817 PolarHBondContact O-N 2.96Å; L814-M818 VanDerWaalsContact O-CB 3.31Å; L814-M818 WeakPolarHBondContact O-CB 3.48Å; L814-M818 PolarHBondContact O-N 3.41Å
815	S	98.2	Very high	96.6	Very high	0 Å²	0	30 Å²	30	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64.9	-41.5	175.6	55.3	0	0	0	0	112	Y747 G750 V811 S812 M818 G819	Y747-S815 VanDerWaalsContact O-CB 3.23Å; Y747-S815 WeakPolarHBondContact O-CB 3.38Å; G750-S815 WeakPolarHBondContact CA-OG 3.49Å; V811-S815 WeakPolarHBondContact O-CB 3.35Å; V811-S815 PolarHBondContact O-N 3.22Å; V811-S815 PolarHBondContact O-OG 2.96Å; S812-S815 WeakPolarHBondContact CA-OG 3.49Å; S812-S815 PolarHBondContact O-OG 3.28Å; S815-M818 PolarHBondContact O-N 3.4Å; S815-G819 PolarHBondContact O-N 3.14Å
816	A	98.3	Very high	96.3	Very high	26 Å²	26	28 Å²	28	22%	0.215	19%	0.187	C	C	.	.	H	α-helix	trans	-61.8	-45.2	174.6	0	0	0	0	0	111.6	S754 S812 A813 M818 G819 V820	S754-A816 WeakPolarHBondContact CB-O 3.42Å; S754-A816 WeakPolarHBondContact OG-CA 3.45Å; S754-A816 PolarHBondContact OG-O 3.06Å; S812-A816 VanDerWaalsContact O-CB 3.24Å; S812-A816 WeakPolarHBondContact O-CB 3.41Å; S812-A816 PolarHBondContact O-N 3.15Å; A813-A816 PolarHBondContact O-N 3.33Å; A816-M818 VanDerWaalsContact C-N 3.31Å; A816-M818 PolarHBondContact O-N 3.48Å; A816-G819 PolarHBondContact O-N 3.27Å; A816-V820 WeakPolarHBondContact O-CG2 3.45Å; A816-V820 PolarHBondContact O-N 3.25Å; A816-V820 VanDerWaalsContact O-N 3.13Å
817	I	97.9	Very high	95.7	Very high	85 Å²	85	24.6 Å²	24.6	44%	0.436	17%	0.166	S	C	.	.	H	α-helix	trans	-60.4	-44.5	175.1	-68	163.9	0	0	0	110.2	L784 A813 L814 G819 V820 T821	L784-I817 HydrophobicContact CD1-CG2 3.89Å; L784-I817 HydrophobicContact CD2-CG2 4.16Å; A813-I817 VanDerWaalsContact O-CG1 3.25Å; A813-I817 WeakPolarHBondContact O-CG1 3.47Å; A813-I817 PolarHBondContact O-N 3.48Å; L814-I817 PolarHBondContact O-N 2.96Å; I817-G819 PolarHBondContact O-N 2.95Å; I817-V820 WeakPolarHBondContact O-CB 3.44Å; I817-V820 PolarHBondContact O-N 2.75Å; I817-T821 HydrophobicContact CG2-CG2 4.2Å; I817-T821 WeakPolarHBondContact O-CG2 3.45Å; I817-T821 PolarHBondContact O-N 2.72Å; I817-T821 PolarHBondContact O-OG1 2.94Å
818	M	96.4	Very high	94.9	Very high	8 Å²	8	24.9 Å²	24.9	4%	0.039	17%	0.172	C	C	.	.	H	α-helix	trans	-63.2	-41.2	179.5	-166	-174.9	-48.8	0	0	112.7	Y747 L784 L785 L814 S815 A816 V820 T821 L822	Y747-M818 HydrophobicContact CE2-CE 3.8Å; Y747-M818 HydrophobicContact CE2-SD 4.32Å; Y747-M818 WeakPolarHBondContact OH-CE 3.49Å; Y747-M818 PolarHBondContact OH-SD 3.42Å; L784-M818 VanDerWaalsContact C-CE 3.5Å; L784-M818 HydrophobicContact CB-CE 3.76Å; L784-M818 HydrophobicContact CD1-CB 4.34Å; L785-M818 HydrophobicContact CB-CE 4.23Å; L814-M818 VanDerWaalsContact O-CB 3.31Å; L814-M818 WeakPolarHBondContact O-CB 3.48Å; L814-M818 PolarHBondContact O-N 3.41Å; S815-M818 PolarHBondContact O-N 3.4Å; A816-M818 VanDerWaalsContact C-N 3.31Å; A816-M818 PolarHBondContact O-N 3.48Å; M818-V820 VanDerWaalsContact C-N 3.29Å; M818-V820 PolarHBondContact O-N 3.35Å; M818-T821 WeakPolarHBondContact CA-OG1 3.38Å; M818-T821 PolarHBondContact O-N 3.33Å; M818-T821 PolarHBondContact O-OG1 2.96Å; M818-T821 VanDerWaalsContact O-OG1 3.09Å; M818-L822 HydrophobicContact CG-CD1 3.84Å; M818-L822 HydrophobicContact CG-CG 4.29Å; M818-L822 WeakPolarHBondContact O-CB 3.35Å; M818-L822 WeakPolarHBondContact O-CG 3.28Å; M818-L822 PolarHBondContact O-N 3.19Å; M818-L822 HydrophobicContact SD-CD1 4.43Å
819	G	96.5	Very high	94	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-61.2	-38.1	174.5	0	0	0	0	0	112.2	S754 S815 A816 I817 T823	S754-G819 WeakPolarHBondContact OG-CA 3.49Å; S815-G819 PolarHBondContact O-N 3.14Å; A816-G819 PolarHBondContact O-N 3.27Å; I817-G819 PolarHBondContact O-N 2.95Å; G819-T823 VanDerWaalsContact O-CB 3.23Å; G819-T823 WeakPolarHBondContact O-CB 3.44Å; G819-T823 PolarHBondContact O-N 3.4Å; G819-T823 VanDerWaalsContact O-N 3.13Å; G819-T823 PolarHBondContact O-OG1 3.32Å
820	V	96.8	Very high	93.4	Very high	64 Å²	64	25.3 Å²	25.3	39%	0.388	17%	0.17	S	C	.	.	H	α-helix	trans	-67	-50.6	173.5	174.4	0	0	0	0	111.3	S754 V758 A816 I817 M818 L822 T823 A824	S754-V820 PolarHBondContact OG-N 3.32Å; V758-V820 HydrophobicContact CG2-CB 4.29Å; V758-V820 HydrophobicContact CG2-CG1 4.15Å; V758-V820 HydrophobicContact CG2-CG2 4Å; A816-V820 WeakPolarHBondContact O-CG2 3.45Å; A816-V820 PolarHBondContact O-N 3.25Å; A816-V820 VanDerWaalsContact O-N 3.13Å; I817-V820 WeakPolarHBondContact O-CB 3.44Å; I817-V820 PolarHBondContact O-N 2.75Å; M818-V820 VanDerWaalsContact C-N 3.29Å; M818-V820 PolarHBondContact O-N 3.35Å; V820-L822 PolarHBondContact O-N 3.37Å; V820-T823 PolarHBondContact O-N 2.88Å; V820-A824 WeakPolarHBondContact O-CB 3.49Å; V820-A824 PolarHBondContact O-N 3.11Å
821	T	94.6	Very high	93.1	Very high	20 Å²	20	22.6 Å²	22.6	12%	0.123	15%	0.151	C	C	.	.	H	α-helix	trans	-65.7	-40.2	-174.6	56.2	0	0	0	0	112.3	L774 L780 N781 L784 I817 M818	L774-T821 HydrophobicContact CD1-CG2 4.47Å; L780-T821 HydrophobicContact CD2-CG2 4.06Å; N781-T821 WeakPolarHBondContact OD1-CB 3.32Å; N781-T821 PolarHBondContact OD1-OG1 3.25Å; L784-T821 HydrophobicContact CD1-CG2 4.47Å; I817-T821 HydrophobicContact CG2-CG2 4.2Å; I817-T821 WeakPolarHBondContact O-CG2 3.45Å; I817-T821 PolarHBondContact O-N 2.72Å; I817-T821 PolarHBondContact O-OG1 2.94Å; M818-T821 WeakPolarHBondContact CA-OG1 3.38Å; M818-T821 PolarHBondContact O-N 3.33Å; M818-T821 PolarHBondContact O-OG1 2.96Å; M818-T821 VanDerWaalsContact O-OG1 3.09Å
822	L	93.2	Very high	92.7	Very high	36 Å²	36	22.8 Å²	22.8	19%	0.188	15%	0.152	C	C	.	.	H	α-helix	trans	-67.2	-50.6	176.1	-70.1	172.5	0	0	0	111.1	N781 M818 V820 A824 A825 I826 I888	N781-L822 HydrophobicContact CB-CD2 4.48Å; N781-L822 WeakPolarHBondContact ND2-CD2 3.23Å; M818-L822 HydrophobicContact CG-CD1 3.84Å; M818-L822 HydrophobicContact CG-CG 4.29Å; M818-L822 WeakPolarHBondContact O-CB 3.35Å; M818-L822 WeakPolarHBondContact O-CG 3.28Å; M818-L822 PolarHBondContact O-N 3.19Å; M818-L822 HydrophobicContact SD-CD1 4.43Å; V820-L822 PolarHBondContact O-N 3.37Å; L822-A824 PolarHBondContact O-N 3.37Å; L822-A825 PolarHBondContact O-N 2.84Å; L822-I826 WeakPolarHBondContact O-CG1 3.4Å; L822-I888 HydrophobicContact CD2-CG2 4.37Å
823	T	94.6	Very high	92.3	Very high	6 Å²	6	21.2 Å²	21.2	4%	0.037	14%	0.141	C	C	.	.	H	α-helix	trans	-71.6	-34.8	-174	-51	0	0	0	0	112.7	G755 V758 A759 G819 V820 A825 I826 M831 V834	G755-T823 VanDerWaalsContact CA-OG1 3.31Å; G755-T823 WeakPolarHBondContact CA-OG1 3.37Å; G755-T823 WeakPolarHBondContact O-CG2 3.44Å; V758-T823 HydrophobicContact CB-CG2 3.94Å; V758-T823 HydrophobicContact CG1-CG2 3.84Å; A759-T823 HydrophobicContact CB-CG2 4.31Å; G819-T823 VanDerWaalsContact O-CB 3.23Å; G819-T823 WeakPolarHBondContact O-CB 3.44Å; G819-T823 PolarHBondContact O-N 3.4Å; G819-T823 VanDerWaalsContact O-N 3.13Å; G819-T823 PolarHBondContact O-OG1 3.32Å; V820-T823 PolarHBondContact O-N 2.88Å; T823-A825 PolarHBondContact O-N 3.13Å; T823-I826 PolarHBondContact O-N 2.95Å; T823-I826 VanDerWaalsContact O-N 3.15Å; T823-M831 HydrophobicContact CG2-SD 4.31Å; T823-V834 HydrophobicContact CG2-CG1 3.9Å
824	A	93.4	Very high	92	Very high	14 Å²	14	19 Å²	19	12%	0.116	12%	0.122	C	C	.	.	H	α-helix	trans	-65.2	-29.8	179	0	0	0	0	0	112.8	V758 K762 L772 V820 L822 I826	V758-A824 HydrophobicContact CG1-CB 4.31Å; K762-A824 PolarHBondContact NZ-O 3.32Å; L772-A824 HydrophobicContact CB-CB 4.43Å; L772-A824 PolarHBondContact N-O 2.97Å; V820-A824 WeakPolarHBondContact O-CB 3.49Å; V820-A824 PolarHBondContact O-N 3.11Å; L822-A824 PolarHBondContact O-N 3.37Å; A824-I826 PolarHBondContact O-N 3.26Å
825	A	91.1	Very high	91.7	Very high	7 Å²	7	17 Å²	17	6%	0.058	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-6.7	177.5	0	0	0	0	0	113.6	P771 L772 L773 L822 T823	P771-A825 WeakPolarHBondContact CB-O 3.36Å; L772-A825 WeakPolarHBondContact O-CA 3.38Å; L773-A825 HydrophobicContact CD2-CB 4.43Å; L822-A825 PolarHBondContact O-N 2.84Å; T823-A825 PolarHBondContact O-N 3.13Å
826	I	89.7	Confident	91.5	Very high	3 Å²	3	17 Å²	17	2%	0.015	11%	0.112	C	C	.	.	S	Bend	trans	-94.4	136.9	-179.9	-57.7	171.7	0	0	0	109.9	K762 L822 T823 A824 D830 V834 I888	K762-I826 PolarHBondContact NZ-O 2.93Å; L822-I826 WeakPolarHBondContact O-CG1 3.4Å; T823-I826 PolarHBondContact O-N 2.95Å; T823-I826 VanDerWaalsContact O-N 3.15Å; A824-I826 PolarHBondContact O-N 3.26Å; I826-D830 HydrophobicContact CG2-CB 3.69Å; I826-V834 HydrophobicContact CB-CG2 4.15Å; I826-V834 HydrophobicContact CD1-CG2 3.32Å; I826-V834 HydrophobicContact CG1-CG2 4.29Å; I826-V834 HydrophobicContact CG2-CG2 3.7Å; I826-I888 HydrophobicContact CD1-CD1 3.83Å
827	G	85.3	Confident	91.4	Very high	5 Å²	5	16.4 Å²	16.4	5%	0.052	11%	0.106	C	C	.	.			trans	-75.6	159.2	179.1	0	0	0	0	0	112.9	S769 A829 D830 M831	S769-G827 CarbonylContact O-C 3.59Å; G827-A829 VanDerWaalsContact C-N 3.34Å; G827-A829 PolarHBondContact O-N 3.09Å; G827-D830 PolarHBondContact O-N 3.41Å; G827-M831 PolarHBondContact O-N 3.4Å
828	G	81.5	Confident	91.3	Very high	22 Å²	22	12.7 Å²	12.7	23%	0.227	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-27.7	-172.9	0	0	0	0	0	116.3	S769 M831	S769-G828 PolarHBondContact O-N 3.21Å; G828-M831 WeakPolarHBondContact O-CB 3.35Å
829	A	78.4	Confident	91.2	Very high	41 Å²	41	12.3 Å²	12.3	34%	0.339	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-18.6	177.6	0	0	0	0	0	114.1	G827 P832 Y1049	G827-A829 VanDerWaalsContact C-N 3.34Å; G827-A829 PolarHBondContact O-N 3.09Å; A829-P832 WeakPolarHBondContact O-CD 3.34Å; A829-Y1049 HydrophobicContact CB-CD1 3.49Å; A829-Y1049 VanDerWaalsContact CB-CD1 3.49Å; A829-Y1049 HydrophobicContact CB-CD2 3.24Å; A829-Y1049 HydrophobicContact CB-CE1 3.47Å; A829-Y1049 VanDerWaalsContact CB-CE1 3.47Å; A829-Y1049 HydrophobicContact CB-CE2 3.22Å; A829-Y1049 HydrophobicContact CB-CG 3.35Å
830	D	85.8	Confident	91.2	Very high	10 Å²	10	12.6 Å²	12.6	5%	0.053	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-8.1	168.2	-66.3	-15.6	0	0	0	112	I826 G827 P832 V833 M880 R882 V887	I826-D830 HydrophobicContact CG2-CB 3.69Å; G827-D830 PolarHBondContact O-N 3.41Å; D830-P832 VanDerWaalsContact C-N 3.32Å; D830-V833 WeakPolarHBondContact O-CB 3.3Å; D830-V833 PolarHBondContact O-N 2.63Å; D830-M880 WeakPolarHBondContact OD1-CE 3.44Å; D830-R882 IonicContact OD1-CZ 3.6Å; D830-R882 IonicContact OD1-NH1 3.55Å; D830-R882 PolarHBondContact OD1-NH1 3Å; D830-R882 IonicContact OD2-CZ 2.78Å; D830-R882 IonicContact OD2-NH1 3.55Å; D830-R882 PolarHBondContact OD2-NH1 3.43Å; D830-R882 IonicContact OD2-NH2 2.65Å; D830-R882 PolarHBondContact OD2-NH2 3.08Å; D830-V887 HydrophobicContact CB-CG1 4.03Å
831	M	90.3	Very high	91.2	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-53.4	-36.1	-179.2	-162.3	55.8	53.6	0	0	114.8	A759 K762 L763 T823 G827 G828 V833 V834 I835	A759-M831 HydrophobicContact CB-CG 4.41Å; A759-M831 HydrophobicContact CB-SD 3.61Å; K762-M831 HydrophobicContact CB-CE 4.13Å; K762-M831 HydrophobicContact CD-CE 3.5Å; K762-M831 HydrophobicContact CG-CE 4.39Å; L763-M831 HydrophobicContact CD1-CG 4.11Å; L763-M831 HydrophobicContact CD2-CB 4.18Å; L763-M831 HydrophobicContact CD2-CG 3.85Å; L763-M831 HydrophobicContact CG-CG 3.84Å; T823-M831 HydrophobicContact CG2-SD 4.31Å; G827-M831 PolarHBondContact O-N 3.4Å; G828-M831 WeakPolarHBondContact O-CB 3.35Å; M831-V833 PolarHBondContact O-N 2.65Å; M831-V834 WeakPolarHBondContact O-CA 3.32Å; M831-V834 VanDerWaalsContact O-CB 3.31Å; M831-V834 WeakPolarHBondContact O-CB 3.4Å; M831-V834 PolarHBondContact O-N 3.29Å; M831-V834 HydrophobicContact SD-CB 4.05Å; M831-V834 HydrophobicContact SD-CG1 4.46Å; M831-V834 HydrophobicContact SD-CG2 4.2Å; M831-I835 WeakPolarHBondContact O-CG1 3.48Å; M831-I835 PolarHBondContact O-N 3.38Å
832	P	89.8	Confident	91.3	Very high	4 Å²	4	13.2 Å²	13.2	3%	0.026	8%	0.08	C	C	.	.	H	α-helix	trans	-68.2	-24.2	179.8	-3	16	0	0	0	113.2	A829 D830 V834 I835 T836 M876 R968	A829-P832 WeakPolarHBondContact O-CD 3.34Å; D830-P832 VanDerWaalsContact C-N 3.32Å; P832-V834 VanDerWaalsContact C-N 3.34Å; P832-I835 PolarHBondContact O-N 3.17Å; P832-T836 PolarHBondContact O-N 3.15Å; P832-T836 PolarHBondContact O-OG1 3.35Å; P832-M876 VanDerWaalsContact C-SD 3.58Å; P832-M876 HydrophobicContact CB-CE 3.51Å; P832-M876 HydrophobicContact CB-SD 4.02Å; P832-M876 HydrophobicContact CG-CE 4.02Å; P832-R968 WeakPolarHBondContact CB-O 3.41Å; P832-R968 VanDerWaalsContact CG-O 3.31Å; P832-R968 WeakPolarHBondContact CG-O 3.45Å
833	V	90.6	Very high	91.5	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-64.6	-42.3	168.6	-178.8	0	0	0	0	109.9	D830 M831 I835 T836 V837 M876 M880 L884 V887	D830-V833 WeakPolarHBondContact O-CB 3.3Å; D830-V833 PolarHBondContact O-N 2.63Å; M831-V833 PolarHBondContact O-N 2.65Å; V833-I835 VanDerWaalsContact C-N 3.33Å; V833-I835 PolarHBondContact O-N 3.38Å; V833-T836 PolarHBondContact O-N 2.88Å; V833-T836 PolarHBondContact O-OG1 2.94Å; V833-V837 HydrophobicContact CG1-CG2 4.36Å; V833-V837 VanDerWaalsContact O-CG2 3.29Å; V833-V837 WeakPolarHBondContact O-CG2 3.38Å; V833-V837 PolarHBondContact O-N 3.18Å; V833-M876 HydrophobicContact CG2-CB 4.01Å; V833-M876 HydrophobicContact CG2-CE 3.97Å; V833-M876 HydrophobicContact CG2-SD 4.2Å; V833-M880 HydrophobicContact CG2-SD 4.23Å; V833-L884 HydrophobicContact CG1-CD1 4.06Å; V833-V887 HydrophobicContact CB-CG1 3.98Å; V833-V887 HydrophobicContact CG1-CB 4.46Å; V833-V887 HydrophobicContact CG1-CG1 3.89Å; V833-V887 HydrophobicContact CG2-CG1 4.38Å
834	V	91.6	Very high	91.6	Very high	4 Å²	4	14.8 Å²	14.8	2%	0.024	8%	0.083	C	C	.	.	H	α-helix	trans	-62.2	-42	176.9	-173.2	0	0	0	0	111.4	T823 I826 M831 P832 T836 V837 L838	T823-V834 HydrophobicContact CG2-CG1 3.9Å; I826-V834 HydrophobicContact CB-CG2 4.15Å; I826-V834 HydrophobicContact CD1-CG2 3.32Å; I826-V834 HydrophobicContact CG1-CG2 4.29Å; I826-V834 HydrophobicContact CG2-CG2 3.7Å; M831-V834 WeakPolarHBondContact O-CA 3.32Å; M831-V834 VanDerWaalsContact O-CB 3.31Å; M831-V834 WeakPolarHBondContact O-CB 3.4Å; M831-V834 PolarHBondContact O-N 3.29Å; M831-V834 HydrophobicContact SD-CB 4.05Å; M831-V834 HydrophobicContact SD-CG1 4.46Å; M831-V834 HydrophobicContact SD-CG2 4.2Å; P832-V834 VanDerWaalsContact C-N 3.34Å; V834-T836 VanDerWaalsContact C-N 3.3Å; V834-T836 PolarHBondContact O-N 2.94Å; V834-V837 PolarHBondContact O-N 3.44Å; V834-L838 HydrophobicContact CG1-CD1 3.72Å; V834-L838 HydrophobicContact CG1-CG 4.11Å; V834-L838 WeakPolarHBondContact O-CB 3.31Å; V834-L838 VanDerWaalsContact O-CG 3.27Å; V834-L838 WeakPolarHBondContact O-CG 3.43Å; V834-L838 PolarHBondContact O-N 3.36Å
835	I	92.1	Very high	91.8	Very high	2 Å²	2	14.1 Å²	14.1	1%	0.01	8%	0.078	C	C	.	.	H	α-helix	trans	-58.4	-43.8	178.1	-61	169.5	0	0	0	110.8	M528 P700 V703 H707 L763 M831 P832 V833 N839	M528-I835 HydrophobicContact CE-CG2 3.75Å; P700-I835 HydrophobicContact CB-CD1 4.28Å; V703-I835 HydrophobicContact CG1-CG2 3.63Å; H707-I835 PolarHBondContact CE1-O 3.25Å; L763-I835 HydrophobicContact CD1-CD1 3.56Å; L763-I835 HydrophobicContact CD1-CG1 4.26Å; M831-I835 WeakPolarHBondContact O-CG1 3.48Å; M831-I835 PolarHBondContact O-N 3.38Å; P832-I835 PolarHBondContact O-N 3.17Å; V833-I835 VanDerWaalsContact C-N 3.33Å; V833-I835 PolarHBondContact O-N 3.38Å; I835-N839 WeakPolarHBondContact O-CB 3.49Å; I835-N839 PolarHBondContact O-N 3.38Å
836	T	94.4	Very high	92	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-71.9	-35.9	-179.7	52.9	0	0	0	0	112.5	M528 P832 V833 V834 N839 S840 G869 L872 S873 M876 P970	M528-T836 HydrophobicContact CE-CG2 4.09Å; M528-T836 HydrophobicContact SD-CG2 3.79Å; P832-T836 PolarHBondContact O-N 3.15Å; P832-T836 PolarHBondContact O-OG1 3.35Å; V833-T836 PolarHBondContact O-N 2.88Å; V833-T836 PolarHBondContact O-OG1 2.94Å; V834-T836 VanDerWaalsContact C-N 3.3Å; V834-T836 PolarHBondContact O-N 2.94Å; T836-N839 WeakPolarHBondContact O-CB 3.4Å; T836-N839 PolarHBondContact O-N 2.85Å; T836-S840 PolarHBondContact O-N 3.26Å; T836-G869 CarbonylContact O-C 3.26Å; T836-G869 WeakPolarHBondContact O-CA 3.22Å; T836-L872 HydrophobicContact CG2-CB 3.71Å; T836-S873 VanDerWaalsContact CB-OG 3.23Å; T836-S873 WeakPolarHBondContact CB-OG 3.37Å; T836-S873 WeakPolarHBondContact OG1-CA 3.49Å; T836-S873 PolarHBondContact OG1-OG 2.86Å; T836-M876 HydrophobicContact CG2-SD 4.19Å; T836-P970 HydrophobicContact CG2-CG 3.84Å
837	V	95.5	Very high	92.4	Very high	13 Å²	13	13.9 Å²	13.9	8%	0.079	8%	0.076	C	C	.	.	H	α-helix	trans	-64.3	-45.2	174.2	172.2	0	0	0	0	110.8	V833 V834 N839 S840 Y841 S873 L884 I888	V833-V837 HydrophobicContact CG1-CG2 4.36Å; V833-V837 VanDerWaalsContact O-CG2 3.29Å; V833-V837 WeakPolarHBondContact O-CG2 3.38Å; V833-V837 PolarHBondContact O-N 3.18Å; V834-V837 PolarHBondContact O-N 3.44Å; V837-N839 VanDerWaalsContact C-N 3.32Å; V837-N839 PolarHBondContact O-N 3.2Å; V837-S840 WeakPolarHBondContact O-CA 3.34Å; V837-S840 VanDerWaalsContact O-CB 3.25Å; V837-S840 WeakPolarHBondContact O-CB 3.41Å; V837-S840 PolarHBondContact O-N 3.43Å; V837-S840 VanDerWaalsContact O-N 3.13Å; V837-Y841 HydrophobicContact CG1-CE1 4.11Å; V837-Y841 HydrophobicContact CG1-CE2 4.33Å; V837-Y841 PolarHBondContact O-N 3.12Å; V837-S873 WeakPolarHBondContact CG2-OG 3.48Å; V837-S873 PolarHBondContact N-OG 3.47Å; V837-S873 VanDerWaalsContact N-OG 3.09Å; V837-L884 HydrophobicContact CG2-CD1 3.63Å; V837-I888 HydrophobicContact CG2-CD1 4.48Å
838	L	95.3	Very high	93	Very high	6 Å²	6	14.1 Å²	14.1	3%	0.031	8%	0.077	C	C	.	.	H	α-helix	trans	-70.5	-29.5	178.4	-63.2	176.4	0	0	0	112	G755 S756 V834 S840 Y841 S842	G755-L838 VanDerWaalsContact C-CD1 3.49Å; S756-L838 WeakPolarHBondContact OG-CD1 3.5Å; V834-L838 HydrophobicContact CG1-CD1 3.72Å; V834-L838 HydrophobicContact CG1-CG 4.11Å; V834-L838 WeakPolarHBondContact O-CB 3.31Å; V834-L838 VanDerWaalsContact O-CG 3.27Å; V834-L838 WeakPolarHBondContact O-CG 3.43Å; V834-L838 PolarHBondContact O-N 3.36Å; L838-S840 VanDerWaalsContact C-N 3.34Å; L838-Y841 HydrophobicContact CD2-CD2 4.06Å; L838-Y841 PolarHBondContact O-N 3.09Å; L838-S842 PolarHBondContact O-N 3.08Å
839	N	94.8	Very high	93.8	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-59.7	-46.3	167.2	-171.5	19.3	0	0	0	110.5	T531 I835 T836 V837 Y841 S842 G843	T531-N839 PolarHBondContact OG1-ND2 3.24Å; I835-N839 WeakPolarHBondContact O-CB 3.49Å; I835-N839 PolarHBondContact O-N 3.38Å; T836-N839 WeakPolarHBondContact O-CB 3.4Å; T836-N839 PolarHBondContact O-N 2.85Å; V837-N839 VanDerWaalsContact C-N 3.32Å; V837-N839 PolarHBondContact O-N 3.2Å; N839-Y841 VanDerWaalsContact C-N 3.34Å; N839-Y841 PolarHBondContact O-N 3.48Å; N839-S842 WeakPolarHBondContact O-CB 3.4Å; N839-S842 PolarHBondContact O-N 3.38Å; N839-S842 PolarHBondContact O-OG 3.09Å; N839-G843 PolarHBondContact O-N 3.06Å
840	S	96.7	Very high	94.7	Very high	8 Å²	8	11.1 Å²	11.1	6%	0.056	5%	0.05	C	C	.	.	H	α-helix	trans	-58.2	-45.9	175.5	-170	0	0	0	0	111.6	T836 V837 L838 S842 G843 W844 G866	T836-S840 PolarHBondContact O-N 3.26Å; V837-S840 WeakPolarHBondContact O-CA 3.34Å; V837-S840 VanDerWaalsContact O-CB 3.25Å; V837-S840 WeakPolarHBondContact O-CB 3.41Å; V837-S840 PolarHBondContact O-N 3.43Å; V837-S840 VanDerWaalsContact O-N 3.13Å; L838-S840 VanDerWaalsContact C-N 3.34Å; S840-S842 VanDerWaalsContact C-N 3.31Å; S840-S842 PolarHBondContact O-N 3.12Å; S840-G843 PolarHBondContact O-N 3.26Å; S840-W844 PolarHBondContact O-N 3.36Å; S840-W844 PolarHBondContact O-NE1 2.97Å; S840-W844 PolarHBondContact OG-NE1 3.3Å; S840-G866 WeakPolarHBondContact CB-O 3.48Å; S840-G866 PolarHBondContact OG-O 3.4Å
841	Y	97.3	Very high	95.2	Very high	96 Å²	96	12.7 Å²	12.7	38%	0.376	6%	0.057	S	C	.	.	H	α-helix	trans	-62.6	-36.2	177.9	-71.1	2.9	0	0	0	112.9	I748 V751 T752 V837 L838 N839 G843 W844 A845	I748-Y841 VanDerWaalsContact CG2-O 3.26Å; I748-Y841 WeakPolarHBondContact CG2-O 3.3Å; V751-Y841 HydrophobicContact CG1-CD2 4.11Å; V751-Y841 HydrophobicContact CG1-CE2 4.02Å; T752-Y841 VanDerWaalsContact OG1-CB 3.26Å; T752-Y841 WeakPolarHBondContact OG1-CB 3.24Å; V837-Y841 HydrophobicContact CG1-CE1 4.11Å; V837-Y841 HydrophobicContact CG1-CE2 4.33Å; V837-Y841 PolarHBondContact O-N 3.12Å; L838-Y841 HydrophobicContact CD2-CD2 4.06Å; L838-Y841 PolarHBondContact O-N 3.09Å; N839-Y841 VanDerWaalsContact C-N 3.34Å; N839-Y841 PolarHBondContact O-N 3.48Å; Y841-G843 VanDerWaalsContact C-N 3.28Å; Y841-G843 PolarHBondContact O-N 2.89Å; Y841-W844 PolarHBondContact O-N 2.91Å; Y841-A845 WeakPolarHBondContact O-CB 3.43Å; Y841-A845 PolarHBondContact O-N 2.95Å
842	S	95.7	Very high	95.5	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-59.3	-40.6	172.9	83.6	0	0	0	0	111.6	L838 N839 S840 A845 L846	L838-S842 PolarHBondContact O-N 3.08Å; N839-S842 WeakPolarHBondContact O-CB 3.4Å; N839-S842 PolarHBondContact O-N 3.38Å; N839-S842 PolarHBondContact O-OG 3.09Å; S840-S842 VanDerWaalsContact C-N 3.31Å; S840-S842 PolarHBondContact O-N 3.12Å; S842-A845 WeakPolarHBondContact O-CB 3.2Å; S842-A845 PolarHBondContact O-N 3.16Å; S842-L846 WeakPolarHBondContact O-CD1 3.37Å; S842-L846 PolarHBondContact O-N 3.32Å
843	G	96.8	Very high	95.9	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-66	-41.7	174.5	0	0	0	0	0	113.8	N839 S840 Y841 A845 L846 C847 G862	N839-G843 PolarHBondContact O-N 3.06Å; S840-G843 PolarHBondContact O-N 3.26Å; Y841-G843 VanDerWaalsContact C-N 3.28Å; Y841-G843 PolarHBondContact O-N 2.89Å; G843-A845 VanDerWaalsContact C-N 3.29Å; G843-A845 PolarHBondContact O-N 2.84Å; G843-L846 WeakPolarHBondContact O-CB 3.49Å; G843-L846 PolarHBondContact O-N 3.43Å; G843-C847 PolarHBondContact O-N 3.16Å; G843-C847 PolarHBondContact O-SG 3.49Å; G843-C847 VanDerWaalsContact O-SG 3.38Å; G843-G862 CarbonylContact C-O 3.5Å; G843-G862 WeakPolarHBondContact CA-O 3.33Å; G843-G862 CarbonylContact O-C 3.58Å; G843-G862 WeakPolarHBondContact O-CA 3.37Å
844	W	97.8	Very high	96.1	Very high	75 Å²	75	19.1 Å²	19.1	28%	0.284	9%	0.091	S	C	.	.	H	α-helix	trans	-68.6	-28.7	176.2	-53.2	127.3	0	0	0	112.8	F505 I748 S840 Y841 C847 A848	F505-W844 HydrophobicContact CE2-CE3 4.15Å; F505-W844 AromaticContact CE2-CZ3 3.79Å; F505-W844 HydrophobicContact CE2-CZ3 3.79Å; F505-W844 HydrophobicContact CZ-CE3 4.44Å; F505-W844 AromaticContact CZ-CZ3 3.98Å; F505-W844 HydrophobicContact CZ-CZ3 3.98Å; I748-W844 HydrophobicContact CD1-CB 4.44Å; S840-W844 PolarHBondContact O-N 3.36Å; S840-W844 PolarHBondContact O-NE1 2.97Å; S840-W844 PolarHBondContact OG-NE1 3.3Å; Y841-W844 PolarHBondContact O-N 2.91Å; W844-C847 WeakPolarHBondContact O-CB 2.99Å; W844-C847 PolarHBondContact O-N 3.47Å; W844-A848 PolarHBondContact O-N 2.96Å
845	A	96.6	Very high	96.4	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.008	9%	0.092	C	C	.	.	H	α-helix	trans	-64.6	-41.8	170.6	0	0	0	0	0	111.6	A714 I748 Y841 S842 G843 C847 A848 E849	A714-A845 HydrophobicContact CB-CB 3.85Å; I748-A845 HydrophobicContact CG2-CB 3.99Å; Y841-A845 WeakPolarHBondContact O-CB 3.43Å; Y841-A845 PolarHBondContact O-N 2.95Å; S842-A845 WeakPolarHBondContact O-CB 3.2Å; S842-A845 PolarHBondContact O-N 3.16Å; G843-A845 VanDerWaalsContact C-N 3.29Å; G843-A845 PolarHBondContact O-N 2.84Å; A845-C847 VanDerWaalsContact C-N 3.3Å; A845-C847 PolarHBondContact O-N 3.42Å; A845-A848 WeakPolarHBondContact O-CB 3.22Å; A845-A848 PolarHBondContact O-N 2.89Å; A845-E849 PolarHBondContact O-N 3.5Å
846	L	97.3	Very high	96.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.7	-35.6	171.6	-88.9	76.3	0	0	0	112.3	T538 V710 S842 G843 A848 E849 G850 V861 I865	T538-L846 HydrophobicContact CG2-CD1 3.44Å; T538-L846 VanDerWaalsContact CG2-CD1 3.44Å; T538-L846 HydrophobicContact CG2-CG 3.84Å; V710-L846 HydrophobicContact CG1-CD1 3.56Å; S842-L846 WeakPolarHBondContact O-CD1 3.37Å; S842-L846 PolarHBondContact O-N 3.32Å; G843-L846 WeakPolarHBondContact O-CB 3.49Å; G843-L846 PolarHBondContact O-N 3.43Å; L846-A848 VanDerWaalsContact C-N 3.35Å; L846-E849 PolarHBondContact O-N 2.72Å; L846-G850 PolarHBondContact O-N 3.41Å; L846-V861 HydrophobicContact CD2-CG1 3.75Å; L846-I865 HydrophobicContact CD2-CD1 4.13Å
847	C	98	Very high	96.8	Very high	5 Å²	5	21.5 Å²	21.5	3%	0.034	10%	0.103	C	C	.	.	H	α-helix	trans	-62.8	-44	173.3	-63.1	0	0	0	0	111.1	F505 G843 W844 A845 E849 G850 F851 G862 A863	F505-C847 HydrophobicContact CD2-CB 4.45Å; F505-C847 HydrophobicContact CE2-CB 4.25Å; G843-C847 PolarHBondContact O-N 3.16Å; G843-C847 PolarHBondContact O-SG 3.49Å; G843-C847 VanDerWaalsContact O-SG 3.38Å; W844-C847 WeakPolarHBondContact O-CB 2.99Å; W844-C847 PolarHBondContact O-N 3.47Å; A845-C847 VanDerWaalsContact C-N 3.3Å; A845-C847 PolarHBondContact O-N 3.42Å; C847-E849 VanDerWaalsContact C-N 3.34Å; C847-G850 PolarHBondContact O-N 2.83Å; C847-F851 WeakPolarHBondContact O-CD2 3.49Å; C847-F851 PolarHBondContact O-N 3.3Å; C847-G862 VanDerWaalsContact SG-CA 3.57Å; C847-A863 PolarHBondContact SG-N 3.08Å
848	A	97.6	Very high	96.9	Very high	9 Å²	9	20.9 Å²	20.9	7%	0.074	10%	0.1	C	C	.	.	H	α-helix	trans	-59.9	-45.4	175.5	0	0	0	0	0	110.8	V741 W844 A845 L846 G850 F851 L852	V741-A848 HydrophobicContact CG1-CB 4.13Å; V741-A848 WeakPolarHBondContact CG1-O 3.44Å; W844-A848 PolarHBondContact O-N 2.96Å; A845-A848 WeakPolarHBondContact O-CB 3.22Å; A845-A848 PolarHBondContact O-N 2.89Å; L846-A848 VanDerWaalsContact C-N 3.35Å; A848-G850 VanDerWaalsContact C-N 3.31Å; A848-G850 PolarHBondContact O-N 3.39Å; A848-F851 PolarHBondContact O-N 2.95Å; A848-L852 VanDerWaalsContact O-CB 3.22Å; A848-L852 WeakPolarHBondContact O-CB 3.24Å; A848-L852 PolarHBondContact O-N 3.02Å
849	E	97	Very high	97	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-60.8	-37.9	174.9	-162	173.2	-166.5	0	0	112.3	T538 G541 T717 A845 L846 C847 L852 L853 L858	T538-E849 WeakPolarHBondContact CG2-OE2 3.39Å; G541-E849 WeakPolarHBondContact CA-OE1 3.33Å; T717-E849 VanDerWaalsContact CB-OE1 3.29Å; T717-E849 WeakPolarHBondContact CB-OE1 3.46Å; T717-E849 HydrophobicContact CG2-CG 3.86Å; T717-E849 WeakPolarHBondContact CG2-OE1 3.47Å; T717-E849 PolarHBondContact OG1-OE1 3.45Å; A845-E849 PolarHBondContact O-N 3.5Å; L846-E849 PolarHBondContact O-N 2.72Å; C847-E849 VanDerWaalsContact C-N 3.34Å; E849-L852 PolarHBondContact O-N 3.34Å; E849-L853 HydrophobicContact CG-CD1 3.86Å; E849-L853 WeakPolarHBondContact O-CB 3.13Å; E849-L853 PolarHBondContact O-N 2.67Å; E849-L858 HydrophobicContact CB-CD1 4.29Å; E849-L858 HydrophobicContact CG-CD1 3.94Å
850	G	97.3	Very high	97.2	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-68.3	-40	175	0	0	0	0	0	114.3	L846 C847 A848 L852 N854 N855	L846-G850 PolarHBondContact O-N 3.41Å; C847-G850 PolarHBondContact O-N 2.83Å; A848-G850 VanDerWaalsContact C-N 3.31Å; A848-G850 PolarHBondContact O-N 3.39Å; G850-L852 VanDerWaalsContact C-N 3.32Å; G850-N854 CarbonylContact O-C 3.48Å; G850-N854 WeakPolarHBondContact O-CA 3.3Å; G850-N854 PolarHBondContact O-N 2.98Å; G850-N854 VanDerWaalsContact O-N 3.11Å; G850-N855 PolarHBondContact O-N 3.02Å
851	F	97.7	Very high	97.3	Very high	44 Å²	44	21.5 Å²	21.5	19%	0.193	10%	0.103	C	C	.	.	H	α-helix	trans	-66.6	-36.1	172	-81.3	-66.5	0	0	0	112	F498 M501 V502 F505 V741 C847 A848 T859	F498-F851 HydrophobicContact CD2-CD1 4.29Å; F498-F851 HydrophobicContact CD2-CE1 4.44Å; F498-F851 HydrophobicContact CE2-CD1 4.28Å; F498-F851 HydrophobicContact CE2-CE1 4.26Å; M501-F851 HydrophobicContact CB-CD1 3.89Å; M501-F851 HydrophobicContact CB-CE1 3.69Å; M501-F851 HydrophobicContact CG-CD1 3.4Å; M501-F851 VanDerWaalsContact CG-CD1 3.4Å; M501-F851 HydrophobicContact CG-CE1 3.4Å; M501-F851 VanDerWaalsContact CG-CE1 3.4Å; M501-F851 HydrophobicContact CG-CG 4.22Å; M501-F851 HydrophobicContact CG-CZ 4.21Å; V502-F851 HydrophobicContact CG2-CE1 3.85Å; V502-F851 HydrophobicContact CG2-CZ 4.18Å; F505-F851 HydrophobicContact CB-CE2 4.41Å; F505-F851 HydrophobicContact CB-CZ 3.88Å; F505-F851 HydrophobicContact CD1-CZ 4.49Å; F505-F851 HydrophobicContact CD2-CE2 4.2Å; F505-F851 HydrophobicContact CD2-CZ 4.48Å; F505-F851 HydrophobicContact CG-CE2 4.21Å; F505-F851 HydrophobicContact CG-CZ 4.04Å; V741-F851 HydrophobicContact CG1-CB 3.79Å; V741-F851 HydrophobicContact CG2-CB 4.14Å; C847-F851 WeakPolarHBondContact O-CD2 3.49Å; C847-F851 PolarHBondContact O-N 3.3Å; A848-F851 PolarHBondContact O-N 2.95Å; F851-T859 HydrophobicContact CE2-CG2 4.2Å; F851-T859 HydrophobicContact CZ-CG2 4.31Å
852	L	96.6	Very high	97.3	Very high	11 Å²	11	17 Å²	17	6%	0.058	9%	0.085	C	C	.	.	H	α-helix	trans	-68.7	-52.1	-178.6	-167.5	65.2	0	0	0	110.7	C718 E721 T738 V741 A742 A848 E849 G850 N854	C718-L852 HydrophobicContact CB-CD2 4.4Å; E721-L852 HydrophobicContact CB-CD2 4.13Å; E721-L852 HydrophobicContact CG-CD2 4.3Å; E721-L852 HydrophobicContact CG-CG 4.33Å; E721-L852 WeakPolarHBondContact OE2-CD2 3.15Å; E721-L852 WeakPolarHBondContact OE2-CG 3.22Å; T738-L852 HydrophobicContact CG2-CD1 3.61Å; T738-L852 WeakPolarHBondContact O-CD1 3.45Å; V741-L852 HydrophobicContact CB-CD1 4.17Å; V741-L852 HydrophobicContact CG1-CB 3.85Å; V741-L852 HydrophobicContact CG1-CD1 4.28Å; A742-L852 HydrophobicContact CB-CD1 3.88Å; A742-L852 HydrophobicContact CB-CD2 4.2Å; A848-L852 VanDerWaalsContact O-CB 3.22Å; A848-L852 WeakPolarHBondContact O-CB 3.24Å; A848-L852 PolarHBondContact O-N 3.02Å; E849-L852 PolarHBondContact O-N 3.34Å; G850-L852 VanDerWaalsContact C-N 3.32Å; L852-N854 VanDerWaalsContact C-N 3.31Å; L852-N854 PolarHBondContact O-N 3.38Å
853	L	96.4	Very high	97.4	Very high	35 Å²	35	17 Å²	17	18%	0.183	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	6.1	-177	-66	170	0	0	0	114.5	V544 L545 T717 E721 E849 N855 L858	V544-L853 HydrophobicContact CG2-CD1 3.81Å; V544-L853 HydrophobicContact CG2-CD2 3.69Å; V544-L853 HydrophobicContact CG2-CG 4.36Å; L545-L853 HydrophobicContact CD2-CD2 4.15Å; L545-L853 HydrophobicContact CG-CD2 4.43Å; T717-L853 HydrophobicContact CG2-CD1 4.3Å; E721-L853 VanDerWaalsContact CD-CD2 3.41Å; E721-L853 WeakPolarHBondContact OE1-CD2 3.12Å; E721-L853 WeakPolarHBondContact OE2-CD2 3.32Å; E721-L853 WeakPolarHBondContact OE2-CG 3.45Å; E849-L853 HydrophobicContact CG-CD1 3.86Å; E849-L853 WeakPolarHBondContact O-CB 3.13Å; E849-L853 PolarHBondContact O-N 2.67Å; L853-N855 VanDerWaalsContact C-N 3.31Å; L853-N855 HydrophobicContact CB-CB 4.4Å; L853-N855 PolarHBondContact O-N 3.45Å; L853-L858 HydrophobicContact CD1-CD1 4.12Å
854	N	96.6	Very high	97.4	Very high	93 Å²	93	17.1 Å²	17.1	50%	0.497	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	47.3	-174.3	-168.4	24.3	0	0	0	113.2	M501 G850 L852	M501-N854 WeakPolarHBondContact CE-OD1 3.35Å; G850-N854 CarbonylContact O-C 3.48Å; G850-N854 WeakPolarHBondContact O-CA 3.3Å; G850-N854 PolarHBondContact O-N 2.98Å; G850-N854 VanDerWaalsContact O-N 3.11Å; L852-N854 VanDerWaalsContact C-N 3.31Å; L852-N854 PolarHBondContact O-N 3.38Å
855	N	97.6	Very high	97.3	Very high	8 Å²	8	13.6 Å²	13.6	4%	0.043	7%	0.073	C	C	.	.			trans	-117.2	110.8	-173.2	-169.2	-42.7	0	0	0	112.7	V540 Y624 G850 L853 L857 L858 T859	V540-N855 WeakPolarHBondContact CG1-ND2 3.39Å; Y624-N855 PolarHBondContact OH-ND2 3.36Å; G850-N855 PolarHBondContact O-N 3.02Å; L853-N855 VanDerWaalsContact C-N 3.31Å; L853-N855 HydrophobicContact CB-CB 4.4Å; L853-N855 PolarHBondContact O-N 3.45Å; N855-L857 VanDerWaalsContact C-N 3.33Å; N855-L857 PolarHBondContact O-N 3.34Å; N855-L857 WeakPolarHBondContact OD1-CB 3.5Å; N855-L857 PolarHBondContact OD1-N 2.92Å; N855-L858 HydrophobicContact CB-CB 4.4Å; N855-L858 HydrophobicContact CB-CD1 4.11Å; N855-L858 HydrophobicContact CB-CG 4.23Å; N855-L858 PolarHBondContact O-N 3.44Å; N855-L858 PolarHBondContact OD1-N 3.24Å; N855-T859 PolarHBondContact O-N 2.96Å; N855-T859 PolarHBondContact O-OG1 2.83Å
856	N	97.1	Very high	97.3	Very high	47 Å²	47	13.6 Å²	13.6	25%	0.251	7%	0.073	S	C	.	.	H	α-helix	trans	-60	-36.8	-179.2	-72.6	-51.1	0	0	0	113.8	Q621 T859 V860	Q621-N856 PolarHBondContact OE1-ND2 2.66Å; N856-T859 PolarHBondContact O-N 2.99Å; N856-V860 VanDerWaalsContact O-CG2 3.27Å; N856-V860 WeakPolarHBondContact O-CG2 3.49Å; N856-V860 PolarHBondContact O-N 2.72Å
857	L	97.4	Very high	97.3	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-63.4	-47.2	-177.8	174.6	62.4	0	0	0	110.9	L537 Y624 N855 T859 V860 V861	L537-L857 HydrophobicContact CD1-CD2 4.39Å; L537-L857 HydrophobicContact CD1-CG 4.42Å; L537-L857 HydrophobicContact CD2-CD2 4.43Å; Y624-L857 HydrophobicContact CD1-CB 3.85Å; Y624-L857 HydrophobicContact CD1-CD2 3.85Å; Y624-L857 HydrophobicContact CD1-CG 4.48Å; Y624-L857 HydrophobicContact CE1-CD2 4.26Å; Y624-L857 HydrophobicContact CG-CB 3.91Å; N855-L857 VanDerWaalsContact C-N 3.33Å; N855-L857 PolarHBondContact O-N 3.34Å; N855-L857 WeakPolarHBondContact OD1-CB 3.5Å; N855-L857 PolarHBondContact OD1-N 2.92Å; L857-T859 VanDerWaalsContact C-N 3.29Å; L857-T859 PolarHBondContact O-N 2.96Å; L857-V860 PolarHBondContact O-N 3.49Å; L857-V861 HydrophobicContact CD1-CG2 3.83Å; L857-V861 HydrophobicContact CG-CG2 4.43Å; L857-V861 VanDerWaalsContact O-CB 3.3Å; L857-V861 WeakPolarHBondContact O-CB 3.06Å; L857-V861 WeakPolarHBondContact O-CG2 3.28Å; L857-V861 PolarHBondContact O-N 2.97Å
858	L	98	Very high	97.1	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-60.8	-40.3	179.5	-69.3	-177.4	0	0	0	111.4	L537 V540 E849 L853 N855 G862	L537-L858 HydrophobicContact CB-CD2 4.3Å; L537-L858 WeakPolarHBondContact O-CD2 3.28Å; V540-L858 HydrophobicContact CB-CD2 4.13Å; V540-L858 HydrophobicContact CG1-CD1 4.35Å; V540-L858 HydrophobicContact CG1-CD2 4.43Å; V540-L858 HydrophobicContact CG1-CG 4.35Å; E849-L858 HydrophobicContact CB-CD1 4.29Å; E849-L858 HydrophobicContact CG-CD1 3.94Å; L853-L858 HydrophobicContact CD1-CD1 4.12Å; N855-L858 HydrophobicContact CB-CB 4.4Å; N855-L858 HydrophobicContact CB-CD1 4.11Å; N855-L858 HydrophobicContact CB-CG 4.23Å; N855-L858 PolarHBondContact O-N 3.44Å; N855-L858 PolarHBondContact OD1-N 3.24Å; L858-G862 WeakPolarHBondContact O-CA 3.5Å; L858-G862 PolarHBondContact O-N 3.23Å
859	T	97.6	Very high	97	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-69.6	-42.7	179.1	-38.6	0	0	0	0	112.2	M501 F505 F851 N855 N856 L857 A863	M501-T859 HydrophobicContact CG-CG2 4.11Å; M501-T859 HydrophobicContact SD-CG2 4.01Å; M501-T859 PolarHBondContact SD-OG1 3.07Å; F505-T859 HydrophobicContact CB-CG2 3.71Å; F505-T859 HydrophobicContact CD2-CG2 4.02Å; F505-T859 HydrophobicContact CG-CG2 4.34Å; F851-T859 HydrophobicContact CE2-CG2 4.2Å; F851-T859 HydrophobicContact CZ-CG2 4.31Å; N855-T859 PolarHBondContact O-N 2.96Å; N855-T859 PolarHBondContact O-OG1 2.83Å; N856-T859 PolarHBondContact O-N 2.99Å; L857-T859 VanDerWaalsContact C-N 3.29Å; L857-T859 PolarHBondContact O-N 2.96Å; T859-A863 WeakPolarHBondContact O-CB 3.31Å; T859-A863 PolarHBondContact O-N 3.48Å
860	V	98.1	Very high	96.9	Very high	28 Å²	28	15.6 Å²	15.6	17%	0.17	9%	0.089	C	C	.	.	H	α-helix	trans	-62.5	-49.7	176.2	169.9	0	0	0	0	110.8	T504 A508 N856 L857 A863 L864	T504-V860 HydrophobicContact CG2-CG2 3.57Å; A508-V860 HydrophobicContact CB-CB 4.24Å; A508-V860 HydrophobicContact CB-CG1 4.26Å; A508-V860 HydrophobicContact CB-CG2 4.11Å; N856-V860 VanDerWaalsContact O-CG2 3.27Å; N856-V860 WeakPolarHBondContact O-CG2 3.49Å; N856-V860 PolarHBondContact O-N 2.72Å; L857-V860 PolarHBondContact O-N 3.49Å; V860-A863 PolarHBondContact O-N 2.96Å; V860-L864 WeakPolarHBondContact O-CB 3.47Å; V860-L864 PolarHBondContact O-N 3.3Å; V860-L864 VanDerWaalsContact O-N 3.11Å
861	V	97.9	Very high	96.7	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-65.9	-43.6	-179.7	164	0	0	0	0	111.3	I534 L537 C631 L846 L857 A863 L864 I865	I534-V861 HydrophobicContact CG2-CB 4.41Å; I534-V861 HydrophobicContact CG2-CG1 3.46Å; I534-V861 VanDerWaalsContact CG2-CG1 3.46Å; I534-V861 HydrophobicContact CG2-CG2 4.1Å; L537-V861 HydrophobicContact CD1-CB 4.41Å; L537-V861 HydrophobicContact CD1-CG1 4.14Å; L537-V861 HydrophobicContact CD1-CG2 3.79Å; C631-V861 HydrophobicContact CB-CG2 4.13Å; L846-V861 HydrophobicContact CD2-CG1 3.75Å; L857-V861 HydrophobicContact CD1-CG2 3.83Å; L857-V861 HydrophobicContact CG-CG2 4.43Å; L857-V861 VanDerWaalsContact O-CB 3.3Å; L857-V861 WeakPolarHBondContact O-CB 3.06Å; L857-V861 WeakPolarHBondContact O-CG2 3.28Å; L857-V861 PolarHBondContact O-N 2.97Å; V861-A863 PolarHBondContact O-N 3.09Å; V861-L864 WeakPolarHBondContact O-CB 3.5Å; V861-L864 PolarHBondContact O-N 3.39Å; V861-I865 HydrophobicContact CG1-CD1 3.53Å; V861-I865 HydrophobicContact CG1-CG1 4.47Å; V861-I865 WeakPolarHBondContact O-CD1 3.5Å; V861-I865 WeakPolarHBondContact O-CG1 3.33Å; V861-I865 PolarHBondContact O-N 3.46Å
862	G	97.8	Very high	96.5	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-60.4	-44.7	177.9	0	0	0	0	0	112	G843 C847 L858 L864 I865 G866	G843-G862 CarbonylContact C-O 3.5Å; G843-G862 WeakPolarHBondContact CA-O 3.33Å; G843-G862 CarbonylContact O-C 3.58Å; G843-G862 WeakPolarHBondContact O-CA 3.37Å; C847-G862 VanDerWaalsContact SG-CA 3.57Å; L858-G862 WeakPolarHBondContact O-CA 3.5Å; L858-G862 PolarHBondContact O-N 3.23Å; G862-L864 VanDerWaalsContact C-N 3.32Å; G862-L864 PolarHBondContact O-N 2.92Å; G862-I865 PolarHBondContact O-N 3.33Å; G862-G866 PolarHBondContact O-N 3.47Å
863	A	97.7	Very high	96.4	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-65.6	-37	178.4	0	0	0	0	0	111.8	F505 A508 C847 T859 V860 V861 S867	F505-A863 HydrophobicContact CD2-CB 4.13Å; F505-A863 HydrophobicContact CE2-CB 4.25Å; A508-A863 HydrophobicContact CB-CB 3.95Å; C847-A863 PolarHBondContact SG-N 3.08Å; T859-A863 WeakPolarHBondContact O-CB 3.31Å; T859-A863 PolarHBondContact O-N 3.48Å; V860-A863 PolarHBondContact O-N 2.96Å; V861-A863 PolarHBondContact O-N 3.09Å; A863-S867 WeakPolarHBondContact O-CB 3.23Å; A863-S867 PolarHBondContact O-N 3.28Å; A863-S867 PolarHBondContact O-OG 2.88Å
864	L	96.6	Very high	96.2	Very high	3 Å²	3	18.8 Å²	18.8	2%	0.016	10%	0.099	C	C	.	.	H	α-helix	trans	-63.5	-46.4	175.5	-176.1	63.2	0	0	0	112.2	G512 C631 V632 L635 V860 V861 G862 S867 S868	G512-L864 VanDerWaalsContact CA-CD1 3.49Å; C631-L864 HydrophobicContact CB-CD2 4.44Å; V632-L864 HydrophobicContact CG2-CD2 4.15Å; L635-L864 HydrophobicContact CD1-CD2 4.1Å; L635-L864 HydrophobicContact CD2-CD1 3.76Å; L635-L864 HydrophobicContact CD2-CD2 4.16Å; L635-L864 HydrophobicContact CD2-CG 3.74Å; V860-L864 WeakPolarHBondContact O-CB 3.47Å; V860-L864 PolarHBondContact O-N 3.3Å; V860-L864 VanDerWaalsContact O-N 3.11Å; V861-L864 WeakPolarHBondContact O-CB 3.5Å; V861-L864 PolarHBondContact O-N 3.39Å; G862-L864 VanDerWaalsContact C-N 3.32Å; G862-L864 PolarHBondContact O-N 2.92Å; L864-S867 PolarHBondContact O-OG 2.95Å; L864-S868 WeakPolarHBondContact O-CB 3.25Å; L864-S868 PolarHBondContact O-N 3.31Å; L864-S868 VanDerWaalsContact O-N 3.1Å
865	I	97.3	Very high	95.9	Very high	2 Å²	2	16.4 Å²	16.4	1%	0.01	9%	0.086	C	C	.	.	H	α-helix	trans	-70.2	-42.7	177.9	-64.8	157	0	0	0	110.8	T531 I534 L846 V861 G862 S867 S868 G869	T531-I865 HydrophobicContact CG2-CG1 4.29Å; I534-I865 HydrophobicContact CG2-CD1 4.47Å; L846-I865 HydrophobicContact CD2-CD1 4.13Å; V861-I865 HydrophobicContact CG1-CD1 3.53Å; V861-I865 HydrophobicContact CG1-CG1 4.47Å; V861-I865 WeakPolarHBondContact O-CD1 3.5Å; V861-I865 WeakPolarHBondContact O-CG1 3.33Å; V861-I865 PolarHBondContact O-N 3.46Å; G862-I865 PolarHBondContact O-N 3.33Å; I865-S867 PolarHBondContact O-N 2.96Å; I865-S868 WeakPolarHBondContact O-CB 3.48Å; I865-S868 PolarHBondContact O-N 3.45Å; I865-G869 PolarHBondContact O-N 3.24Å
866	G	96.8	Very high	95.6	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-59.1	-48.2	179.6	0	0	0	0	0	112.2	S840 G862 A870	S840-G866 WeakPolarHBondContact CB-O 3.48Å; S840-G866 PolarHBondContact OG-O 3.4Å; G862-G866 PolarHBondContact O-N 3.47Å; G866-A870 WeakPolarHBondContact O-CB 3.4Å; G866-A870 PolarHBondContact O-N 2.93Å; G866-A870 VanDerWaalsContact O-N 3.14Å
867	S	95.4	Very high	95.3	Very high	12 Å²	12	14.6 Å²	14.6	8%	0.084	8%	0.077	C	C	.	.	H	α-helix	trans	-64.1	-41.1	174.6	55.1	0	0	0	0	112.4	G512 A863 L864 I865 A870 I871	G512-S867 WeakPolarHBondContact CA-OG 3.45Å; A863-S867 WeakPolarHBondContact O-CB 3.23Å; A863-S867 PolarHBondContact O-N 3.28Å; A863-S867 PolarHBondContact O-OG 2.88Å; L864-S867 PolarHBondContact O-OG 2.95Å; I865-S867 PolarHBondContact O-N 2.96Å; S867-A870 PolarHBondContact O-N 3.27Å; S867-I871 WeakPolarHBondContact O-CG1 3.38Å; S867-I871 PolarHBondContact O-N 3.29Å
868	S	95	Very high	94.8	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-58	-53	176.5	-178.6	0	0	0	0	112.9	L864 I865 A870 I871 L872	L864-S868 WeakPolarHBondContact O-CB 3.25Å; L864-S868 PolarHBondContact O-N 3.31Å; L864-S868 VanDerWaalsContact O-N 3.1Å; I865-S868 WeakPolarHBondContact O-CB 3.48Å; I865-S868 PolarHBondContact O-N 3.45Å; S868-A870 VanDerWaalsContact C-N 3.31Å; S868-A870 PolarHBondContact O-N 3.22Å; S868-I871 PolarHBondContact O-N 3.28Å; S868-L872 WeakPolarHBondContact O-CG 3.35Å; S868-L872 PolarHBondContact O-N 3.44Å
869	G	94.6	Very high	94.3	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.4	-42.2	177.5	0	0	0	0	0	112.4	T836 I865 L872 S873	T836-G869 CarbonylContact O-C 3.26Å; T836-G869 WeakPolarHBondContact O-CA 3.22Å; I865-G869 PolarHBondContact O-N 3.24Å; G869-L872 PolarHBondContact O-N 2.65Å; G869-S873 PolarHBondContact O-N 2.93Å; G869-S873 PolarHBondContact O-OG 3.2Å
870	A	94.8	Very high	93.6	Very high	45 Å²	45	19.7 Å²	19.7	37%	0.372	11%	0.107	S	C	.	.	H	α-helix	trans	-64.7	-42.5	-179.6	0	0	0	0	0	112.8	G866 S867 S868 S873 Y874	G866-A870 WeakPolarHBondContact O-CB 3.4Å; G866-A870 PolarHBondContact O-N 2.93Å; G866-A870 VanDerWaalsContact O-N 3.14Å; S867-A870 PolarHBondContact O-N 3.27Å; S868-A870 VanDerWaalsContact C-N 3.31Å; S868-A870 PolarHBondContact O-N 3.22Å; A870-S873 PolarHBondContact O-N 2.73Å; A870-Y874 WeakPolarHBondContact O-CB 3.41Å; A870-Y874 PolarHBondContact O-N 3.36Å
871	I	94.7	Very high	93	Very high	12 Å²	12	21 Å²	21	6%	0.062	11%	0.113	C	C	.	.	H	α-helix	trans	-65.8	-44.7	177.2	-70.9	165.2	0	0	0	110.5	Y513 V516 W517 S867 S868 S873 Y874 I875	Y513-I871 HydrophobicContact CD2-CD1 3.96Å; Y513-I871 HydrophobicContact CD2-CG1 4.47Å; Y513-I871 HydrophobicContact CG-CD1 4.45Å; V516-I871 HydrophobicContact CB-CD1 3.89Å; V516-I871 HydrophobicContact CG1-CB 4.07Å; V516-I871 HydrophobicContact CG1-CD1 4.02Å; V516-I871 HydrophobicContact CG1-CG2 3.97Å; W517-I871 HydrophobicContact CD2-CG2 4.09Å; W517-I871 HydrophobicContact CE3-CG2 4.49Å; W517-I871 HydrophobicContact CG-CD1 4.42Å; W517-I871 HydrophobicContact CH2-CG2 4.44Å; W517-I871 HydrophobicContact CZ2-CG2 4.03Å; S867-I871 WeakPolarHBondContact O-CG1 3.38Å; S867-I871 PolarHBondContact O-N 3.29Å; S868-I871 PolarHBondContact O-N 3.28Å; I871-S873 VanDerWaalsContact C-N 3.33Å; I871-S873 PolarHBondContact O-N 2.85Å; I871-Y874 WeakPolarHBondContact O-CB 3.42Å; I871-Y874 PolarHBondContact O-N 2.84Å; I871-Y874 VanDerWaalsContact O-N 3.12Å; I871-I875 HydrophobicContact CG2-CD1 3.77Å; I871-I875 HydrophobicContact CG2-CG1 4.31Å; I871-I875 WeakPolarHBondContact O-CG1 3.42Å; I871-I875 PolarHBondContact O-N 3.48Å
872	L	93.1	Very high	92.3	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-61.9	-41.4	177.1	-69.9	174.8	0	0	0	111.8	H524 L527 M528 T836 S868 G869 Y874 I875 M876	H524-L872 HydrophobicContact CB-CD2 4.09Å; L527-L872 HydrophobicContact CD2-CD1 4.15Å; L527-L872 HydrophobicContact CD2-CD2 4.36Å; L527-L872 HydrophobicContact CD2-CG 4.47Å; M528-L872 HydrophobicContact CG-CD1 3.58Å; M528-L872 HydrophobicContact SD-CD1 3.96Å; T836-L872 HydrophobicContact CG2-CB 3.71Å; S868-L872 WeakPolarHBondContact O-CG 3.35Å; S868-L872 PolarHBondContact O-N 3.44Å; G869-L872 PolarHBondContact O-N 2.65Å; L872-Y874 VanDerWaalsContact C-N 3.32Å; L872-Y874 PolarHBondContact O-N 3.48Å; L872-I875 PolarHBondContact O-N 3.13Å; L872-M876 WeakPolarHBondContact O-CB 3.45Å; L872-M876 VanDerWaalsContact O-CG 3.32Å; L872-M876 WeakPolarHBondContact O-CG 3.21Å; L872-M876 PolarHBondContact O-N 3.36Å
873	S	93.6	Very high	91.8	Very high	5 Å²	5	25.3 Å²	25.3	4%	0.035	14%	0.138	C	C	.	.	H	α-helix	trans	-60.3	-41.9	172.9	-60.5	0	0	0	0	112	T836 V837 G869 A870 I871 M876 C877	T836-S873 VanDerWaalsContact CB-OG 3.23Å; T836-S873 WeakPolarHBondContact CB-OG 3.37Å; T836-S873 WeakPolarHBondContact OG1-CA 3.49Å; T836-S873 PolarHBondContact OG1-OG 2.86Å; V837-S873 WeakPolarHBondContact CG2-OG 3.48Å; V837-S873 PolarHBondContact N-OG 3.47Å; V837-S873 VanDerWaalsContact N-OG 3.09Å; G869-S873 PolarHBondContact O-N 2.93Å; G869-S873 PolarHBondContact O-OG 3.2Å; A870-S873 PolarHBondContact O-N 2.73Å; I871-S873 VanDerWaalsContact C-N 3.33Å; I871-S873 PolarHBondContact O-N 2.85Å; S873-M876 PolarHBondContact O-N 2.97Å; S873-C877 WeakPolarHBondContact O-CB 3.34Å; S873-C877 PolarHBondContact O-N 3.24Å; S873-C877 PolarHBondContact O-SG 3.35Å
874	Y	92.9	Very high	91.2	Very high	138 Å²	138	29.2 Å²	29.2	54%	0.541	16%	0.159	S	C	.	.	H	α-helix	trans	-63.2	-49.6	177.2	175.7	-98.5	0	0	0	112.1	W517 A870 I871 L872 M876 C877 V878	W517-Y874 HydrophobicContact CH2-CD1 4.06Å; W517-Y874 HydrophobicContact CH2-CE1 4.13Å; W517-Y874 HydrophobicContact CZ2-CD1 4.11Å; W517-Y874 HydrophobicContact CZ2-CE1 4.3Å; A870-Y874 WeakPolarHBondContact O-CB 3.41Å; A870-Y874 PolarHBondContact O-N 3.36Å; I871-Y874 WeakPolarHBondContact O-CB 3.42Å; I871-Y874 PolarHBondContact O-N 2.84Å; I871-Y874 VanDerWaalsContact O-N 3.12Å; L872-Y874 VanDerWaalsContact C-N 3.32Å; L872-Y874 PolarHBondContact O-N 3.48Å; Y874-M876 VanDerWaalsContact C-N 3.29Å; Y874-M876 PolarHBondContact O-N 2.91Å; Y874-C877 WeakPolarHBondContact O-CB 3.19Å; Y874-C877 PolarHBondContact O-N 3.4Å; Y874-C877 VanDerWaalsContact O-N 3.16Å; Y874-V878 HydrophobicContact CD1-CG2 4.24Å; Y874-V878 HydrophobicContact CD2-CG2 4.17Å; Y874-V878 HydrophobicContact CE1-CG2 3.79Å; Y874-V878 HydrophobicContact CE2-CG2 3.71Å; Y874-V878 HydrophobicContact CG-CG2 4.42Å; Y874-V878 WeakPolarHBondContact O-CG2 3.11Å; Y874-V878 PolarHBondContact O-N 3.44Å
875	I	90.8	Very high	90.7	Very high	43 Å²	43	31.7 Å²	31.7	22%	0.221	18%	0.18	C	C	.	.	H	α-helix	trans	-56	-46.4	177.9	-69.6	169.3	0	0	0	110.3	W517 I871 L872 V878 A879	W517-I875 HydrophobicContact CH2-CD1 4.34Å; W517-I875 HydrophobicContact CH2-CG1 4Å; W517-I875 HydrophobicContact CZ3-CD1 4.02Å; W517-I875 HydrophobicContact CZ3-CG1 4.08Å; I871-I875 HydrophobicContact CG2-CD1 3.77Å; I871-I875 HydrophobicContact CG2-CG1 4.31Å; I871-I875 WeakPolarHBondContact O-CG1 3.42Å; I871-I875 PolarHBondContact O-N 3.48Å; L872-I875 PolarHBondContact O-N 3.13Å; I875-V878 PolarHBondContact O-N 2.6Å; I875-A879 VanDerWaalsContact O-CB 3.28Å; I875-A879 WeakPolarHBondContact O-CB 3.4Å; I875-A879 PolarHBondContact O-N 3.06Å
876	M	90.6	Very high	89.9	Confident	11 Å²	11	34 Å²	34	5%	0.054	19%	0.192	C	C	.	.	H	α-helix	trans	-62.2	-45.3	177.1	-74.6	-162.8	75.7	0	0	112.9	P832 V833 T836 L872 S873 Y874 A879 M880 V965 P970	P832-M876 VanDerWaalsContact C-SD 3.58Å; P832-M876 HydrophobicContact CB-CE 3.51Å; P832-M876 HydrophobicContact CB-SD 4.02Å; P832-M876 HydrophobicContact CG-CE 4.02Å; V833-M876 HydrophobicContact CG2-CB 4.01Å; V833-M876 HydrophobicContact CG2-CE 3.97Å; V833-M876 HydrophobicContact CG2-SD 4.2Å; T836-M876 HydrophobicContact CG2-SD 4.19Å; L872-M876 WeakPolarHBondContact O-CB 3.45Å; L872-M876 VanDerWaalsContact O-CG 3.32Å; L872-M876 WeakPolarHBondContact O-CG 3.21Å; L872-M876 PolarHBondContact O-N 3.36Å; S873-M876 PolarHBondContact O-N 2.97Å; Y874-M876 VanDerWaalsContact C-N 3.29Å; Y874-M876 PolarHBondContact O-N 2.91Å; M876-A879 PolarHBondContact O-N 3.35Å; M876-M880 VanDerWaalsContact O-CG 3.28Å; M876-M880 WeakPolarHBondContact O-CG 3.42Å; M876-M880 PolarHBondContact O-N 3.29Å; M876-M880 VanDerWaalsContact O-N 3.17Å; M876-V965 HydrophobicContact CE-CG1 4.31Å; M876-P970 HydrophobicContact CG-CG 4.04Å; M876-P970 HydrophobicContact SD-CG 3.55Å; M876-P970 VanDerWaalsContact SD-CG 3.55Å
877	C	90	Very high	89.3	Confident	7 Å²	7	34.1 Å²	34.1	5%	0.047	19%	0.192	C	C	.	.	H	α-helix	trans	-60.1	-46.7	177.7	-87.2	0	0	0	0	112	S873 Y874 M880 N881 R882	S873-C877 WeakPolarHBondContact O-CB 3.34Å; S873-C877 PolarHBondContact O-N 3.24Å; S873-C877 PolarHBondContact O-SG 3.35Å; Y874-C877 WeakPolarHBondContact O-CB 3.19Å; Y874-C877 PolarHBondContact O-N 3.4Å; Y874-C877 VanDerWaalsContact O-N 3.16Å; C877-M880 PolarHBondContact O-N 3.47Å; C877-N881 PolarHBondContact O-N 3.19Å; C877-N881 VanDerWaalsContact O-N 3.15Å; C877-R882 CarbonylContact C-O 3.58Å; C877-R882 WeakPolarHBondContact CA-O 3.48Å; C877-R882 WeakPolarHBondContact CB-O 3.35Å; C877-R882 PolarHBondContact O-N 3.39Å; C877-R882 VanDerWaalsContact O-O 3.06Å
878	V	88.3	Confident	88.8	Confident	74 Å²	74	35.3 Å²	35.3	45%	0.448	20%	0.197	S	C	.	.	H	α-helix	trans	-63.9	-44.8	177.7	172.7	0	0	0	0	111.2	Y874 I875 M880 N881	Y874-V878 HydrophobicContact CD1-CG2 4.24Å; Y874-V878 HydrophobicContact CD2-CG2 4.17Å; Y874-V878 HydrophobicContact CE1-CG2 3.79Å; Y874-V878 HydrophobicContact CE2-CG2 3.71Å; Y874-V878 HydrophobicContact CG-CG2 4.42Å; Y874-V878 WeakPolarHBondContact O-CG2 3.11Å; Y874-V878 PolarHBondContact O-N 3.44Å; I875-V878 PolarHBondContact O-N 2.6Å; V878-M880 PolarHBondContact O-N 3.48Å; V878-M880 VanDerWaalsContact O-N 3.13Å; V878-N881 PolarHBondContact O-N 2.89Å
879	A	86.9	Confident	88.1	Confident	8 Å²	8	39.1 Å²	39.1	7%	0.066	22%	0.218	C	C	.	.	H	α-helix	trans	-65.1	-15.8	178.4	0	0	0	0	0	114	I875 M876 P964 V965	I875-A879 VanDerWaalsContact O-CB 3.28Å; I875-A879 WeakPolarHBondContact O-CB 3.4Å; I875-A879 PolarHBondContact O-N 3.06Å; M876-A879 PolarHBondContact O-N 3.35Å; A879-P964 HydrophobicContact CB-CB 3.89Å; A879-P964 HydrophobicContact CB-CG 4.36Å; A879-V965 HydrophobicContact CB-CG1 3.75Å
880	M	83.5	Confident	86.6	Confident	25 Å²	25	40 Å²	40	12%	0.123	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-0.7	173.3	-64.2	173.5	67.3	0	0	112.9	D830 V833 M876 C877 V878 R882 V965	D830-M880 WeakPolarHBondContact OD1-CE 3.44Å; V833-M880 HydrophobicContact CG2-SD 4.23Å; M876-M880 VanDerWaalsContact O-CG 3.28Å; M876-M880 WeakPolarHBondContact O-CG 3.42Å; M876-M880 PolarHBondContact O-N 3.29Å; M876-M880 VanDerWaalsContact O-N 3.17Å; C877-M880 PolarHBondContact O-N 3.47Å; V878-M880 PolarHBondContact O-N 3.48Å; V878-M880 VanDerWaalsContact O-N 3.13Å; M880-R882 HydrophobicContact CB-CB 4.44Å; M880-R882 PolarHBondContact O-N 2.89Å; M880-V965 HydrophobicContact CG-CB 4.19Å; M880-V965 HydrophobicContact CG-CG1 3.63Å; M880-V965 HydrophobicContact CG-CG2 3.99Å; M880-V965 HydrophobicContact SD-CG1 4.13Å
881	N	85.1	Confident	84.9	Confident	55 Å²	55	39.4 Å²	39.4	29%	0.294	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	35.9	-167.7	-164.7	28.5	0	0	0	114.3	C877 V878 T894 A1025 G1026 M1027	C877-N881 PolarHBondContact O-N 3.19Å; C877-N881 VanDerWaalsContact O-N 3.15Å; V878-N881 PolarHBondContact O-N 2.89Å; N881-T894 HydrophobicContact CB-CG2 4.17Å; N881-T894 WeakPolarHBondContact O-CG2 3.22Å; N881-A1025 PolarHBondContact ND2-O 3.18Å; N881-G1026 WeakPolarHBondContact ND2-CA 3.48Å; N881-M1027 HydrophobicContact CB-CB 4.43Å
882	R	84.1	Confident	82.6	Confident	34 Å²	34	49.3 Å²	49.3	13%	0.128	26%	0.263	C	S	.	.			trans	-122.9	136.7	-178.8	-72.6	175	70.7	-164.7	-5.1	111.3	D830 C877 M880 V887 T894	D830-R882 IonicContact OD1-CZ 3.6Å; D830-R882 IonicContact OD1-NH1 3.55Å; D830-R882 PolarHBondContact OD1-NH1 3Å; D830-R882 IonicContact OD2-CZ 2.78Å; D830-R882 IonicContact OD2-NH1 3.55Å; D830-R882 PolarHBondContact OD2-NH1 3.43Å; D830-R882 IonicContact OD2-NH2 2.65Å; D830-R882 PolarHBondContact OD2-NH2 3.08Å; C877-R882 CarbonylContact C-O 3.58Å; C877-R882 WeakPolarHBondContact CA-O 3.48Å; C877-R882 WeakPolarHBondContact CB-O 3.35Å; C877-R882 PolarHBondContact O-N 3.39Å; C877-R882 VanDerWaalsContact O-O 3.06Å; M880-R882 HydrophobicContact CB-CB 4.44Å; M880-R882 PolarHBondContact O-N 2.89Å; R882-V887 HydrophobicContact CB-CG2 4.08Å; R882-T894 HydrophobicContact CG-CG2 3.71Å
883	S	86.3	Confident	80.6	Confident	56 Å²	56	49.8 Å²	49.8	39%	0.392	27%	0.268	S	S	.	.			trans	-72.5	151.7	173	74.5	0	0	0	0	111.4	A885 N886 V887	S883-A885 PolarHBondContact O-N 3.13Å; S883-N886 WeakPolarHBondContact O-CB 3.24Å; S883-N886 PolarHBondContact O-N 3.45Å; S883-N886 WeakPolarHBondContact OG-CB 3.39Å; S883-N886 PolarHBondContact OG-N 3Å; S883-N886 PolarHBondContact OG-ND2 3.44Å; S883-N886 PolarHBondContact OG-OD1 3.21Å; S883-V887 PolarHBondContact O-N 3.43Å; S883-V887 VanDerWaalsContact O-N 3.11Å
884	L	86	Confident	78.6	Confident	83 Å²	83	50.1 Å²	50.1	44%	0.435	27%	0.27	S	S	.	.	H	α-helix	trans	-56.4	-39.7	175.9	-177	64.8	0	0	0	112.1	V833 V837 N886 V887 I888	V833-L884 HydrophobicContact CG1-CD1 4.06Å; V837-L884 HydrophobicContact CG2-CD1 3.63Å; L884-N886 VanDerWaalsContact C-N 3.34Å; L884-N886 PolarHBondContact O-N 3.18Å; L884-V887 PolarHBondContact O-N 3.28Å; L884-I888 HydrophobicContact CD1-CG1 4.01Å; L884-I888 HydrophobicContact CG-CG1 4.28Å; L884-I888 WeakPolarHBondContact O-CG1 3.41Å; L884-I888 PolarHBondContact O-N 3.03Å
885	A	85.3	Confident	76.5	Confident	55 Å²	55	49.2 Å²	49.2	46%	0.455	28%	0.279	S	S	.	.	H	α-helix	trans	-61.3	-42	176.6	0	0	0	0	0	111.9	S883 V887 L889	S883-A885 PolarHBondContact O-N 3.13Å; A885-V887 VanDerWaalsContact C-N 3.32Å; A885-V887 PolarHBondContact O-N 2.88Å; A885-L889 VanDerWaalsContact O-CB 3.25Å; A885-L889 WeakPolarHBondContact O-CB 3.32Å; A885-L889 WeakPolarHBondContact O-CG 3.33Å; A885-L889 PolarHBondContact O-N 2.81Å
886	N	80.7	Confident	74.5	Confident	51 Å²	51	49.5 Å²	49.5	27%	0.273	29%	0.285	S	S	.	.	H	α-helix	trans	-65.3	-36.8	177.5	-72.8	-2.8	0	0	0	111.8	S883 L884 G890 G891	S883-N886 WeakPolarHBondContact O-CB 3.24Å; S883-N886 PolarHBondContact O-N 3.45Å; S883-N886 WeakPolarHBondContact OG-CB 3.39Å; S883-N886 PolarHBondContact OG-N 3Å; S883-N886 PolarHBondContact OG-ND2 3.44Å; S883-N886 PolarHBondContact OG-OD1 3.21Å; L884-N886 VanDerWaalsContact C-N 3.34Å; L884-N886 PolarHBondContact O-N 3.18Å; N886-G890 PolarHBondContact O-N 3.08Å; N886-G891 PolarHBondContact O-N 3.11Å
887	V	83.8	Confident	72.7	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-69.5	-51.5	177.5	177.5	0	0	0	0	111.2	D830 V833 R882 S883 L884 A885 G890	D830-V887 HydrophobicContact CB-CG1 4.03Å; V833-V887 HydrophobicContact CB-CG1 3.98Å; V833-V887 HydrophobicContact CG1-CB 4.46Å; V833-V887 HydrophobicContact CG1-CG1 3.89Å; V833-V887 HydrophobicContact CG2-CG1 4.38Å; R882-V887 HydrophobicContact CB-CG2 4.08Å; S883-V887 PolarHBondContact O-N 3.43Å; S883-V887 VanDerWaalsContact O-N 3.11Å; L884-V887 PolarHBondContact O-N 3.28Å; A885-V887 VanDerWaalsContact C-N 3.32Å; A885-V887 PolarHBondContact O-N 2.88Å; V887-G890 PolarHBondContact O-N 2.79Å
888	I	84.4	Confident	71.2	Confident	37 Å²	37	52.8 Å²	52.8	19%	0.19	31%	0.309	C	S	.	.	H	α-helix	trans	-72.1	-36.5	-174.6	-62.5	-62.6	0	0	0	112.8	L822 I826 V837 L884 G890	L822-I888 HydrophobicContact CD2-CG2 4.37Å; I826-I888 HydrophobicContact CD1-CD1 3.83Å; V837-I888 HydrophobicContact CG2-CD1 4.48Å; L884-I888 HydrophobicContact CD1-CG1 4.01Å; L884-I888 HydrophobicContact CG-CG1 4.28Å; L884-I888 WeakPolarHBondContact O-CG1 3.41Å; L884-I888 PolarHBondContact O-N 3.03Å; I888-G890 VanDerWaalsContact C-N 3.33Å
889	L	81.3	Confident	69.8	Low	81 Å²	81	53.3 Å²	53.3	42%	0.424	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-1.4	-178.7	-60.3	177.3	0	0	0	113.4	R777 H778 A885	R777-L889 PolarHBondContact NH2-O 3.48Å; H778-L889 PolarHBondContact CE1-O 3.17Å; A885-L889 VanDerWaalsContact O-CB 3.25Å; A885-L889 WeakPolarHBondContact O-CB 3.32Å; A885-L889 WeakPolarHBondContact O-CG 3.33Å; A885-L889 PolarHBondContact O-N 2.81Å
890	G	62.4	Low	69	Low	19 Å²	19	55 Å²	55	20%	0.196	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	45.2	177.3	0	0	0	0	0	113.3	R777 N886 V887 I888	R777-G890 PolarHBondContact NH2-O 3.44Å; N886-G890 PolarHBondContact O-N 3.08Å; V887-G890 PolarHBondContact O-N 2.79Å; I888-G890 VanDerWaalsContact C-N 3.33Å
891	G	58.3	Low	68.6	Low	31 Å²	31	62.9 Å²	62.9	32%	0.32	38%	0.38	S	S	.	.			trans	-67.8	132.6	168.2	0	0	0	0	0	110.4	N886 G893	N886-G891 PolarHBondContact O-N 3.11Å; G891-G893 PolarHBondContact O-N 3.3Å
892	Y	47.8	Very low	68.2	Low	220 Å²	220	63.8 Å²	63.8	86%	0.863	39%	0.389	S	S	*	.			trans	-68.7	115.6	174.5	-112.4	-92.2	0	0	0	109.4
893	G	51.6	Low	67.8	Low	12 Å²	12	67.2 Å²	67.2	12%	0.124	41%	0.408	C	S	.	.	S	Bend	trans	70.7	177.3	171.8	0	0	0	0	0	116.1	G891	G891-G893 PolarHBondContact O-N 3.3Å
894	T	49.6	Very low	67.3	Low	11 Å²	11	72.7 Å²	72.7	7%	0.067	43%	0.428	C	S	.	.	S	Bend	trans	-61.1	132.6	148.8	56.7	0	0	0	0	106.1	N881 R882 S896 I1023	N881-T894 HydrophobicContact CB-CG2 4.17Å; N881-T894 WeakPolarHBondContact O-CG2 3.22Å; R882-T894 HydrophobicContact CG-CG2 3.71Å; T894-S896 PolarHBondContact O-N 2.93Å; T894-I1023 PolarHBondContact N-O 3.49Å; T894-I1023 PolarHBondContact OG1-O 3.07Å
895	T	49.1	Very low	66.9	Low	119 Å²	119	71.6 Å²	71.6	73%	0.73	42%	0.422	S	S	*	.			trans	-48	112.8	165.8	14.7	0	0	0	0	106.6	T897	T895-T897 PolarHBondContact O-N 3.5Å; T895-T897 VanDerWaalsContact O-N 3.11Å
896	S	49.4	Very low	66.1	Low	49 Å²	49	74.8 Å²	74.8	34%	0.343	44%	0.435	S	S	.	.			trans	-51.5	125.1	-176.4	60.1	0	0	0	0	107.5	T894 A898	T894-S896 PolarHBondContact O-N 2.93Å; S896-A898 WeakPolarHBondContact CB-O 3.29Å; S896-A898 PolarHBondContact O-N 3.3Å; S896-A898 PolarHBondContact OG-O 3.05Å
897	T	53.3	Low	65.9	Low	56 Å²	56	75 Å²	75	34%	0.344	45%	0.45	S	S	.	.	S	Bend	trans	-58.1	-28.4	-173.7	-31.4	0	0	0	0	110.1	T895 P1020	T895-T897 PolarHBondContact O-N 3.5Å; T895-T897 VanDerWaalsContact O-N 3.11Å; T897-P1020 PolarHBondContact N-O 3.5Å; T897-P1020 VanDerWaalsContact N-O 3.1Å
898	A	57.3	Low	65.9	Low	32 Å²	32	80.8 Å²	80.8	26%	0.264	49%	0.485	S	S	.	.	S	Bend	trans	-120.4	134.5	164.2	0	0	0	0	0	110.5	S896 G900 P1020 N1021	S896-A898 WeakPolarHBondContact CB-O 3.29Å; S896-A898 PolarHBondContact O-N 3.3Å; S896-A898 PolarHBondContact OG-O 3.05Å; A898-G900 PolarHBondContact O-N 2.89Å; A898-P1020 HydrophobicContact CB-CB 4.26Å; A898-P1020 HydrophobicContact CB-CG 4.46Å; A898-P1020 PolarHBondContact N-O 2.85Å; A898-P1020 VanDerWaalsContact N-O 3.08Å; A898-N1021 WeakPolarHBondContact CB-OD1 3.21Å; A898-N1021 PolarHBondContact O-OD1 2.99Å; A898-N1021 VanDerWaalsContact O-OD1 3.09Å
899	G	60.4	Low	66.1	Low	84 Å²	84	81.7 Å²	81.7	87%	0.866	49%	0.489	S	S	*	.	S	Bend	trans	-73.9	25.7	-179.1	0	0	0	0	0	115.4
900	G	69.4	Low	66.5	Low	43 Å²	43	81.2 Å²	81.2	44%	0.443	49%	0.489	S	S	.	.	S	Bend	trans	-92.9	-176.6	-176.6	0	0	0	0	0	113.9	A898 N1021	A898-G900 PolarHBondContact O-N 2.89Å; G900-N1021 WeakPolarHBondContact CA-OD1 3.49Å; G900-N1021 PolarHBondContact N-OD1 3.3Å
901	K	75.1	Confident	68	Low	191 Å²	191	85.6 Å²	85.6	83%	0.83	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-78.2	140.8	171.4	-71.5	-176.2	177.5	-178.7	0	109.8	N1021	K901-N1021 WeakPolarHBondContact O-CB 3.46Å
902	P	76.5	Confident	69.8	Low	75 Å²	75	85.5 Å²	85.5	49%	0.487	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-54.3	150.8	170.3	-24.5	33.9	0	0	0	112.1	E904 D1019	P902-E904 PolarHBondContact O-N 3.42Å; P902-D1019 WeakPolarHBondContact CA-OD2 3.48Å
903	M	76.5	Confident	72	Confident	106 Å²	106	78.8 Å²	78.8	52%	0.522	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-59.2	133.5	177.4	-172.6	-178.1	-61.8	0	0	110.8	D1019	M903-D1019 HydrophobicContact CB-CB 4.37Å; M903-D1019 PolarHBondContact N-OD2 3.42Å
904	E	75.8	Confident	74	Confident	171 Å²	171	80.4 Å²	80.4	80%	0.799	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-70.8	134.3	172.5	-75	-169.8	170.5	0	0	110.5	P902 T906	P902-E904 PolarHBondContact O-N 3.42Å; E904-T906 PolarHBondContact O-N 3.04Å
905	I	76.4	Confident	76	Confident	60 Å²	60	84.4 Å²	84.4	31%	0.308	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-79.9	117.8	176.3	-64	-179.8	0	0	0	109	D1053 Y1058	I905-D1053 HydrophobicContact CD1-CB 3.18Å; I905-Y1058 HydrophobicContact CD1-CD2 4.49Å; I905-Y1058 HydrophobicContact CD1-CE2 4.19Å; I905-Y1058 HydrophobicContact CG2-CD1 4.04Å; I905-Y1058 HydrophobicContact CG2-CD2 3.36Å; I905-Y1058 HydrophobicContact CG2-CE1 4.23Å; I905-Y1058 HydrophobicContact CG2-CE2 3.62Å; I905-Y1058 HydrophobicContact CG2-CG 3.6Å
906	T	69.6	Low	78.1	Confident	121 Å²	121	82.1 Å²	82.1	74%	0.742	49%	0.485	S	S	*	.			trans	-104.1	134.4	175.1	60	0	0	0	0	110.6	E904	E904-T906 PolarHBondContact O-N 3.04Å
907	G	75.4	Confident	80.2	Confident	57 Å²	57	79.8 Å²	79.8	59%	0.588	47%	0.469	S	S	*	.	S	Bend	trans	122.7	-179.4	173.4	0	0	0	0	0	114.1
908	T	83.8	Confident	82.2	Confident	121 Å²	121	77.4 Å²	77.4	74%	0.742	46%	0.455	S	S	*	.			trans	-119.3	142.3	176.4	57.8	0	0	0	0	109.5
909	H	88.5	Confident	83.9	Confident	57 Å²	57	81.1 Å²	81.1	26%	0.264	47%	0.466	S	S	.	.			trans	-70.3	150.4	173.7	71.9	-76.3	0	0	0	110.9	E911 L1045 F1057 Y1058 M1064	H909-E911 IonicContact NE2-OE2 3.26Å; H909-L1045 VanDerWaalsContact CE1-CD1 3.49Å; H909-L1045 WeakPolarHBondContact CE1-CD1 3.16Å; H909-L1045 WeakPolarHBondContact ND1-CD1 3.25Å; H909-F1057 WeakPolarHBondContact CA-O 3.33Å; H909-F1057 VanDerWaalsContact CB-O 3.26Å; H909-F1057 WeakPolarHBondContact CB-O 3.38Å; H909-Y1058 HydrophobicContact CB-CD1 4.49Å; H909-M1064 HydrophobicContact CB-CG 4.03Å
910	T	91.3	Very high	85.5	Confident	70 Å²	70	79.6 Å²	79.6	43%	0.429	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	123.8	169.4	-58.9	0	0	0	0	108.4	A1063 M1064	T910-A1063 CarbonylContact O-C 3.03Å; T910-M1064 WeakPolarHBondContact O-CB 3.45Å; T910-M1064 PolarHBondContact O-N 2.93Å
911	E	93.8	Very high	86.8	Confident	112 Å²	112	77.5 Å²	77.5	52%	0.523	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	137	176.6	-169.2	177	175.5	0	0	110.7	H909 M1064	H909-E911 IonicContact NE2-OE2 3.26Å; E911-M1064 WeakPolarHBondContact CA-O 3.36Å
912	I	95.3	Very high	87.6	Confident	28 Å²	28	72.2 Å²	72.2	14%	0.144	39%	0.393	C	S	.	.			trans	-124.8	159	177.9	63.1	169.5	0	0	0	111.3	N916 A917 M920 I1039 A1063 M1064	I912-N916 HydrophobicContact CB-CB 4.35Å; I912-A917 HydrophobicContact CD1-CB 3.92Å; I912-M920 HydrophobicContact CD1-SD 4.18Å; I912-I1039 HydrophobicContact CD1-CD1 4.24Å; I912-I1039 HydrophobicContact CD1-CG1 4.22Å; I912-A1063 HydrophobicContact CB-CB 4.49Å; I912-A1063 HydrophobicContact CD1-CB 3.69Å; I912-A1063 HydrophobicContact CG1-CB 3.88Å; I912-A1063 HydrophobicContact CG2-CB 3.86Å; I912-M1064 PolarHBondContact N-O 3.4Å
913	N	94.6	Very high	88.5	Confident	80 Å²	80	75.7 Å²	75.7	43%	0.428	40%	0.403	S	S	.	.			trans	-95.2	177.2	172.3	68.1	26.4	0	0	0	111.5	D915 N916 A917	N913-D915 VanDerWaalsContact C-N 3.33Å; N913-D915 PolarHBondContact O-N 3.25Å; N913-D915 PolarHBondContact OD1-N 3Å; N913-D915 VanDerWaalsContact OD1-N 3.09Å; N913-N916 PolarHBondContact OD1-N 3.49Å; N913-N916 PolarHBondContact OD1-OD1 3.45Å; N913-A917 PolarHBondContact O-N 3.41Å; N913-A917 VanDerWaalsContact O-N 3.14Å
914	L	92.8	Very high	89.4	Confident	46 Å²	46	71 Å²	71	24%	0.241	38%	0.381	C	S	.	.	H	α-helix	trans	-62.4	-34.7	179.8	-80.2	167.4	0	0	0	113.9	A917 V918 L1065 A1075 L1076	L914-A917 PolarHBondContact O-N 2.95Å; L914-V918 VanDerWaalsContact O-CG2 3.28Å; L914-V918 WeakPolarHBondContact O-CG2 3.48Å; L914-V918 PolarHBondContact O-N 3.33Å; L914-L1065 HydrophobicContact CD2-CD1 4.38Å; L914-L1065 HydrophobicContact CD2-CD2 4.15Å; L914-L1065 HydrophobicContact CG-CD1 4.41Å; L914-A1075 HydrophobicContact CD1-CB 3.59Å; L914-A1075 HydrophobicContact CD2-CB 4.16Å; L914-L1076 HydrophobicContact CD2-CD2 3.81Å; L914-L1076 HydrophobicContact CD2-CG 3.95Å
915	D	92.1	Very high	90.4	Very high	95 Å²	95	66.4 Å²	66.4	51%	0.508	37%	0.368	S	S	.	.	H	α-helix	trans	-65.4	-47.4	-178.6	-69.5	-59.5	0	0	0	111.3	N913 A917 V918 E919 K1079	N913-D915 VanDerWaalsContact C-N 3.33Å; N913-D915 PolarHBondContact O-N 3.25Å; N913-D915 PolarHBondContact OD1-N 3Å; N913-D915 VanDerWaalsContact OD1-N 3.09Å; D915-A917 VanDerWaalsContact C-N 3.33Å; D915-A917 PolarHBondContact O-N 3.48Å; D915-V918 PolarHBondContact O-N 3.04Å; D915-E919 PolarHBondContact O-N 3.47Å; D915-K1079 IonicContact OD1-NZ 3.53Å; D915-K1079 PolarHBondContact OD1-NZ 3.26Å; D915-K1079 IonicContact OD2-NZ 3.58Å; D915-K1079 PolarHBondContact OD2-NZ 2.95Å
916	N	92.4	Very high	91.4	Very high	70 Å²	70	64.7 Å²	64.7	37%	0.374	36%	0.359	S	S	.	.	H	α-helix	trans	-66.3	-36.1	176.7	-64.7	126.8	0	0	0	112.2	I912 N913 E919 M920	I912-N916 HydrophobicContact CB-CB 4.35Å; N913-N916 PolarHBondContact OD1-N 3.49Å; N913-N916 PolarHBondContact OD1-OD1 3.45Å; N916-E919 PolarHBondContact O-N 2.91Å; N916-M920 WeakPolarHBondContact O-CG 3.37Å; N916-M920 PolarHBondContact O-N 2.76Å
917	A	94.8	Very high	92.8	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-62.7	-42.9	175.1	0	0	0	0	0	112.1	I912 N913 L914 D915 M920 I921 I1039 L1065 L1076	I912-A917 HydrophobicContact CD1-CB 3.92Å; N913-A917 PolarHBondContact O-N 3.41Å; N913-A917 VanDerWaalsContact O-N 3.14Å; L914-A917 PolarHBondContact O-N 2.95Å; D915-A917 VanDerWaalsContact C-N 3.33Å; D915-A917 PolarHBondContact O-N 3.48Å; A917-M920 PolarHBondContact O-N 3.37Å; A917-I921 VanDerWaalsContact O-CG1 3.28Å; A917-I921 WeakPolarHBondContact O-CG1 3.41Å; A917-I921 PolarHBondContact O-N 3.17Å; A917-I1039 HydrophobicContact CB-CD1 4.15Å; A917-L1065 HydrophobicContact CB-CD2 4.03Å; A917-L1076 HydrophobicContact CB-CD2 4.25Å
918	V	94.6	Very high	93.9	Very high	7 Å²	7	56.2 Å²	56.2	4%	0.042	30%	0.296	C	S	.	.	H	α-helix	trans	-65.5	-40.6	177	171.1	0	0	0	0	111.2	L914 D915 I921 K922 L1076 K1079 V1080	L914-V918 VanDerWaalsContact O-CG2 3.28Å; L914-V918 WeakPolarHBondContact O-CG2 3.48Å; L914-V918 PolarHBondContact O-N 3.33Å; D915-V918 PolarHBondContact O-N 3.04Å; V918-I921 PolarHBondContact O-N 2.85Å; V918-K922 HydrophobicContact CG1-CD 4.35Å; V918-K922 HydrophobicContact CG1-CG 4.5Å; V918-K922 WeakPolarHBondContact O-CG 3.26Å; V918-K922 PolarHBondContact O-N 3.08Å; V918-L1076 HydrophobicContact CG2-CD2 3.68Å; V918-K1079 HydrophobicContact CG1-CB 4.43Å; V918-K1079 HydrophobicContact CG2-CB 3.82Å; V918-K1079 HydrophobicContact CG2-CD 4.09Å; V918-V1080 HydrophobicContact CG1-CG2 4.34Å
919	E	93.4	Very high	94.6	Very high	109 Å²	109	50.6 Å²	50.6	51%	0.509	26%	0.261	S	S	.	.	H	α-helix	trans	-60.3	-46.7	176.3	-165.2	170.8	-155.6	0	0	111.5	D915 N916 I921 K922 E923	D915-E919 PolarHBondContact O-N 3.47Å; N916-E919 PolarHBondContact O-N 2.91Å; E919-I921 VanDerWaalsContact C-N 3.34Å; E919-I921 PolarHBondContact O-N 3.45Å; E919-K922 WeakPolarHBondContact O-CB 3.3Å; E919-K922 PolarHBondContact O-N 3.47Å; E919-K922 VanDerWaalsContact O-N 3.1Å; E919-E923 PolarHBondContact O-N 2.71Å
920	M	94.4	Very high	95.1	Very high	52 Å²	52	47.9 Å²	47.9	26%	0.256	25%	0.249	S	C	.	.	H	α-helix	trans	-60.1	-40.2	174.2	-71.7	177.1	149.3	0	0	113	I912 N916 A917 K922 E923 A924 Q1037 I1039	I912-M920 HydrophobicContact CD1-SD 4.18Å; N916-M920 WeakPolarHBondContact O-CG 3.37Å; N916-M920 PolarHBondContact O-N 2.76Å; A917-M920 PolarHBondContact O-N 3.37Å; M920-K922 VanDerWaalsContact C-N 3.31Å; M920-K922 PolarHBondContact O-N 3.46Å; M920-E923 PolarHBondContact O-N 2.86Å; M920-A924 WeakPolarHBondContact O-CB 3.47Å; M920-A924 PolarHBondContact O-N 3.13Å; M920-A924 VanDerWaalsContact O-N 3.14Å; M920-Q1037 HydrophobicContact CE-CG 3.95Å; M920-Q1037 HydrophobicContact SD-CG 4.08Å; M920-I1039 HydrophobicContact CB-CD1 4.39Å; M920-I1039 HydrophobicContact SD-CD1 4.26Å
921	I	95.4	Very high	95.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.4	-37	175.8	-70.1	164.8	0	0	0	111.1	A917 V918 E919 I927 L951 K956 L1002 L1004 L1076	A917-I921 VanDerWaalsContact O-CG1 3.28Å; A917-I921 WeakPolarHBondContact O-CG1 3.41Å; A917-I921 PolarHBondContact O-N 3.17Å; V918-I921 PolarHBondContact O-N 2.85Å; E919-I921 VanDerWaalsContact C-N 3.34Å; E919-I921 PolarHBondContact O-N 3.45Å; I921-I927 HydrophobicContact CG2-CD1 4.3Å; I921-L951 HydrophobicContact CG2-CD1 4.01Å; I921-L951 HydrophobicContact CG2-CD2 3.82Å; I921-K956 PolarHBondContact O-NZ 3.35Å; I921-L1002 HydrophobicContact CB-CD2 4.29Å; I921-L1002 HydrophobicContact CG1-CD2 3.61Å; I921-L1004 HydrophobicContact CD1-CD1 4.45Å; I921-L1004 HydrophobicContact CG1-CD2 4.5Å; I921-L1076 HydrophobicContact CD1-CD1 4.47Å; I921-L1076 HydrophobicContact CD1-CD2 4.07Å
922	K	93.1	Very high	95.3	Very high	79 Å²	79	39.5 Å²	39.5	34%	0.343	21%	0.206	S	C	.	.	H	α-helix	trans	-67.2	-41	177.7	-72.1	176.5	175.6	-179.7	0	112.1	V918 E919 M920 K956 S1083 Y1084	V918-K922 HydrophobicContact CG1-CD 4.35Å; V918-K922 HydrophobicContact CG1-CG 4.5Å; V918-K922 WeakPolarHBondContact O-CG 3.26Å; V918-K922 PolarHBondContact O-N 3.08Å; E919-K922 WeakPolarHBondContact O-CB 3.3Å; E919-K922 PolarHBondContact O-N 3.47Å; E919-K922 VanDerWaalsContact O-N 3.1Å; M920-K922 VanDerWaalsContact C-N 3.31Å; M920-K922 PolarHBondContact O-N 3.46Å; K922-K956 PolarHBondContact O-NZ 3.18Å; K922-S1083 VanDerWaalsContact CE-OG 3.27Å; K922-S1083 WeakPolarHBondContact CE-OG 3.41Å; K922-S1083 PolarHBondContact NZ-OG 3.32Å; K922-Y1084 HydrophobicContact CG-CE2 4.12Å; K922-Y1084 WeakPolarHBondContact CG-OH 3.33Å
923	E	94.1	Very high	95	Very high	148 Å²	148	41.4 Å²	41.4	69%	0.692	21%	0.211	S	C	*	.	H	α-helix	trans	-69.3	-32.8	179.2	-69.6	-178	167.8	0	0	113.1	E919 M920	E919-E923 PolarHBondContact O-N 2.71Å; M920-E923 PolarHBondContact O-N 2.86Å
924	A	96.5	Very high	94.8	Very high	7 Å²	7	39 Å²	39	6%	0.058	21%	0.205	C	C	.	.			trans	-72.9	136.7	-176.5	0	0	0	0	0	113.2	M920 I927 K956 D1001 L1002	M920-A924 WeakPolarHBondContact O-CB 3.47Å; M920-A924 PolarHBondContact O-N 3.13Å; M920-A924 VanDerWaalsContact O-N 3.14Å; A924-I927 HydrophobicContact CB-CD1 4.19Å; A924-I927 HydrophobicContact CB-CG1 3.91Å; A924-K956 PolarHBondContact O-NZ 2.97Å; A924-D1001 HydrophobicContact CB-CB 3.87Å; A924-L1002 HydrophobicContact CB-CB 3.61Å; A924-L1002 HydrophobicContact CB-CD2 4.12Å
925	S	96.3	Very high	94.9	Very high	76 Å²	76	36.8 Å²	36.8	53%	0.531	19%	0.194	S	C	.	.	S	Bend	trans	-102.8	-33.4	175.4	-63.2	0	0	0	0	112.7	N957 D1001	S925-N957 PolarHBondContact O-N 2.93Å; S925-D1001 PolarHBondContact N-OD2 3.28Å
926	N	97.7	Very high	94.7	Very high	24 Å²	24	32.8 Å²	32.8	13%	0.128	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	113.9	175.8	-173.2	20.1	0	0	0	110.3	N957 R959 E999 T1000 D1001 L1002	N926-N957 PolarHBondContact OD1-ND2 2.83Å; N926-N957 VanDerWaalsContact OD1-ND2 3.15Å; N926-R959 PolarHBondContact OD1-NH2 3.29Å; N926-E999 PolarHBondContact ND2-O 3.46Å; N926-T1000 PolarHBondContact ND2-OG1 3.32Å; N926-T1000 WeakPolarHBondContact O-CG2 3.32Å; N926-D1001 PolarHBondContact N-OD2 3.5Å; N926-D1001 WeakPolarHBondContact O-CB 3.45Å; N926-D1001 PolarHBondContact O-N 3.14Å; N926-L1002 PolarHBondContact O-N 3.16Å
927	I	98.6	Very high	94.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	128.3	-174.2	-53.4	176.1	0	0	0	110.1	I921 A924 L951 K956 N957 V958 R959 L1002 L1004	I921-I927 HydrophobicContact CG2-CD1 4.3Å; A924-I927 HydrophobicContact CB-CD1 4.19Å; A924-I927 HydrophobicContact CB-CG1 3.91Å; I927-L951 HydrophobicContact CD1-CD1 4.17Å; I927-K956 HydrophobicContact CD1-CD 4.39Å; I927-N957 PolarHBondContact N-O 2.92Å; I927-V958 HydrophobicContact CB-CG1 4.31Å; I927-V958 HydrophobicContact CB-CG2 4.28Å; I927-V958 HydrophobicContact CD1-CG2 4.42Å; I927-V958 HydrophobicContact CG2-CG1 4.42Å; I927-V958 WeakPolarHBondContact O-CA 3.46Å; I927-R959 PolarHBondContact O-N 3.03Å; I927-L1002 VanDerWaalsContact CA-O 3.28Å; I927-L1002 WeakPolarHBondContact CA-O 3.46Å; I927-L1002 HydrophobicContact CG1-CB 4.36Å; I927-L1004 HydrophobicContact CG2-CD1 4.34Å; I927-L1004 HydrophobicContact CG2-CG 4.26Å
928	I	98.7	Very high	94.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	132.4	170.7	-63.5	173.7	0	0	0	109.4	T930 R959 I993 D996 F997 T1000 L1002 V1003 L1004	I928-T930 HydrophobicContact CG2-CG2 4.1Å; I928-R959 CarbonylContact C-O 3.58Å; I928-R959 WeakPolarHBondContact CA-O 3.36Å; I928-I993 HydrophobicContact CD1-CD1 3.89Å; I928-I993 HydrophobicContact CD1-CG1 3.92Å; I928-I993 HydrophobicContact CG1-CD1 4.07Å; I928-I993 HydrophobicContact CG2-CD1 3.7Å; I928-D996 HydrophobicContact CD1-CB 4.5Å; I928-F997 HydrophobicContact CB-CE1 4.23Å; I928-F997 HydrophobicContact CD1-CD1 3.98Å; I928-F997 HydrophobicContact CD1-CE1 3.95Å; I928-F997 HydrophobicContact CG2-CE1 3.83Å; I928-F997 HydrophobicContact CG2-CZ 4.15Å; I928-T1000 HydrophobicContact CB-CG2 4.19Å; I928-T1000 HydrophobicContact CD1-CG2 3.92Å; I928-T1000 WeakPolarHBondContact CD1-OG1 3.46Å; I928-T1000 HydrophobicContact CG1-CG2 3.82Å; I928-L1002 PolarHBondContact N-O 3.02Å; I928-V1003 HydrophobicContact CB-CG2 4.37Å; I928-V1003 CarbonylContact O-C 3.36Å; I928-V1003 VanDerWaalsContact O-CA 3.25Å; I928-V1003 WeakPolarHBondContact O-CA 3.47Å; I928-L1004 PolarHBondContact O-N 3.06Å
929	I	98.6	Very high	94.3	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.3	173.6	-54.8	-179.2	0	0	0	108.2	P931 I944 V948 V958 R959 F960 G961 L1004 I1006	I929-P931 WeakPolarHBondContact O-CD 3.33Å; I929-I944 HydrophobicContact CD1-CG2 4.13Å; I929-V948 HydrophobicContact CD1-CG2 3.43Å; I929-V948 VanDerWaalsContact CD1-CG2 3.43Å; I929-V958 HydrophobicContact CD1-CG1 4.15Å; I929-V958 HydrophobicContact CG1-CG1 4.43Å; I929-R959 PolarHBondContact N-O 3.3Å; I929-F960 HydrophobicContact CB-CD1 3.82Å; I929-F960 HydrophobicContact CB-CE1 3.94Å; I929-F960 HydrophobicContact CB-CG 4.47Å; I929-F960 HydrophobicContact CD1-CE1 4.12Å; I929-F960 HydrophobicContact CD1-CZ 4.13Å; I929-F960 HydrophobicContact CG2-CD1 3.94Å; I929-F960 HydrophobicContact CG2-CE1 3.8Å; I929-F960 CarbonylContact O-C 3.56Å; I929-F960 VanDerWaalsContact O-CA 3.29Å; I929-F960 WeakPolarHBondContact O-CA 3.3Å; I929-G961 PolarHBondContact O-N 2.97Å; I929-L1004 WeakPolarHBondContact CA-O 3.18Å; I929-L1004 HydrophobicContact CD1-CD1 4.49Å; I929-L1004 HydrophobicContact CG1-CB 4.24Å; I929-L1004 HydrophobicContact CG1-CD1 4.29Å; I929-L1004 HydrophobicContact CG2-CB 4.5Å; I929-I1006 HydrophobicContact CG2-CD1 3.89Å; I929-I1006 HydrophobicContact CG2-CG1 4.35Å
930	T	98.1	Very high	94.4	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	90.7	175.3	63	0	0	0	0	109.2	I928 F997 V1003 L1004 V1005 I1006 L1030 V1032	I928-T930 HydrophobicContact CG2-CG2 4.1Å; T930-F997 HydrophobicContact CG2-CE1 4.31Å; T930-F997 HydrophobicContact CG2-CZ 4.04Å; T930-V1003 HydrophobicContact CG2-CG1 4.08Å; T930-L1004 PolarHBondContact N-O 3.08Å; T930-V1005 WeakPolarHBondContact OG1-CA 3.39Å; T930-V1005 WeakPolarHBondContact OG1-CG2 3.44Å; T930-I1006 PolarHBondContact O-N 3.05Å; T930-L1030 HydrophobicContact CG2-CB 4.48Å; T930-L1030 HydrophobicContact CG2-CD1 3.83Å; T930-V1032 HydrophobicContact CG2-CG1 3.83Å
931	P	96.7	Very high	94.4	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.013	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	148.1	-178.2	31.1	-34.5	0	0	0	111.7	I929 L935 F960 I962 L973 L977	I929-P931 WeakPolarHBondContact O-CD 3.33Å; P931-L935 HydrophobicContact CB-CD1 3.99Å; P931-F960 HydrophobicContact CG-CD1 4.08Å; P931-I962 HydrophobicContact CG-CD1 3.61Å; P931-L973 HydrophobicContact CB-CD1 4.36Å; P931-L973 HydrophobicContact CB-CD2 3.96Å; P931-L973 HydrophobicContact CB-CG 4.46Å; P931-L973 HydrophobicContact CG-CD2 3.65Å; P931-L973 HydrophobicContact CG-CG 4.12Å; P931-L973 WeakPolarHBondContact O-CD2 3.38Å; P931-L977 HydrophobicContact CG-CD1 4.29Å
932	G	93.4	Very high	94.4	Very high	3 Å²	3	36.7 Å²	36.7	3%	0.031	20%	0.197	C	C	.	.			trans	-122.9	-179.1	167.1	0	0	0	0	0	112	G934 L935 I1006 G1007	G932-G934 PolarHBondContact O-N 2.77Å; G932-G934 VanDerWaalsContact O-N 3.08Å; G932-L935 WeakPolarHBondContact O-CB 3.43Å; G932-L935 PolarHBondContact O-N 2.64Å; G932-L935 VanDerWaalsContact O-N 3.07Å; G932-I1006 PolarHBondContact N-O 3.04Å; G932-G1007 CarbonylContact C-O 3.59Å; G932-G1007 WeakPolarHBondContact CA-O 3.25Å
933	Y	89.1	Confident	94.6	Very high	68 Å²	68	33.1 Å²	33.1	27%	0.267	18%	0.182	S	C	.	.	H	α-helix	trans	-57.9	-27.2	180	-176.4	-104.4	0	0	0	113	L935 C936 A937 R968	Y933-L935 VanDerWaalsContact C-N 3.26Å; Y933-L935 PolarHBondContact O-N 3.48Å; Y933-C936 PolarHBondContact O-N 3.27Å; Y933-A937 HydrophobicContact CD1-CB 4.14Å; Y933-A937 HydrophobicContact CE1-CB 3.73Å; Y933-A937 WeakPolarHBondContact O-CB 3.37Å; Y933-A937 PolarHBondContact O-N 3.18Å; Y933-R968 HydrophobicContact CD2-CG 3.89Å; Y933-R968 HydrophobicContact CE1-CG 4.45Å; Y933-R968 VanDerWaalsContact CE1-NE 3.25Å; Y933-R968 HydrophobicContact CE2-CB 4.42Å; Y933-R968 HydrophobicContact CE2-CG 3.61Å; Y933-R968 HydrophobicContact CG-CG 4.43Å; Y933-R968 VanDerWaalsContact CZ-CD 3.46Å; Y933-R968 VanDerWaalsContact CZ-CZ 3.47Å; Y933-R968 WeakPolarHBondContact OH-CD 3.41Å; Y933-R968 PolarHBondContact OH-NE 3.47Å; Y933-R968 VanDerWaalsContact OH-NE 3.11Å; Y933-R968 PolarHBondContact OH-NH1 3.36Å
934	G	90.4	Very high	94.7	Very high	29 Å²	29	26.1 Å²	26.1	30%	0.299	15%	0.149	S	C	.	.	H	α-helix	trans	-59.8	-32.6	177	0	0	0	0	0	114.1	G932 A938 G1007	G932-G934 PolarHBondContact O-N 2.77Å; G932-G934 VanDerWaalsContact O-N 3.08Å; G934-A938 WeakPolarHBondContact O-CB 3.38Å; G934-A938 PolarHBondContact O-N 3.49Å; G934-G1007 PolarHBondContact N-O 3.44Å
935	L	93.9	Very high	94.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.7	-48.5	175.8	174.3	149.7	0	0	0	110.7	P931 G932 Y933 A938 K939 A940 Q941 I944 I1006	P931-L935 HydrophobicContact CB-CD1 3.99Å; G932-L935 WeakPolarHBondContact O-CB 3.43Å; G932-L935 PolarHBondContact O-N 2.64Å; G932-L935 VanDerWaalsContact O-N 3.07Å; Y933-L935 VanDerWaalsContact C-N 3.26Å; Y933-L935 PolarHBondContact O-N 3.48Å; L935-A938 PolarHBondContact O-N 2.94Å; L935-K939 PolarHBondContact O-N 3.44Å; L935-A940 HydrophobicContact CG-CB 4.25Å; L935-A940 WeakPolarHBondContact O-CB 3.43Å; L935-A940 PolarHBondContact O-N 3.3Å; L935-Q941 HydrophobicContact CD2-CB 3.59Å; L935-I944 HydrophobicContact CD1-CG1 4.19Å; L935-I1006 HydrophobicContact CB-CG2 4.05Å; L935-I1006 HydrophobicContact CD1-CB 3.99Å; L935-I1006 HydrophobicContact CD1-CD1 4.17Å; L935-I1006 HydrophobicContact CD1-CG2 3.88Å; L935-I1006 HydrophobicContact CG-CG2 4.35Å
936	C	89.2	Confident	94.7	Very high	11 Å²	11	24.9 Å²	24.9	7%	0.074	14%	0.138	C	C	.	.	H	α-helix	trans	-72.2	-39	-178.2	-62.6	0	0	0	0	112.8	Y933 A938 K939 L973 L976	Y933-C936 PolarHBondContact O-N 3.27Å; C936-A938 PolarHBondContact O-N 2.97Å; C936-K939 PolarHBondContact O-N 3.14Å; C936-L973 WeakPolarHBondContact SG-CD1 3.13Å; C936-L976 HydrophobicContact CB-CD1 3.69Å; C936-L976 WeakPolarHBondContact SG-CD1 3.45Å
937	A	88.3	Confident	94.6	Very high	61 Å²	61	23.8 Å²	23.8	50%	0.504	13%	0.132	S	C	.	.	H	α-helix	trans	-60	-33.1	176.6	0	0	0	0	0	112	Y933 K939	Y933-A937 HydrophobicContact CD1-CB 4.14Å; Y933-A937 HydrophobicContact CE1-CB 3.73Å; Y933-A937 WeakPolarHBondContact O-CB 3.37Å; Y933-A937 PolarHBondContact O-N 3.18Å; A937-K939 VanDerWaalsContact C-N 3.35Å
938	A	91.7	Very high	94.5	Very high	25 Å²	25	24 Å²	24	21%	0.207	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-2.4	175.2	0	0	0	0	0	113.9	G934 L935 C936 A940 A1069 K1070	G934-A938 WeakPolarHBondContact O-CB 3.38Å; G934-A938 PolarHBondContact O-N 3.49Å; L935-A938 PolarHBondContact O-N 2.94Å; C936-A938 PolarHBondContact O-N 2.97Å; A938-A940 HydrophobicContact CB-CB 4.41Å; A938-A940 PolarHBondContact O-N 2.91Å; A938-A1069 HydrophobicContact CB-CB 3.96Å; A938-K1070 HydrophobicContact CB-CB 4.28Å; A938-K1070 WeakPolarHBondContact O-CB 3.31Å
939	K	92.4	Very high	94.4	Very high	124 Å²	124	29.7 Å²	29.7	54%	0.539	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	34.7	-171.2	-56.9	-174.9	175.9	-172.2	0	113.4	L935 C936 A937 K1070	L935-K939 PolarHBondContact O-N 3.44Å; C936-K939 PolarHBondContact O-N 3.14Å; A937-K939 VanDerWaalsContact C-N 3.35Å; K939-K1070 WeakPolarHBondContact O-CD 3.02Å
940	A	95.4	Very high	94.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.161	C	C	.	.			trans	-87.5	-1.5	-177.3	0	0	0	0	0	113.8	L935 A938 Y942 P943 I944 A1069 K1070 C1073	L935-A940 HydrophobicContact CG-CB 4.25Å; L935-A940 WeakPolarHBondContact O-CB 3.43Å; L935-A940 PolarHBondContact O-N 3.3Å; A938-A940 HydrophobicContact CB-CB 4.41Å; A938-A940 PolarHBondContact O-N 2.91Å; A940-Y942 VanDerWaalsContact C-N 3.3Å; A940-Y942 PolarHBondContact O-N 3.12Å; A940-P943 VanDerWaalsContact O-CD 3.25Å; A940-P943 WeakPolarHBondContact O-CD 3.11Å; A940-P943 VanDerWaalsContact O-CG 3.26Å; A940-P943 WeakPolarHBondContact O-CG 3.37Å; A940-I944 WeakPolarHBondContact O-CG1 3.19Å; A940-I944 PolarHBondContact O-N 2.9Å; A940-A1069 HydrophobicContact CB-CB 4.3Å; A940-K1070 HydrophobicContact CB-CD 4.39Å; A940-C1073 HydrophobicContact CB-CB 4.32Å
941	Q	95.2	Very high	94.1	Very high	7 Å²	7	30.4 Å²	30.4	3%	0.033	16%	0.161	C	C	.	.	H	α-helix	trans	-61.2	-35	176.5	63.3	-84.2	21.4	0	0	113.4	L935 I944 A945 L977 A980	L935-Q941 HydrophobicContact CD2-CB 3.59Å; Q941-I944 PolarHBondContact O-N 3.45Å; Q941-A945 WeakPolarHBondContact O-CB 3.29Å; Q941-A945 PolarHBondContact O-N 3.48Å; Q941-L977 HydrophobicContact CB-CD2 4.5Å; Q941-A980 HydrophobicContact CB-CB 3.88Å; Q941-A980 HydrophobicContact CG-CB 3.7Å
942	Y	95.7	Very high	94	Very high	104 Å²	104	34.9 Å²	34.9	41%	0.408	18%	0.178	S	C	.	.	H	α-helix	trans	-66	-53.4	-178.3	-59	-79.3	0	0	0	113.8	A940 I944 A945 D946 A980	A940-Y942 VanDerWaalsContact C-N 3.3Å; A940-Y942 PolarHBondContact O-N 3.12Å; Y942-I944 PolarHBondContact O-N 3.38Å; Y942-A945 PolarHBondContact O-N 2.9Å; Y942-D946 PolarHBondContact O-N 3.16Å; Y942-A980 HydrophobicContact CD1-CB 4.2Å; Y942-A980 HydrophobicContact CE1-CB 4.49Å
943	P	96.2	Very high	94.1	Very high	4 Å²	4	41.2 Å²	41.2	3%	0.026	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-31.2	175.8	25.7	-36.1	0	0	0	112.4	A940 L947 K1070 C1073 D1074 Q1077	A940-P943 VanDerWaalsContact O-CD 3.25Å; A940-P943 WeakPolarHBondContact O-CD 3.11Å; A940-P943 VanDerWaalsContact O-CG 3.26Å; A940-P943 WeakPolarHBondContact O-CG 3.37Å; P943-L947 VanDerWaalsContact O-CB 3.31Å; P943-L947 WeakPolarHBondContact O-CB 3.34Å; P943-L947 PolarHBondContact O-N 3.1Å; P943-K1070 HydrophobicContact CG-CD 4.3Å; P943-C1073 HydrophobicContact CB-CB 4.25Å; P943-C1073 HydrophobicContact CG-CB 3.83Å; P943-D1074 WeakPolarHBondContact CB-OD1 3.47Å; P943-D1074 WeakPolarHBondContact CG-OD1 3.03Å; P943-Q1077 HydrophobicContact CB-CB 4.44Å
944	I	96.6	Very high	94.3	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-68.2	-42	175	-71.3	-61.5	0	0	0	111.9	I929 L935 A940 Q941 Y942 D946 L947 V948 F960 I1006 C1073	I929-I944 HydrophobicContact CD1-CG2 4.13Å; L935-I944 HydrophobicContact CD1-CG1 4.19Å; A940-I944 WeakPolarHBondContact O-CG1 3.19Å; A940-I944 PolarHBondContact O-N 2.9Å; Q941-I944 PolarHBondContact O-N 3.45Å; Y942-I944 PolarHBondContact O-N 3.38Å; I944-D946 VanDerWaalsContact C-N 3.31Å; I944-D946 PolarHBondContact O-N 3.15Å; I944-L947 HydrophobicContact CD1-CD2 4.11Å; I944-L947 PolarHBondContact O-N 3.15Å; I944-V948 HydrophobicContact CG2-CG2 4.3Å; I944-V948 WeakPolarHBondContact O-CB 3.49Å; I944-V948 VanDerWaalsContact O-CG2 3.26Å; I944-V948 WeakPolarHBondContact O-CG2 3.14Å; I944-V948 PolarHBondContact O-N 3.16Å; I944-F960 HydrophobicContact CG2-CE1 3.94Å; I944-F960 HydrophobicContact CG2-CZ 3.86Å; I944-I1006 HydrophobicContact CD1-CD1 3.56Å; I944-I1006 HydrophobicContact CG1-CD1 3.99Å; I944-C1073 HydrophobicContact CD1-CB 4.02Å; I944-C1073 VanDerWaalsContact CD1-SG 3.58Å; I944-C1073 HydrophobicContact CG1-CB 4.06Å
945	A	96.4	Very high	94.5	Very high	13 Å²	13	43.4 Å²	43.4	11%	0.107	23%	0.23	C	C	.	.	H	α-helix	trans	-59.9	-42.4	176	0	0	0	0	0	111.7	Q941 Y942 V948 K949 A980 V982	Q941-A945 WeakPolarHBondContact O-CB 3.29Å; Q941-A945 PolarHBondContact O-N 3.48Å; Y942-A945 PolarHBondContact O-N 2.9Å; A945-V948 PolarHBondContact O-N 2.98Å; A945-K949 WeakPolarHBondContact O-CB 3.47Å; A945-K949 PolarHBondContact O-N 3.48Å; A945-A980 HydrophobicContact CB-CB 3.92Å; A945-A980 VanDerWaalsContact CB-O 3.27Å; A945-A980 WeakPolarHBondContact CB-O 3.24Å; A945-V982 HydrophobicContact CB-CG2 3.67Å
946	D	95.8	Very high	94.7	Very high	44 Å²	44	44.7 Å²	44.7	24%	0.235	24%	0.236	C	C	.	.	H	α-helix	trans	-68.5	-39.9	175.7	-166.9	61.1	0	0	0	112.3	Y942 I944 K949 M950 Q1077 R1081	Y942-D946 PolarHBondContact O-N 3.16Å; I944-D946 VanDerWaalsContact C-N 3.31Å; I944-D946 PolarHBondContact O-N 3.15Å; D946-K949 WeakPolarHBondContact O-CB 3.37Å; D946-K949 PolarHBondContact O-N 3.45Å; D946-M950 WeakPolarHBondContact O-CG 3.49Å; D946-M950 PolarHBondContact O-N 3.24Å; D946-M950 WeakPolarHBondContact OD2-CE 3.32Å; D946-Q1077 VanDerWaalsContact CB-NE2 3.32Å; D946-Q1077 PolarHBondContact OD2-NE2 2.85Å; D946-R1081 IonicContact OD2-CZ 3.79Å; D946-R1081 IonicContact OD2-NH2 2.78Å; D946-R1081 PolarHBondContact OD2-NH2 3.04Å
947	L	95.7	Very high	95.1	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-59.4	-47.3	173.9	175.9	62.1	0	0	0	111.6	P943 I944 K949 M950 L951 L1076 V1080	P943-L947 VanDerWaalsContact O-CB 3.31Å; P943-L947 WeakPolarHBondContact O-CB 3.34Å; P943-L947 PolarHBondContact O-N 3.1Å; I944-L947 HydrophobicContact CD1-CD2 4.11Å; I944-L947 PolarHBondContact O-N 3.15Å; L947-K949 VanDerWaalsContact C-N 3.31Å; L947-K949 PolarHBondContact O-N 3.2Å; L947-M950 PolarHBondContact O-N 3.4Å; L947-L951 HydrophobicContact CD1-CD1 4.01Å; L947-L951 HydrophobicContact CD1-CG 4.15Å; L947-L951 HydrophobicContact CG-CD1 4.02Å; L947-L951 VanDerWaalsContact O-CG 3.31Å; L947-L951 WeakPolarHBondContact O-CG 3.12Å; L947-L951 PolarHBondContact O-N 2.98Å; L947-L1076 HydrophobicContact CD2-CB 4.31Å; L947-V1080 HydrophobicContact CD1-CB 3.84Å; L947-V1080 HydrophobicContact CD1-CG1 3.8Å; L947-V1080 HydrophobicContact CD1-CG2 3.78Å
948	V	97.2	Very high	95.5	Very high	4 Å²	4	45 Å²	45	2%	0.024	23%	0.228	C	C	.	.	H	α-helix	trans	-59.8	-43.7	176.6	169	0	0	0	0	110.7	I929 I944 A945 L951 R952 V958 F960 I986	I929-V948 HydrophobicContact CD1-CG2 3.43Å; I929-V948 VanDerWaalsContact CD1-CG2 3.43Å; I944-V948 HydrophobicContact CG2-CG2 4.3Å; I944-V948 WeakPolarHBondContact O-CB 3.49Å; I944-V948 VanDerWaalsContact O-CG2 3.26Å; I944-V948 WeakPolarHBondContact O-CG2 3.14Å; I944-V948 PolarHBondContact O-N 3.16Å; A945-V948 PolarHBondContact O-N 2.98Å; V948-L951 PolarHBondContact O-N 3.2Å; V948-R952 HydrophobicContact CG1-CG 4.4Å; V948-R952 WeakPolarHBondContact O-CB 3.37Å; V948-R952 WeakPolarHBondContact O-CG 3.47Å; V948-R952 PolarHBondContact O-N 2.92Å; V948-V958 HydrophobicContact CB-CG1 4.39Å; V948-V958 HydrophobicContact CG1-CB 4.24Å; V948-V958 HydrophobicContact CG1-CG1 4.02Å; V948-V958 HydrophobicContact CG2-CG1 3.88Å; V948-F960 HydrophobicContact CB-CE2 4.49Å; V948-F960 HydrophobicContact CG1-CE2 4.21Å; V948-F960 HydrophobicContact CG2-CE2 3.85Å; V948-F960 HydrophobicContact CG2-CZ 3.72Å; V948-I986 HydrophobicContact CG1-CD1 3.79Å
949	K	95.8	Very high	95.8	Very high	119 Å²	119	45.4 Å²	45.4	52%	0.517	22%	0.224	S	C	.	.	H	α-helix	trans	-57.9	-51	176	-176.8	-176.9	172.7	-171.6	0	111.4	A945 D946 L947 L951 R952 E953	A945-K949 WeakPolarHBondContact O-CB 3.47Å; A945-K949 PolarHBondContact O-N 3.48Å; D946-K949 WeakPolarHBondContact O-CB 3.37Å; D946-K949 PolarHBondContact O-N 3.45Å; L947-K949 VanDerWaalsContact C-N 3.31Å; L947-K949 PolarHBondContact O-N 3.2Å; K949-L951 VanDerWaalsContact C-N 3.35Å; K949-L951 PolarHBondContact O-N 3.44Å; K949-R952 PolarHBondContact O-N 3.3Å; K949-E953 WeakPolarHBondContact CE-OE1 3.39Å; K949-E953 WeakPolarHBondContact O-CG 3.5Å; K949-E953 PolarHBondContact O-N 3.46Å
950	M	94.9	Very high	96.1	Very high	16 Å²	16	39.5 Å²	39.5	8%	0.079	20%	0.199	C	C	.	.	H	α-helix	trans	-60.6	-40.9	179.4	-71.7	-175.2	-71.5	0	0	112.7	D946 L947 E953 Q1077 R1081	D946-M950 WeakPolarHBondContact O-CG 3.49Å; D946-M950 PolarHBondContact O-N 3.24Å; D946-M950 WeakPolarHBondContact OD2-CE 3.32Å; L947-M950 PolarHBondContact O-N 3.4Å; M950-E953 PolarHBondContact O-N 3.39Å; M950-Q1077 HydrophobicContact CE-CB 4.49Å; M950-Q1077 HydrophobicContact CE-CG 3.58Å; M950-R1081 HydrophobicContact SD-CB 3.91Å; M950-R1081 HydrophobicContact SD-CG 4.22Å
951	L	95.9	Very high	96.2	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-68.4	-38.3	178.2	-67.4	172.1	0	0	0	111.9	I921 I927 L947 V948 K949 Q954 K956 V958 V1080	I921-L951 HydrophobicContact CG2-CD1 4.01Å; I921-L951 HydrophobicContact CG2-CD2 3.82Å; I927-L951 HydrophobicContact CD1-CD1 4.17Å; L947-L951 HydrophobicContact CD1-CD1 4.01Å; L947-L951 HydrophobicContact CD1-CG 4.15Å; L947-L951 HydrophobicContact CG-CD1 4.02Å; L947-L951 VanDerWaalsContact O-CG 3.31Å; L947-L951 WeakPolarHBondContact O-CG 3.12Å; L947-L951 PolarHBondContact O-N 2.98Å; V948-L951 PolarHBondContact O-N 3.2Å; K949-L951 VanDerWaalsContact C-N 3.35Å; K949-L951 PolarHBondContact O-N 3.44Å; L951-Q954 WeakPolarHBondContact O-CB 3.41Å; L951-Q954 PolarHBondContact O-N 3.38Å; L951-K956 HydrophobicContact CB-CD 4.17Å; L951-K956 HydrophobicContact CD2-CD 3.81Å; L951-K956 WeakPolarHBondContact O-CB 3.18Å; L951-K956 PolarHBondContact O-N 3.33Å; L951-V958 HydrophobicContact CB-CG2 3.79Å; L951-V958 HydrophobicContact CD1-CG2 4.38Å; L951-V1080 HydrophobicContact CD2-CG1 4.16Å
952	R	95.2	Very high	96.3	Very high	96 Å²	96	39.3 Å²	39.3	36%	0.362	20%	0.198	S	C	.	.	H	α-helix	trans	-68.9	-34	175.8	-73	-176.7	69.8	-172.1	5.5	112.6	V948 K949 Q954 G955 V958	V948-R952 HydrophobicContact CG1-CG 4.4Å; V948-R952 WeakPolarHBondContact O-CB 3.37Å; V948-R952 WeakPolarHBondContact O-CG 3.47Å; V948-R952 PolarHBondContact O-N 2.92Å; K949-R952 PolarHBondContact O-N 3.3Å; R952-Q954 PolarHBondContact O-N 2.99Å; R952-Q954 VanDerWaalsContact O-N 3.17Å; R952-G955 PolarHBondContact O-N 3.27Å; R952-V958 HydrophobicContact CG-CB 4.1Å; R952-V958 HydrophobicContact CG-CG2 4.26Å
953	E	94.4	Very high	96.3	Very high	136 Å²	136	34.4 Å²	34.4	64%	0.636	18%	0.179	S	C	*	.	H	α-helix	trans	-60.4	-21.2	172.9	-75.7	171.5	178.6	0	0	112.5	K949 M950	K949-E953 WeakPolarHBondContact CE-OE1 3.39Å; K949-E953 WeakPolarHBondContact O-CG 3.5Å; K949-E953 PolarHBondContact O-N 3.46Å; M950-E953 PolarHBondContact O-N 3.39Å
954	Q	93.6	Very high	96.1	Very high	74 Å²	74	36.1 Å²	36.1	35%	0.346	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	7.1	174.1	-62.9	168.8	13.4	0	0	113.9	L951 R952 Y1084	L951-Q954 WeakPolarHBondContact O-CB 3.41Å; L951-Q954 PolarHBondContact O-N 3.38Å; R952-Q954 PolarHBondContact O-N 2.99Å; R952-Q954 VanDerWaalsContact O-N 3.17Å; Q954-Y1084 PolarHBondContact OE1-OH 2.85Å
955	G	95.2	Very high	95.8	Very high	70 Å²	70	37.5 Å²	37.5	72%	0.722	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.7	11.4	-179.9	0	0	0	0	0	115	R952	R952-G955 PolarHBondContact O-N 3.27Å
956	K	97	Very high	95.5	Very high	26 Å²	26	37.3 Å²	37.3	11%	0.113	20%	0.197	C	C	.	.			trans	-73.3	143.2	172.5	-62.3	176.6	-179.8	-70.4	0	110.5	I921 K922 A924 I927 L951 V958 Y1084	I921-K956 PolarHBondContact O-NZ 3.35Å; K922-K956 PolarHBondContact O-NZ 3.18Å; A924-K956 PolarHBondContact O-NZ 2.97Å; I927-K956 HydrophobicContact CD1-CD 4.39Å; L951-K956 HydrophobicContact CB-CD 4.17Å; L951-K956 HydrophobicContact CD2-CD 3.81Å; L951-K956 WeakPolarHBondContact O-CB 3.18Å; L951-K956 PolarHBondContact O-N 3.33Å; K956-V958 HydrophobicContact CB-CG2 4.05Å; K956-V958 PolarHBondContact O-N 2.92Å; K956-Y1084 WeakPolarHBondContact CE-OH 3.45Å
957	N	97.6	Very high	95.1	Very high	77 Å²	77	36.3 Å²	36.3	41%	0.412	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	103.7	172.8	-176	23.7	0	0	0	109.2	S925 N926 I927 R959	S925-N957 PolarHBondContact O-N 2.93Å; N926-N957 PolarHBondContact OD1-ND2 2.83Å; N926-N957 VanDerWaalsContact OD1-ND2 3.15Å; I927-N957 PolarHBondContact N-O 2.92Å; N957-R959 PolarHBondContact ND2-NE 3.49Å
958	V	98.2	Very high	94.8	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	119.5	-178.2	-168.6	0	0	0	0	110.3	I927 I929 V948 L951 R952 K956	I927-V958 HydrophobicContact CB-CG1 4.31Å; I927-V958 HydrophobicContact CB-CG2 4.28Å; I927-V958 HydrophobicContact CD1-CG2 4.42Å; I927-V958 HydrophobicContact CG2-CG1 4.42Å; I927-V958 WeakPolarHBondContact O-CA 3.46Å; I929-V958 HydrophobicContact CD1-CG1 4.15Å; I929-V958 HydrophobicContact CG1-CG1 4.43Å; V948-V958 HydrophobicContact CB-CG1 4.39Å; V948-V958 HydrophobicContact CG1-CB 4.24Å; V948-V958 HydrophobicContact CG1-CG1 4.02Å; V948-V958 HydrophobicContact CG2-CG1 3.88Å; L951-V958 HydrophobicContact CB-CG2 3.79Å; L951-V958 HydrophobicContact CD1-CG2 4.38Å; R952-V958 HydrophobicContact CG-CB 4.1Å; R952-V958 HydrophobicContact CG-CG2 4.26Å; K956-V958 HydrophobicContact CB-CG2 4.05Å; K956-V958 PolarHBondContact O-N 2.92Å
959	R	98.3	Very high	94.3	Very high	34 Å²	34	40.8 Å²	40.8	13%	0.128	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	157.4	-173.9	-61.2	175	-67.5	157.6	2.8	111.2	N926 I927 I928 I929 N957 I986 I993 D996	N926-R959 PolarHBondContact OD1-NH2 3.29Å; I927-R959 PolarHBondContact O-N 3.03Å; I928-R959 CarbonylContact C-O 3.58Å; I928-R959 WeakPolarHBondContact CA-O 3.36Å; I929-R959 PolarHBondContact N-O 3.3Å; N957-R959 PolarHBondContact ND2-NE 3.49Å; R959-I986 CarbonylContact C-O 3.51Å; R959-I986 WeakPolarHBondContact CA-O 3.23Å; R959-I993 HydrophobicContact CB-CD1 4.4Å; R959-D996 IonicContact CZ-OD2 2.78Å; R959-D996 IonicContact NH1-OD2 2.81Å; R959-D996 PolarHBondContact NH1-OD2 3.46Å; R959-D996 IonicContact NH2-OD2 3.91Å; R959-D996 PolarHBondContact NH2-OD2 2.9Å
960	F	98.3	Very high	94.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	134.9	174.2	-70	-95.4	0	0	0	110.4	I929 P931 I944 V948 I962 L977 V982 I986 V987 L988	I929-F960 HydrophobicContact CB-CD1 3.82Å; I929-F960 HydrophobicContact CB-CE1 3.94Å; I929-F960 HydrophobicContact CB-CG 4.47Å; I929-F960 HydrophobicContact CD1-CE1 4.12Å; I929-F960 HydrophobicContact CD1-CZ 4.13Å; I929-F960 HydrophobicContact CG2-CD1 3.94Å; I929-F960 HydrophobicContact CG2-CE1 3.8Å; I929-F960 CarbonylContact O-C 3.56Å; I929-F960 VanDerWaalsContact O-CA 3.29Å; I929-F960 WeakPolarHBondContact O-CA 3.3Å; P931-F960 HydrophobicContact CG-CD1 4.08Å; I944-F960 HydrophobicContact CG2-CE1 3.94Å; I944-F960 HydrophobicContact CG2-CZ 3.86Å; V948-F960 HydrophobicContact CB-CE2 4.49Å; V948-F960 HydrophobicContact CG1-CE2 4.21Å; V948-F960 HydrophobicContact CG2-CE2 3.85Å; V948-F960 HydrophobicContact CG2-CZ 3.72Å; F960-I962 HydrophobicContact CB-CD1 4.33Å; F960-L977 HydrophobicContact CD1-CD1 3.95Å; F960-L977 HydrophobicContact CD1-CD2 4.32Å; F960-L977 HydrophobicContact CE1-CD1 4.33Å; F960-L977 HydrophobicContact CE1-CD2 3.87Å; F960-L977 HydrophobicContact CG-CD1 4.23Å; F960-L977 HydrophobicContact CZ-CD2 4.26Å; F960-V982 HydrophobicContact CD2-CG1 3.82Å; F960-V982 HydrophobicContact CE2-CB 4.47Å; F960-V982 HydrophobicContact CE2-CG1 3.48Å; F960-V982 VanDerWaalsContact CE2-CG1 3.48Å; F960-V982 HydrophobicContact CE2-CG2 4.09Å; F960-V982 HydrophobicContact CZ-CG1 4.29Å; F960-V982 HydrophobicContact CZ-CG2 4.13Å; F960-I986 HydrophobicContact CD2-CD1 4.3Å; F960-I986 HydrophobicContact CE2-CD1 4.26Å; F960-I986 PolarHBondContact N-O 3.44Å; F960-V987 HydrophobicContact CB-CG1 4.41Å; F960-V987 HydrophobicContact CB-CG2 4.26Å; F960-V987 HydrophobicContact CD2-CG2 4.22Å; F960-V987 HydrophobicContact CG-CG2 4.47Å; F960-L988 PolarHBondContact O-N 3.4Å
961	G	97.8	Very high	93.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	115.1	169.7	0	0	0	0	0	110.7	I929	I929-G961 PolarHBondContact O-N 2.97Å
962	I	97.1	Very high	93.6	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.015	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	125.6	-176.8	-52.6	-55.9	0	0	0	110.1	P931 F960 L973 L977 V987 L988 M990	P931-I962 HydrophobicContact CG-CD1 3.61Å; F960-I962 HydrophobicContact CB-CD1 4.33Å; I962-L973 HydrophobicContact CD1-CD2 4.08Å; I962-L973 HydrophobicContact CD1-CG 4.17Å; I962-L973 HydrophobicContact CG2-CB 4.46Å; I962-L973 HydrophobicContact CG2-CD2 4.48Å; I962-L977 HydrophobicContact CD1-CD1 3.74Å; I962-V987 HydrophobicContact CD1-CG1 4.06Å; I962-V987 HydrophobicContact CG1-CG1 3.48Å; I962-V987 VanDerWaalsContact CG1-CG1 3.48Å; I962-L988 PolarHBondContact N-O 3.46Å; I962-M990 PolarHBondContact O-N 3.49Å
963	H	95.8	Very high	93.6	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	18%	0.176	C	C	.	.			trans	-82.6	136.8	170.9	-169.5	-75.8	0	0	0	109.9	V965 A966 M990 T1011 M1027 P1028 L1030	H963-V965 VanDerWaalsContact C-N 3.25Å; H963-V965 VanDerWaalsContact CE1-CG2 3.47Å; H963-V965 WeakPolarHBondContact CE1-CG2 3.44Å; H963-V965 WeakPolarHBondContact ND1-CG2 3.47Å; H963-V965 PolarHBondContact ND1-N 2.88Å; H963-V965 PolarHBondContact O-N 3.48Å; H963-V965 VanDerWaalsContact O-N 3.07Å; H963-A966 HydrophobicContact CB-CB 4.03Å; H963-A966 VanDerWaalsContact O-CB 3.31Å; H963-A966 WeakPolarHBondContact O-CB 3.49Å; H963-A966 PolarHBondContact O-N 2.86Å; H963-M990 VanDerWaalsContact CD2-SD 3.57Å; H963-T1011 HydrophobicContact CB-CG2 3.82Å; H963-T1011 VanDerWaalsContact CG-CG2 3.45Å; H963-M1027 WeakPolarHBondContact CE1-CE 3.44Å; H963-P1028 PolarHBondContact NE2-O 3.17Å; H963-L1030 HydrophobicContact CB-CD1 4.09Å
964	P	91.2	Very high	93.6	Very high	41 Å²	41	24.6 Å²	24.6	27%	0.266	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-31.6	-172.7	-28.6	34.4	0	0	0	115.5	A879 M990	A879-P964 HydrophobicContact CB-CB 3.89Å; A879-P964 HydrophobicContact CB-CG 4.36Å; P964-M990 HydrophobicContact CG-CE 4.19Å
965	V	90.6	Very high	93.6	Very high	29 Å²	29	21.1 Å²	21.1	18%	0.176	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	10.6	176	-57.9	0	0	0	0	114.7	M876 A879 M880 H963 G967 M1027	M876-V965 HydrophobicContact CE-CG1 4.31Å; A879-V965 HydrophobicContact CB-CG1 3.75Å; M880-V965 HydrophobicContact CG-CB 4.19Å; M880-V965 HydrophobicContact CG-CG1 3.63Å; M880-V965 HydrophobicContact CG-CG2 3.99Å; M880-V965 HydrophobicContact SD-CG1 4.13Å; H963-V965 VanDerWaalsContact C-N 3.25Å; H963-V965 VanDerWaalsContact CE1-CG2 3.47Å; H963-V965 WeakPolarHBondContact CE1-CG2 3.44Å; H963-V965 WeakPolarHBondContact ND1-CG2 3.47Å; H963-V965 PolarHBondContact ND1-N 2.88Å; H963-V965 PolarHBondContact O-N 3.48Å; H963-V965 VanDerWaalsContact O-N 3.07Å; V965-G967 PolarHBondContact O-N 3.44Å; V965-G967 VanDerWaalsContact O-N 3.12Å; V965-M1027 HydrophobicContact CG2-CE 4.03Å
966	A	89.9	Confident	93.6	Very high	9 Å²	9	18 Å²	18	7%	0.074	10%	0.097	C	C	.	.			trans	-71.9	106.8	175.2	0	0	0	0	0	110.8	H963 L973	H963-A966 HydrophobicContact CB-CB 4.03Å; H963-A966 VanDerWaalsContact O-CB 3.31Å; H963-A966 WeakPolarHBondContact O-CB 3.49Å; H963-A966 PolarHBondContact O-N 2.86Å; A966-L973 HydrophobicContact CB-CD2 3.79Å
967	G	87.2	Confident	93.5	Very high	23 Å²	23	16.8 Å²	16.8	24%	0.237	9%	0.092	C	C	.	.	S	Bend	trans	137.5	-162	177.9	0	0	0	0	0	112.3	V965	V965-G967 PolarHBondContact O-N 3.44Å; V965-G967 VanDerWaalsContact O-N 3.12Å
968	R	88.9	Confident	93.4	Very high	94 Å²	94	13.5 Å²	13.5	36%	0.355	8%	0.076	S	C	.	.	S	Bend	trans	-114	6	173.7	-67.9	-175.4	174.5	-172.7	1.7	113	P700 L763 P832 Y933	P700-R968 HydrophobicContact CG-CB 4.12Å; L763-R968 PolarHBondContact O-NH1 2.97Å; P832-R968 WeakPolarHBondContact CB-O 3.41Å; P832-R968 VanDerWaalsContact CG-O 3.31Å; P832-R968 WeakPolarHBondContact CG-O 3.45Å; Y933-R968 HydrophobicContact CD2-CG 3.89Å; Y933-R968 HydrophobicContact CE1-CG 4.45Å; Y933-R968 VanDerWaalsContact CE1-NE 3.25Å; Y933-R968 HydrophobicContact CE2-CB 4.42Å; Y933-R968 HydrophobicContact CE2-CG 3.61Å; Y933-R968 HydrophobicContact CG-CG 4.43Å; Y933-R968 VanDerWaalsContact CZ-CD 3.46Å; Y933-R968 VanDerWaalsContact CZ-CZ 3.47Å; Y933-R968 WeakPolarHBondContact OH-CD 3.41Å; Y933-R968 PolarHBondContact OH-NE 3.47Å; Y933-R968 VanDerWaalsContact OH-NE 3.11Å; Y933-R968 PolarHBondContact OH-NH1 3.36Å
969	M	88.4	Confident	93.3	Very high	6 Å²	6	15.6 Å²	15.6	3%	0.03	9%	0.086	C	C	.	.	S	Bend	trans	-158.9	146.9	177.6	177.3	-179.8	173.4	0	0	109.1	M528 L699 P700 V703 G971 Q972	M528-M969 HydrophobicContact CB-CE 3.52Å; M528-M969 HydrophobicContact CE-CE 3.44Å; M528-M969 VanDerWaalsContact CE-CE 3.44Å; M528-M969 HydrophobicContact CE-CG 3.67Å; M528-M969 HydrophobicContact CE-SD 4.15Å; M528-M969 HydrophobicContact CG-CE 4.07Å; L699-M969 HydrophobicContact CD2-CE 4.23Å; L699-M969 HydrophobicContact CD2-SD 3.99Å; L699-M969 HydrophobicContact CG-CE 4.49Å; L699-M969 HydrophobicContact CG-SD 4.01Å; P700-M969 HydrophobicContact CB-CB 4.21Å; P700-M969 HydrophobicContact CG-CB 3.84Å; P700-M969 HydrophobicContact CG-SD 4.44Å; V703-M969 HydrophobicContact CG2-CE 3.89Å; V703-M969 HydrophobicContact CG2-SD 4.22Å; M969-G971 PolarHBondContact O-N 3.28Å; M969-Q972 HydrophobicContact CB-CB 4.13Å; M969-Q972 VanDerWaalsContact O-CB 3.23Å; M969-Q972 WeakPolarHBondContact O-CB 3.23Å; M969-Q972 PolarHBondContact O-N 2.99Å; M969-Q972 VanDerWaalsContact O-N 3.08Å
970	P	89.6	Confident	93.1	Very high	5 Å²	5	14.8 Å²	14.8	3%	0.032	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	125.4	175.9	-29.4	35.8	0	0	0	112.9	H524 S525 T836 M876 Q972	H524-P970 HydrophobicContact CB-CB 3.91Å; S525-P970 PolarHBondContact N-O 3.33Å; S525-P970 PolarHBondContact OG-O 2.98Å; T836-P970 HydrophobicContact CG2-CG 3.84Å; M876-P970 HydrophobicContact CG-CG 4.04Å; M876-P970 HydrophobicContact SD-CG 3.55Å; M876-P970 VanDerWaalsContact SD-CG 3.55Å; P970-Q972 PolarHBondContact O-N 2.58Å
971	G	89.8	Confident	92.9	Very high	10 Å²	10	17.6 Å²	17.6	10%	0.103	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	10.7	179.6	0	0	0	0	0	115.2	M969 L973 N974 V975	M969-G971 PolarHBondContact O-N 3.28Å; G971-L973 VanDerWaalsContact C-N 3.26Å; G971-L973 PolarHBondContact O-N 3.47Å; G971-N974 PolarHBondContact O-N 2.7Å; G971-N974 PolarHBondContact O-OD1 3.19Å; G971-V975 PolarHBondContact O-N 3.12Å
972	Q	92.2	Very high	92.8	Very high	5 Å²	5	18.1 Å²	18.1	2%	0.023	12%	0.118	C	C	.	.	H	α-helix	trans	-60.1	-39.1	-177.6	-172.3	-177.1	19	0	0	111.9	S525 S697 M969 P970 N974 V975 L976	S525-Q972 PolarHBondContact OG-N 2.87Å; S697-Q972 PolarHBondContact O-NE2 3.42Å; M969-Q972 HydrophobicContact CB-CB 4.13Å; M969-Q972 VanDerWaalsContact O-CB 3.23Å; M969-Q972 WeakPolarHBondContact O-CB 3.23Å; M969-Q972 PolarHBondContact O-N 2.99Å; M969-Q972 VanDerWaalsContact O-N 3.08Å; P970-Q972 PolarHBondContact O-N 2.58Å; Q972-N974 VanDerWaalsContact C-N 3.34Å; Q972-N974 PolarHBondContact O-N 2.8Å; Q972-V975 PolarHBondContact O-N 3.5Å; Q972-L976 HydrophobicContact CG-CD1 3.84Å; Q972-L976 HydrophobicContact CG-CG 4.32Å; Q972-L976 WeakPolarHBondContact O-CG 3.47Å; Q972-L976 PolarHBondContact O-N 2.91Å
973	L	93.6	Very high	92.7	Very high	2 Å²	2	20 Å²	20	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-67	-37.4	-175.9	-163.6	52.2	0	0	0	111.7	P931 C936 I962 A966 G971 V975 L976 L977	P931-L973 HydrophobicContact CB-CD1 4.36Å; P931-L973 HydrophobicContact CB-CD2 3.96Å; P931-L973 HydrophobicContact CB-CG 4.46Å; P931-L973 HydrophobicContact CG-CD2 3.65Å; P931-L973 HydrophobicContact CG-CG 4.12Å; P931-L973 WeakPolarHBondContact O-CD2 3.38Å; C936-L973 WeakPolarHBondContact SG-CD1 3.13Å; I962-L973 HydrophobicContact CD1-CD2 4.08Å; I962-L973 HydrophobicContact CD1-CG 4.17Å; I962-L973 HydrophobicContact CG2-CB 4.46Å; I962-L973 HydrophobicContact CG2-CD2 4.48Å; A966-L973 HydrophobicContact CB-CD2 3.79Å; G971-L973 VanDerWaalsContact C-N 3.26Å; G971-L973 PolarHBondContact O-N 3.47Å; L973-V975 PolarHBondContact O-N 3.32Å; L973-L976 PolarHBondContact O-N 2.87Å; L973-L977 HydrophobicContact CG-CD1 4.46Å; L973-L977 WeakPolarHBondContact O-CB 3.49Å; L973-L977 VanDerWaalsContact O-CG 3.29Å; L973-L977 WeakPolarHBondContact O-CG 3.35Å; L973-L977 PolarHBondContact O-N 3.28Å
974	N	94.6	Very high	92.6	Very high	7 Å²	7	23.4 Å²	23.4	4%	0.037	14%	0.144	C	C	.	.	H	α-helix	trans	-59.5	-46.1	174.7	-50.4	71	0	0	0	110.8	A522 F585 G971 Q972 L977 A978 E989	A522-N974 HydrophobicContact CB-CB 4.2Å; F585-N974 HydrophobicContact CZ-CB 4.42Å; G971-N974 PolarHBondContact O-N 2.7Å; G971-N974 PolarHBondContact O-OD1 3.19Å; Q972-N974 VanDerWaalsContact C-N 3.34Å; Q972-N974 PolarHBondContact O-N 2.8Å; N974-L977 PolarHBondContact O-N 2.84Å; N974-A978 WeakPolarHBondContact O-CB 3.32Å; N974-A978 PolarHBondContact O-N 2.99Å; N974-E989 PolarHBondContact ND2-OE1 3.12Å
975	V	94.4	Very high	92.7	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.006	15%	0.152	C	C	.	.	H	α-helix	trans	-65.6	-40.2	178.6	-172.4	0	0	0	0	111.5	M581 M584 F585 I696 G971 Q972 L973 A978 E979	M581-V975 HydrophobicContact CB-CG1 4.22Å; M581-V975 HydrophobicContact CG-CG1 3.96Å; M581-V975 HydrophobicContact SD-CG1 4.3Å; M584-V975 HydrophobicContact SD-CG1 4.3Å; F585-V975 HydrophobicContact CE2-CG2 4.03Å; F585-V975 HydrophobicContact CZ-CB 4.46Å; F585-V975 HydrophobicContact CZ-CG2 3.95Å; I696-V975 HydrophobicContact CG2-CB 4.44Å; I696-V975 HydrophobicContact CG2-CG1 3.66Å; G971-V975 PolarHBondContact O-N 3.12Å; Q972-V975 PolarHBondContact O-N 3.5Å; L973-V975 PolarHBondContact O-N 3.32Å; V975-A978 PolarHBondContact O-N 2.84Å; V975-E979 WeakPolarHBondContact O-CB 3.33Å; V975-E979 PolarHBondContact O-N 2.98Å
976	L	94.9	Very high	92.9	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.016	15%	0.147	C	C	.	.	H	α-helix	trans	-69.7	-31.7	179.3	-69.1	171.8	0	0	0	112.9	I696 C936 Q972 L973 E979 A980	I696-L976 HydrophobicContact CB-CD2 4.26Å; I696-L976 HydrophobicContact CG2-CD2 3.91Å; C936-L976 HydrophobicContact CB-CD1 3.69Å; C936-L976 WeakPolarHBondContact SG-CD1 3.45Å; Q972-L976 HydrophobicContact CG-CD1 3.84Å; Q972-L976 HydrophobicContact CG-CG 4.32Å; Q972-L976 WeakPolarHBondContact O-CG 3.47Å; Q972-L976 PolarHBondContact O-N 2.91Å; L973-L976 PolarHBondContact O-N 2.87Å; L976-E979 WeakPolarHBondContact CD2-OE2 3.35Å; L976-A980 PolarHBondContact O-N 3.37Å
977	L	95.8	Very high	93.3	Very high	1 Å²	1	25 Å²	25	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-72.3	-40.2	171.7	-69	173.8	0	0	0	111.2	P931 Q941 F960 I962 L973 N974 A980 G981 V982 V987	P931-L977 HydrophobicContact CG-CD1 4.29Å; Q941-L977 HydrophobicContact CB-CD2 4.5Å; F960-L977 HydrophobicContact CD1-CD1 3.95Å; F960-L977 HydrophobicContact CD1-CD2 4.32Å; F960-L977 HydrophobicContact CE1-CD1 4.33Å; F960-L977 HydrophobicContact CE1-CD2 3.87Å; F960-L977 HydrophobicContact CG-CD1 4.23Å; F960-L977 HydrophobicContact CZ-CD2 4.26Å; I962-L977 HydrophobicContact CD1-CD1 3.74Å; L973-L977 HydrophobicContact CG-CD1 4.46Å; L973-L977 WeakPolarHBondContact O-CB 3.49Å; L973-L977 VanDerWaalsContact O-CG 3.29Å; L973-L977 WeakPolarHBondContact O-CG 3.35Å; L973-L977 PolarHBondContact O-N 3.28Å; N974-L977 PolarHBondContact O-N 2.84Å; L977-A980 WeakPolarHBondContact O-CB 3.48Å; L977-A980 PolarHBondContact O-N 3.16Å; L977-A980 VanDerWaalsContact O-N 3.13Å; L977-G981 PolarHBondContact O-N 3.35Å; L977-V982 HydrophobicContact CB-CB 4.13Å; L977-V982 HydrophobicContact CB-CG2 4.23Å; L977-V982 HydrophobicContact CD2-CG2 4.31Å; L977-V982 WeakPolarHBondContact O-CB 3.1Å; L977-V982 WeakPolarHBondContact O-CG2 3.45Å; L977-V982 PolarHBondContact O-N 3Å; L977-V987 HydrophobicContact CD1-CG1 4.34Å; L977-V987 HydrophobicContact CD1-CG2 4.4Å
978	A	95.2	Very high	93.7	Very high	8 Å²	8	25.7 Å²	25.7	7%	0.066	15%	0.147	C	C	.	.	H	α-helix	trans	-61.6	-42.4	173.2	0	0	0	0	0	111.7	M584 F585 N974 V975 A980 G981	M584-A978 HydrophobicContact CB-CB 4.27Å; F585-A978 HydrophobicContact CD1-CB 3.57Å; F585-A978 HydrophobicContact CE1-CB 3.63Å; F585-A978 HydrophobicContact CG-CB 4.08Å; F585-A978 HydrophobicContact CZ-CB 4.17Å; N974-A978 WeakPolarHBondContact O-CB 3.32Å; N974-A978 PolarHBondContact O-N 2.99Å; V975-A978 PolarHBondContact O-N 2.84Å; A978-A980 PolarHBondContact O-N 2.98Å; A978-G981 WeakPolarHBondContact O-CA 3.5Å; A978-G981 PolarHBondContact O-N 2.96Å
979	E	94.6	Very high	94	Very high	46 Å²	46	22.2 Å²	22.2	22%	0.215	14%	0.135	C	C	.	.	H	α-helix	trans	-57.4	-37.5	172.3	-178	-176.8	-148.5	0	0	111.9	M584 V975 L976 G981	M584-E979 HydrophobicContact CE-CG 4.37Å; M584-E979 HydrophobicContact SD-CB 3.99Å; M584-E979 HydrophobicContact SD-CG 4.32Å; V975-E979 WeakPolarHBondContact O-CB 3.33Å; V975-E979 PolarHBondContact O-N 2.98Å; L976-E979 WeakPolarHBondContact CD2-OE2 3.35Å; E979-G981 PolarHBondContact O-N 3.28Å
980	A	94.9	Very high	94.4	Very high	17 Å²	17	22.2 Å²	22.2	14%	0.14	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-5.8	175.8	0	0	0	0	0	113.9	Q941 Y942 A945 L976 L977 A978	Q941-A980 HydrophobicContact CB-CB 3.88Å; Q941-A980 HydrophobicContact CG-CB 3.7Å; Y942-A980 HydrophobicContact CD1-CB 4.2Å; Y942-A980 HydrophobicContact CE1-CB 4.49Å; A945-A980 HydrophobicContact CB-CB 3.92Å; A945-A980 VanDerWaalsContact CB-O 3.27Å; A945-A980 WeakPolarHBondContact CB-O 3.24Å; L976-A980 PolarHBondContact O-N 3.37Å; L977-A980 WeakPolarHBondContact O-CB 3.48Å; L977-A980 PolarHBondContact O-N 3.16Å; L977-A980 VanDerWaalsContact O-N 3.13Å; A978-A980 PolarHBondContact O-N 2.98Å
981	G	94.3	Very high	94.5	Very high	59 Å²	59	28.5 Å²	28.5	61%	0.608	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.9	17.3	-179.9	0	0	0	0	0	114.5	L977 A978 E979 P983	L977-G981 PolarHBondContact O-N 3.35Å; A978-G981 WeakPolarHBondContact O-CA 3.5Å; A978-G981 PolarHBondContact O-N 2.96Å; E979-G981 PolarHBondContact O-N 3.28Å; G981-P983 WeakPolarHBondContact O-CD 3.19Å
982	V	96.1	Very high	94.8	Very high	10 Å²	10	33.8 Å²	33.8	6%	0.061	19%	0.19	C	C	.	.			trans	-75	124.5	174.6	-178.6	0	0	0	0	109.5	A945 F960 L977 I986 V987	A945-V982 HydrophobicContact CB-CG2 3.67Å; F960-V982 HydrophobicContact CD2-CG1 3.82Å; F960-V982 HydrophobicContact CE2-CB 4.47Å; F960-V982 HydrophobicContact CE2-CG1 3.48Å; F960-V982 VanDerWaalsContact CE2-CG1 3.48Å; F960-V982 HydrophobicContact CE2-CG2 4.09Å; F960-V982 HydrophobicContact CZ-CG1 4.29Å; F960-V982 HydrophobicContact CZ-CG2 4.13Å; L977-V982 HydrophobicContact CB-CB 4.13Å; L977-V982 HydrophobicContact CB-CG2 4.23Å; L977-V982 HydrophobicContact CD2-CG2 4.31Å; L977-V982 WeakPolarHBondContact O-CB 3.1Å; L977-V982 WeakPolarHBondContact O-CG2 3.45Å; L977-V982 PolarHBondContact O-N 3Å; V982-I986 HydrophobicContact CG1-CD1 3.9Å; V982-I986 HydrophobicContact CG1-CG1 4.02Å; V982-V987 HydrophobicContact CG1-CG2 3.68Å
983	P	94.5	Very high	95	Very high	43 Å²	43	33.5 Å²	33.5	28%	0.279	19%	0.189	S	C	.	.			trans	-61.1	136	173.8	-25.6	37.2	0	0	0	112	G981 D985 I986	G981-P983 WeakPolarHBondContact O-CD 3.19Å; P983-D985 WeakPolarHBondContact CB-OD1 3.43Å; P983-D985 PolarHBondContact O-N 3.35Å; P983-I986 HydrophobicContact CB-CG1 4.42Å; P983-I986 WeakPolarHBondContact O-CG1 3.25Å; P983-I986 PolarHBondContact O-N 2.91Å
984	Y	92.9	Very high	95.1	Very high	73 Å²	73	34.7 Å²	34.7	29%	0.286	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-67.8	-19.6	-175.2	65	-98.5	0	0	0	114.1	R587 Q641 I986 V987	R587-Y984 HydrophobicContact CG-CD1 4.25Å; R587-Y984 HydrophobicContact CG-CE1 3.98Å; R587-Y984 PolarHBondContact NH2-OH 3.43Å; Q641-Y984 HydrophobicContact CB-CE2 4.38Å; Q641-Y984 HydrophobicContact CG-CD1 3.99Å; Q641-Y984 HydrophobicContact CG-CD2 4.39Å; Q641-Y984 HydrophobicContact CG-CE1 3.87Å; Q641-Y984 HydrophobicContact CG-CE2 4.29Å; Q641-Y984 HydrophobicContact CG-CG 4.26Å; Y984-I986 VanDerWaalsContact C-N 3.28Å; Y984-I986 PolarHBondContact O-N 3.35Å; Y984-V987 PolarHBondContact O-N 2.85Å
985	D	93.4	Very high	95.2	Very high	81 Å²	81	42.7 Å²	42.7	43%	0.433	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-74.1	-16.9	-178.8	58	-14.9	0	0	0	113.7	R587 P983	R587-D985 IonicContact NH1-OD2 3.64Å; P983-D985 WeakPolarHBondContact CB-OD1 3.43Å; P983-D985 PolarHBondContact O-N 3.35Å
986	I	96.2	Very high	95.4	Very high	12 Å²	12	45.3 Å²	45.3	6%	0.062	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-102.9	7.8	172.5	61.7	158.4	0	0	0	112.7	V948 R959 F960 V982 P983 Y984	V948-I986 HydrophobicContact CG1-CD1 3.79Å; R959-I986 CarbonylContact C-O 3.51Å; R959-I986 WeakPolarHBondContact CA-O 3.23Å; F960-I986 HydrophobicContact CD2-CD1 4.3Å; F960-I986 HydrophobicContact CE2-CD1 4.26Å; F960-I986 PolarHBondContact N-O 3.44Å; V982-I986 HydrophobicContact CG1-CD1 3.9Å; V982-I986 HydrophobicContact CG1-CG1 4.02Å; P983-I986 HydrophobicContact CB-CG1 4.42Å; P983-I986 WeakPolarHBondContact O-CG1 3.25Å; P983-I986 PolarHBondContact O-N 2.91Å; Y984-I986 VanDerWaalsContact C-N 3.28Å; Y984-I986 PolarHBondContact O-N 3.35Å
987	V	96.8	Very high	95.5	Very high	18 Å²	18	45.1 Å²	45.1	11%	0.109	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	104.1	175.6	-177.1	0	0	0	0	107.7	F960 I962 L977 V982 Y984	F960-V987 HydrophobicContact CB-CG1 4.41Å; F960-V987 HydrophobicContact CB-CG2 4.26Å; F960-V987 HydrophobicContact CD2-CG2 4.22Å; F960-V987 HydrophobicContact CG-CG2 4.47Å; I962-V987 HydrophobicContact CD1-CG1 4.06Å; I962-V987 HydrophobicContact CG1-CG1 3.48Å; I962-V987 VanDerWaalsContact CG1-CG1 3.48Å; L977-V987 HydrophobicContact CD1-CG1 4.34Å; L977-V987 HydrophobicContact CD1-CG2 4.4Å; V982-V987 HydrophobicContact CG1-CG2 3.68Å; Y984-V987 PolarHBondContact O-N 2.85Å
988	L	97.1	Very high	95.6	Very high	38 Å²	38	48 Å²	48	20%	0.199	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	146.2	-175.2	-59.9	176.1	0	0	0	110.4	F960 I962 E992 I993	F960-L988 PolarHBondContact O-N 3.4Å; I962-L988 PolarHBondContact N-O 3.46Å; L988-E992 HydrophobicContact CB-CB 4.3Å; L988-I993 HydrophobicContact CB-CB 4.08Å; L988-I993 HydrophobicContact CB-CD1 4.27Å; L988-I993 HydrophobicContact CD1-CB 4.32Å; L988-I993 HydrophobicContact CD1-CD1 4.13Å; L988-I993 HydrophobicContact CD1-CG1 4.13Å
989	E	95.6	Very high	95.6	Very high	22 Å²	22	54.8 Å²	54.8	10%	0.103	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	160.6	173.3	-60.3	-60.7	149.6	0	0	110.6	P521 N974 D991 E992 I993	P521-E989 HydrophobicContact CB-CG 4.02Å; P521-E989 HydrophobicContact CG-CG 4.45Å; N974-E989 PolarHBondContact ND2-OE1 3.12Å; E989-D991 VanDerWaalsContact C-N 3.29Å; E989-D991 PolarHBondContact O-N 2.88Å; E989-E992 HydrophobicContact CB-CG 4.4Å; E989-E992 PolarHBondContact N-OE2 3.49Å; E989-E992 WeakPolarHBondContact O-CB 3.47Å; E989-E992 PolarHBondContact O-N 3.32Å; E989-I993 PolarHBondContact O-N 3.49Å
990	M	95.3	Very high	95.7	Very high	6 Å²	6	52.6 Å²	52.6	3%	0.03	28%	0.284	C	S	.	.	H	α-helix	trans	-52.6	-43.7	-176.1	177	179.8	70.1	0	0	113.6	I962 H963 P964 E992 I993 N994 P1028 L1030	I962-M990 PolarHBondContact O-N 3.49Å; H963-M990 VanDerWaalsContact CD2-SD 3.57Å; P964-M990 HydrophobicContact CG-CE 4.19Å; M990-E992 PolarHBondContact O-N 3.13Å; M990-I993 PolarHBondContact O-N 2.93Å; M990-N994 WeakPolarHBondContact CG-ND2 3.41Å; M990-N994 WeakPolarHBondContact O-CB 3.48Å; M990-N994 PolarHBondContact O-N 2.9Å; M990-N994 VanDerWaalsContact O-N 3.09Å; M990-P1028 HydrophobicContact CE-CB 3.64Å; M990-P1028 HydrophobicContact CE-CG 3.96Å; M990-P1028 HydrophobicContact SD-CB 4.22Å; M990-L1030 HydrophobicContact CB-CD2 4.03Å; M990-L1030 HydrophobicContact CG-CD2 3.85Å; M990-L1030 HydrophobicContact CG-CG 4.27Å
991	D	92.5	Very high	95.8	Very high	137 Å²	137	53.6 Å²	53.6	73%	0.733	29%	0.287	S	S	*	.	H	α-helix	trans	-69.6	-22.3	-178.1	-63	-25.3	0	0	0	112.5	E989	E989-D991 VanDerWaalsContact C-N 3.29Å; E989-D991 PolarHBondContact O-N 2.88Å
992	E	95.2	Very high	96	Very high	120 Å²	120	50.9 Å²	50.9	56%	0.561	26%	0.258	S	S	*	.	H	α-helix	trans	-86.4	-25.5	-179.8	-58.6	174.9	143.7	0	0	112.4	L988 E989 M990	L988-E992 HydrophobicContact CB-CB 4.3Å; E989-E992 HydrophobicContact CB-CG 4.4Å; E989-E992 PolarHBondContact N-OE2 3.49Å; E989-E992 WeakPolarHBondContact O-CB 3.47Å; E989-E992 PolarHBondContact O-N 3.32Å; M990-E992 PolarHBondContact O-N 3.13Å
993	I	97.1	Very high	96.2	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-111.7	-15.5	-170.6	-156	172.7	0	0	0	114.2	I928 R959 L988 E989 M990 E995 D996 F997 L1030	I928-I993 HydrophobicContact CD1-CD1 3.89Å; I928-I993 HydrophobicContact CD1-CG1 3.92Å; I928-I993 HydrophobicContact CG1-CD1 4.07Å; I928-I993 HydrophobicContact CG2-CD1 3.7Å; R959-I993 HydrophobicContact CB-CD1 4.4Å; L988-I993 HydrophobicContact CB-CB 4.08Å; L988-I993 HydrophobicContact CB-CD1 4.27Å; L988-I993 HydrophobicContact CD1-CB 4.32Å; L988-I993 HydrophobicContact CD1-CD1 4.13Å; L988-I993 HydrophobicContact CD1-CG1 4.13Å; E989-I993 PolarHBondContact O-N 3.49Å; M990-I993 PolarHBondContact O-N 2.93Å; I993-E995 VanDerWaalsContact C-N 3.3Å; I993-E995 PolarHBondContact O-N 3.22Å; I993-D996 WeakPolarHBondContact O-CB 3.45Å; I993-D996 PolarHBondContact O-N 3.5Å; I993-D996 VanDerWaalsContact O-N 3.08Å; I993-F997 HydrophobicContact CG2-CE2 4.37Å; I993-L1030 HydrophobicContact CG2-CD2 3.92Å
994	N	96.4	Very high	96.4	Very high	27 Å²	27	48.5 Å²	48.5	14%	0.144	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-62.1	-35	-173.2	-103.7	-14.2	0	0	0	113.5	M990 D996 F997 V1029 L1030 E1031	M990-N994 WeakPolarHBondContact CG-ND2 3.41Å; M990-N994 WeakPolarHBondContact O-CB 3.48Å; M990-N994 PolarHBondContact O-N 2.9Å; M990-N994 VanDerWaalsContact O-N 3.09Å; N994-D996 PolarHBondContact O-N 2.98Å; N994-F997 WeakPolarHBondContact O-CD2 3.27Å; N994-F997 VanDerWaalsContact OD1-CE2 3.27Å; N994-F997 WeakPolarHBondContact OD1-CE2 3.43Å; N994-V1029 PolarHBondContact ND2-O 3.26Å; N994-L1030 WeakPolarHBondContact OD1-CA 3.45Å; N994-E1031 PolarHBondContact OD1-N 2.96Å
995	E	96.4	Very high	96.6	Very high	175 Å²	175	45 Å²	45	82%	0.818	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-70	-16.5	178.5	-62.8	-168.8	167.2	0	0	113.2	I993 P998	I993-E995 VanDerWaalsContact C-N 3.3Å; I993-E995 PolarHBondContact O-N 3.22Å; E995-P998 WeakPolarHBondContact O-CD 3.27Å
996	D	97.3	Very high	96.8	Very high	55 Å²	55	41.1 Å²	41.1	29%	0.294	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-88.7	-12.2	-176.6	-67.4	-15.8	0	0	0	113.8	I928 R959 I993 N994 E999 T1000	I928-D996 HydrophobicContact CD1-CB 4.5Å; R959-D996 IonicContact CZ-OD2 2.78Å; R959-D996 IonicContact NH1-OD2 2.81Å; R959-D996 PolarHBondContact NH1-OD2 3.46Å; R959-D996 IonicContact NH2-OD2 3.91Å; R959-D996 PolarHBondContact NH2-OD2 2.9Å; I993-D996 WeakPolarHBondContact O-CB 3.45Å; I993-D996 PolarHBondContact O-N 3.5Å; I993-D996 VanDerWaalsContact O-N 3.08Å; N994-D996 PolarHBondContact O-N 2.98Å; D996-E999 PolarHBondContact O-N 3.19Å; D996-T1000 PolarHBondContact O-N 3.32Å; D996-T1000 PolarHBondContact O-OG1 3.33Å
997	F	97.8	Very high	96.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-59.1	-41.1	-177.4	-79	-65.8	0	0	0	114.5	I928 T930 I993 N994 E999 T1000 V1003 L1030 E1031 V1032 K1034 S1035	I928-F997 HydrophobicContact CB-CE1 4.23Å; I928-F997 HydrophobicContact CD1-CD1 3.98Å; I928-F997 HydrophobicContact CD1-CE1 3.95Å; I928-F997 HydrophobicContact CG2-CE1 3.83Å; I928-F997 HydrophobicContact CG2-CZ 4.15Å; T930-F997 HydrophobicContact CG2-CE1 4.31Å; T930-F997 HydrophobicContact CG2-CZ 4.04Å; I993-F997 HydrophobicContact CG2-CE2 4.37Å; N994-F997 WeakPolarHBondContact O-CD2 3.27Å; N994-F997 VanDerWaalsContact OD1-CE2 3.27Å; N994-F997 WeakPolarHBondContact OD1-CE2 3.43Å; F997-E999 VanDerWaalsContact C-N 3.25Å; F997-E999 PolarHBondContact O-N 3.18Å; F997-T1000 WeakPolarHBondContact O-CB 3.34Å; F997-T1000 PolarHBondContact O-N 2.84Å; F997-T1000 VanDerWaalsContact O-N 3.08Å; F997-V1003 HydrophobicContact CD1-CG2 3.73Å; F997-V1003 HydrophobicContact CE1-CG1 4.18Å; F997-V1003 HydrophobicContact CE1-CG2 3.79Å; F997-L1030 HydrophobicContact CE2-CB 4.24Å; F997-L1030 HydrophobicContact CE2-CD2 3.98Å; F997-L1030 HydrophobicContact CZ-CB 4.2Å; F997-L1030 HydrophobicContact CZ-CD2 4.09Å; F997-E1031 HydrophobicContact CD2-CB 4.44Å; F997-V1032 HydrophobicContact CE1-CB 4.43Å; F997-V1032 HydrophobicContact CE1-CG1 3.92Å; F997-V1032 HydrophobicContact CZ-CG1 4.03Å; F997-K1034 HydrophobicContact CB-CB 4.17Å; F997-S1035 VanDerWaalsContact O-CA 3.24Å; F997-S1035 WeakPolarHBondContact O-CA 3.39Å; F997-S1035 WeakPolarHBondContact O-CB 3.26Å
998	P	97.3	Very high	96.4	Very high	62 Å²	62	41.6 Å²	41.6	40%	0.403	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-59.3	-32.6	177.3	-24.6	35	0	0	0	114.3	E995 T1000 K1034	E995-P998 WeakPolarHBondContact O-CD 3.27Å; P998-T1000 VanDerWaalsContact C-N 3.3Å; P998-K1034 HydrophobicContact CG-CB 4.2Å; P998-K1034 HydrophobicContact CG-CD 4.37Å
999	E	95.1	Very high	96.2	Very high	150 Å²	150	40.6 Å²	40.6	70%	0.701	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-90.4	7.1	179.5	-59.1	-57.9	139.5	0	0	112.6	N926 D996 F997	N926-E999 PolarHBondContact ND2-O 3.46Å; D996-E999 PolarHBondContact O-N 3.19Å; F997-E999 VanDerWaalsContact C-N 3.25Å; F997-E999 PolarHBondContact O-N 3.18Å
1000	T	97.8	Very high	96	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.215	C	C	.	.			trans	-96.3	130.4	-177.4	-62.6	0	0	0	0	111.5	N926 I928 D996 F997 P998 L1002 V1003 K1036	N926-T1000 PolarHBondContact ND2-OG1 3.32Å; N926-T1000 WeakPolarHBondContact O-CG2 3.32Å; I928-T1000 HydrophobicContact CB-CG2 4.19Å; I928-T1000 HydrophobicContact CD1-CG2 3.92Å; I928-T1000 WeakPolarHBondContact CD1-OG1 3.46Å; I928-T1000 HydrophobicContact CG1-CG2 3.82Å; D996-T1000 PolarHBondContact O-N 3.32Å; D996-T1000 PolarHBondContact O-OG1 3.33Å; F997-T1000 WeakPolarHBondContact O-CB 3.34Å; F997-T1000 PolarHBondContact O-N 2.84Å; F997-T1000 VanDerWaalsContact O-N 3.08Å; P998-T1000 VanDerWaalsContact C-N 3.3Å; T1000-L1002 WeakPolarHBondContact CG2-O 3.28Å; T1000-V1003 HydrophobicContact CG2-CG2 3.97Å; T1000-K1036 PolarHBondContact O-N 3.5Å; T1000-K1036 VanDerWaalsContact O-N 3.12Å
1001	D	97.8	Very high	95.9	Very high	37 Å²	37	41.2 Å²	41.2	20%	0.198	22%	0.218	C	C	.	.	S	Bend	trans	-75	-40.9	-178.6	-61.3	-43.2	0	0	0	111.9	A924 S925 N926 K1036 Q1037	A924-D1001 HydrophobicContact CB-CB 3.87Å; S925-D1001 PolarHBondContact N-OD2 3.28Å; N926-D1001 PolarHBondContact N-OD2 3.5Å; N926-D1001 WeakPolarHBondContact O-CB 3.45Å; N926-D1001 PolarHBondContact O-N 3.14Å; D1001-K1036 WeakPolarHBondContact O-CB 3.23Å; D1001-K1036 WeakPolarHBondContact OD1-CE 3.39Å; D1001-K1036 IonicContact OD1-NZ 3.83Å; D1001-K1036 PolarHBondContact OD1-NZ 3.38Å; D1001-Q1037 PolarHBondContact O-N 3.28Å
1002	L	98.4	Very high	96.1	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.01	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	132.8	-175.3	-176.4	65.4	0	0	0	111.8	I921 A924 N926 I927 I928 T1000 L1004 Q1037 I1039	I921-L1002 HydrophobicContact CB-CD2 4.29Å; I921-L1002 HydrophobicContact CG1-CD2 3.61Å; A924-L1002 HydrophobicContact CB-CB 3.61Å; A924-L1002 HydrophobicContact CB-CD2 4.12Å; N926-L1002 PolarHBondContact O-N 3.16Å; I927-L1002 VanDerWaalsContact CA-O 3.28Å; I927-L1002 WeakPolarHBondContact CA-O 3.46Å; I927-L1002 HydrophobicContact CG1-CB 4.36Å; I928-L1002 PolarHBondContact N-O 3.02Å; T1000-L1002 WeakPolarHBondContact CG2-O 3.28Å; L1002-L1004 HydrophobicContact CD2-CD2 4.02Å; L1002-L1004 HydrophobicContact CG-CD2 4.13Å; L1002-Q1037 CarbonylContact C-O 3.58Å; L1002-Q1037 WeakPolarHBondContact CA-O 3.24Å; L1002-Q1037 HydrophobicContact CD1-CB 3.95Å; L1002-Q1037 HydrophobicContact CD1-CG 3.87Å; L1002-I1039 HydrophobicContact CD1-CD1 3.93Å; L1002-I1039 HydrophobicContact CD1-CG1 4Å; L1002-I1039 HydrophobicContact CD2-CD1 4.43Å
1003	V	98.8	Very high	96.1	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127.5	170.4	-178.1	0	0	0	0	110.5	I928 T930 F997 T1000 V1005 V1032 S1035 Q1037 V1038 I1039	I928-V1003 HydrophobicContact CB-CG2 4.37Å; I928-V1003 CarbonylContact O-C 3.36Å; I928-V1003 VanDerWaalsContact O-CA 3.25Å; I928-V1003 WeakPolarHBondContact O-CA 3.47Å; T930-V1003 HydrophobicContact CG2-CG1 4.08Å; F997-V1003 HydrophobicContact CD1-CG2 3.73Å; F997-V1003 HydrophobicContact CE1-CG1 4.18Å; F997-V1003 HydrophobicContact CE1-CG2 3.79Å; T1000-V1003 HydrophobicContact CG2-CG2 3.97Å; V1003-V1005 HydrophobicContact CG1-CG2 4.12Å; V1003-V1032 HydrophobicContact CB-CB 4.48Å; V1003-V1032 HydrophobicContact CG1-CB 3.91Å; V1003-V1032 HydrophobicContact CG1-CG1 3.76Å; V1003-S1035 VanDerWaalsContact CG2-CB 3.49Å; V1003-S1035 VanDerWaalsContact CG2-OG 3.26Å; V1003-S1035 WeakPolarHBondContact CG2-OG 3.29Å; V1003-Q1037 PolarHBondContact N-O 2.67Å; V1003-V1038 HydrophobicContact CB-CG2 4.37Å; V1003-V1038 CarbonylContact O-C 2.99Å; V1003-V1038 WeakPolarHBondContact O-CA 3.37Å; V1003-I1039 PolarHBondContact O-N 3.07Å
1004	L	98.4	Very high	95.9	Very high	3 Å²	3	29 Å²	29	2%	0.016	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	106.5	173.5	-57.5	-177.4	0	0	0	109.8	I921 I927 I928 I929 T930 L1002 I1006 I1039	I921-L1004 HydrophobicContact CD1-CD1 4.45Å; I921-L1004 HydrophobicContact CG1-CD2 4.5Å; I927-L1004 HydrophobicContact CG2-CD1 4.34Å; I927-L1004 HydrophobicContact CG2-CG 4.26Å; I928-L1004 PolarHBondContact O-N 3.06Å; I929-L1004 WeakPolarHBondContact CA-O 3.18Å; I929-L1004 HydrophobicContact CD1-CD1 4.49Å; I929-L1004 HydrophobicContact CG1-CB 4.24Å; I929-L1004 HydrophobicContact CG1-CD1 4.29Å; I929-L1004 HydrophobicContact CG2-CB 4.5Å; T930-L1004 PolarHBondContact N-O 3.08Å; L1002-L1004 HydrophobicContact CD2-CD2 4.02Å; L1002-L1004 HydrophobicContact CG-CD2 4.13Å; L1004-I1006 HydrophobicContact CB-CD1 4.49Å; L1004-I1006 HydrophobicContact CB-CG1 4.38Å; L1004-I1039 HydrophobicContact CD2-CB 3.84Å; L1004-I1039 HydrophobicContact CD2-CD1 3.95Å; L1004-I1039 HydrophobicContact CD2-CG1 4.3Å; L1004-I1039 HydrophobicContact CD2-CG2 4.49Å
1005	V	98.3	Very high	95.6	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	109.9	176.2	-176.1	0	0	0	0	109	T930 V1003 A1008 V1012 V1032 V1038 I1039 V1040 M1041	T930-V1005 WeakPolarHBondContact OG1-CA 3.39Å; T930-V1005 WeakPolarHBondContact OG1-CG2 3.44Å; V1003-V1005 HydrophobicContact CG1-CG2 4.12Å; V1005-A1008 HydrophobicContact CG1-CB 3.96Å; V1005-V1012 HydrophobicContact CG1-CG1 4.23Å; V1005-V1012 HydrophobicContact CG1-CG2 3.96Å; V1005-V1032 HydrophobicContact CG2-CB 4.43Å; V1005-V1032 HydrophobicContact CG2-CG1 4.27Å; V1005-V1032 HydrophobicContact CG2-CG2 4.24Å; V1005-V1038 HydrophobicContact CG2-CG1 3.65Å; V1005-I1039 PolarHBondContact N-O 3.25Å; V1005-V1040 HydrophobicContact CB-CB 4.49Å; V1005-V1040 HydrophobicContact CB-CG1 4.48Å; V1005-V1040 HydrophobicContact CB-CG2 4.1Å; V1005-V1040 HydrophobicContact CG1-CG1 4.46Å; V1005-V1040 HydrophobicContact CG2-CG2 4.27Å; V1005-M1041 PolarHBondContact O-N 3.44Å
1006	I	96.9	Very high	95.4	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	103.6	-172.7	-45.8	179.1	0	0	0	110.7	I929 T930 G932 L935 I944 L1004 A1008 M1041	I929-I1006 HydrophobicContact CG2-CD1 3.89Å; I929-I1006 HydrophobicContact CG2-CG1 4.35Å; T930-I1006 PolarHBondContact O-N 3.05Å; G932-I1006 PolarHBondContact N-O 3.04Å; L935-I1006 HydrophobicContact CB-CG2 4.05Å; L935-I1006 HydrophobicContact CD1-CB 3.99Å; L935-I1006 HydrophobicContact CD1-CD1 4.17Å; L935-I1006 HydrophobicContact CD1-CG2 3.88Å; L935-I1006 HydrophobicContact CG-CG2 4.35Å; I944-I1006 HydrophobicContact CD1-CD1 3.56Å; I944-I1006 HydrophobicContact CG1-CD1 3.99Å; L1004-I1006 HydrophobicContact CB-CD1 4.49Å; L1004-I1006 HydrophobicContact CB-CG1 4.38Å; I1006-A1008 PolarHBondContact O-N 3.12Å; I1006-M1041 HydrophobicContact CD1-SD 4.22Å; I1006-M1041 HydrophobicContact CG1-SD 3.97Å; I1006-M1041 HydrophobicContact CG2-CB 4.4Å; I1006-M1041 HydrophobicContact CG2-CE 4.42Å
1007	G	92.1	Very high	95	Very high	27 Å²	27	20.2 Å²	20.2	28%	0.278	11%	0.114	S	C	.	.	S	Bend	trans	67.3	21.6	175.8	0	0	0	0	0	114.8	G932 G934 M1041	G932-G1007 CarbonylContact C-O 3.59Å; G932-G1007 WeakPolarHBondContact CA-O 3.25Å; G934-G1007 PolarHBondContact N-O 3.44Å; G1007-M1041 PolarHBondContact N-O 3.07Å
1008	A	93.4	Very high	94.5	Very high	12 Å²	12	23.8 Å²	23.8	10%	0.099	13%	0.131	C	C	.	.			trans	-107.9	151.8	170.2	0	0	0	0	0	110.4	V1005 I1006	V1005-A1008 HydrophobicContact CG1-CB 3.96Å; I1006-A1008 PolarHBondContact O-N 3.12Å
1009	N	92.1	Very high	94.1	Very high	18 Å²	18	21.2 Å²	21.2	10%	0.096	11%	0.113	C	C	.	.	S	Bend	trans	-141.8	-68.1	175	-170	11.5	0	0	0	111.4	T1011 V1012 N1013 G1048 N1054 F1057	N1009-T1011 VanDerWaalsContact C-N 3.28Å; N1009-T1011 PolarHBondContact O-N 3.36Å; N1009-V1012 WeakPolarHBondContact O-CG2 3.46Å; N1009-V1012 PolarHBondContact O-N 3.32Å; N1009-N1013 PolarHBondContact O-N 3.38Å; N1009-G1048 VanDerWaalsContact ND2-CA 3.27Å; N1009-G1048 WeakPolarHBondContact ND2-CA 3.42Å; N1009-G1048 PolarHBondContact ND2-N 3.07Å; N1009-N1054 PolarHBondContact O-ND2 3.4Å; N1009-N1054 VanDerWaalsContact OD1-CB 3.29Å; N1009-N1054 WeakPolarHBondContact OD1-CB 3.26Å; N1009-N1054 PolarHBondContact OD1-ND2 3.39Å; N1009-F1057 VanDerWaalsContact OD1-CZ 3.28Å; N1009-F1057 WeakPolarHBondContact OD1-CZ 3.32Å
1010	D	91.2	Very high	93.6	Very high	26 Å²	26	14.2 Å²	14.2	14%	0.139	8%	0.081	C	C	.	.	G	3₁₀ helix	trans	-64.2	-35.5	-173.4	-56.1	-18.4	0	0	0	111.6	V1012 N1013 Y1049 A1050	D1010-V1012 PolarHBondContact O-N 3.2Å; D1010-V1012 VanDerWaalsContact O-N 3.16Å; D1010-N1013 WeakPolarHBondContact O-CB 3.27Å; D1010-N1013 PolarHBondContact O-N 2.91Å; D1010-Y1049 WeakPolarHBondContact OD2-CB 3.47Å; D1010-Y1049 PolarHBondContact OD2-N 3.46Å; D1010-A1050 PolarHBondContact OD2-N 3.47Å
1011	T	94.1	Very high	93	Very high	14 Å²	14	15.2 Å²	15.2	9%	0.086	9%	0.087	C	C	.	.	G	3₁₀ helix	trans	-71.5	-4.2	-179.9	58.9	0	0	0	0	115	H963 N1009 M1027 V1029 L1030	H963-T1011 HydrophobicContact CB-CG2 3.82Å; H963-T1011 VanDerWaalsContact CG-CG2 3.45Å; N1009-T1011 VanDerWaalsContact C-N 3.28Å; N1009-T1011 PolarHBondContact O-N 3.36Å; T1011-M1027 HydrophobicContact CG2-CE 4.25Å; T1011-V1029 WeakPolarHBondContact O-CB 3.46Å; T1011-L1030 PolarHBondContact O-N 3.08Å
1012	V	96.1	Very high	92.4	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-127.2	12	178.6	-63.7	0	0	0	0	111.8	V1005 N1009 D1010 L1030 V1032 W1033 I1056	V1005-V1012 HydrophobicContact CG1-CG1 4.23Å; V1005-V1012 HydrophobicContact CG1-CG2 3.96Å; N1009-V1012 WeakPolarHBondContact O-CG2 3.46Å; N1009-V1012 PolarHBondContact O-N 3.32Å; D1010-V1012 PolarHBondContact O-N 3.2Å; D1010-V1012 VanDerWaalsContact O-N 3.16Å; V1012-L1030 HydrophobicContact CG1-CB 4.18Å; V1012-V1032 HydrophobicContact CB-CG1 4.3Å; V1012-V1032 HydrophobicContact CB-CG2 3.93Å; V1012-V1032 HydrophobicContact CG1-CG1 3.78Å; V1012-V1032 HydrophobicContact CG1-CG2 4.3Å; V1012-W1033 WeakPolarHBondContact O-CZ3 3.49Å; V1012-I1056 HydrophobicContact CB-CD1 4.14Å; V1012-I1056 HydrophobicContact CG2-CD1 3.67Å; V1012-I1056 WeakPolarHBondContact O-CD1 3.48Å
1013	N	94.6	Very high	91.6	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.091	C	C	.	.			trans	-86.2	117.4	-169.7	-171.1	-24.2	0	0	0	111.7	N1009 D1010 A1015 A1016 I1024 D1053 N1054 P1055	N1009-N1013 PolarHBondContact O-N 3.38Å; D1010-N1013 WeakPolarHBondContact O-CB 3.27Å; D1010-N1013 PolarHBondContact O-N 2.91Å; N1013-A1015 PolarHBondContact O-N 3.04Å; N1013-A1015 WeakPolarHBondContact OD1-CB 3.35Å; N1013-A1015 PolarHBondContact OD1-N 3.48Å; N1013-A1016 WeakPolarHBondContact O-CB 3.36Å; N1013-A1016 PolarHBondContact O-N 3.45Å; N1013-I1024 HydrophobicContact CB-CD1 3.68Å; N1013-D1053 PolarHBondContact ND2-O 3.25Å; N1013-N1054 PolarHBondContact OD1-OD1 3.35Å; N1013-P1055 WeakPolarHBondContact OD1-CD 3.19Å
1014	S	93.9	Very high	90.9	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-19.2	-178.1	75	0	0	0	0	113.9	A1016 Q1017 E1018 K1059	S1014-A1016 PolarHBondContact O-N 3.28Å; S1014-A1016 VanDerWaalsContact O-N 3.11Å; S1014-Q1017 PolarHBondContact O-N 3.25Å; S1014-E1018 WeakPolarHBondContact CB-OE2 3.31Å; S1014-E1018 WeakPolarHBondContact O-CB 3.42Å; S1014-E1018 PolarHBondContact O-N 3.47Å; S1014-E1018 PolarHBondContact OG-OE2 3Å; S1014-K1059 VanDerWaalsContact OG-CE 3.3Å; S1014-K1059 WeakPolarHBondContact OG-CE 3.3Å; S1014-K1059 PolarHBondContact OG-NZ 3.03Å
1015	A	90.9	Very high	90.4	Very high	7 Å²	7	16.7 Å²	16.7	6%	0.058	9%	0.094	C	C	.	.	H	α-helix	trans	-59.9	-23.1	175.6	0	0	0	0	0	112.4	N1013 Q1017 D1019 P1055	N1013-A1015 PolarHBondContact O-N 3.04Å; N1013-A1015 WeakPolarHBondContact OD1-CB 3.35Å; N1013-A1015 PolarHBondContact OD1-N 3.48Å; A1015-Q1017 PolarHBondContact O-N 2.62Å; A1015-D1019 HydrophobicContact CB-CB 4.38Å; A1015-D1019 PolarHBondContact O-N 2.78Å; A1015-D1019 VanDerWaalsContact O-N 3.1Å; A1015-P1055 HydrophobicContact CB-CG 4.05Å
1016	A	90.5	Very high	89.9	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.6	-29.1	176	0	0	0	0	0	112.8	N1013 S1014 I1024 G1026 M1027 V1029	N1013-A1016 WeakPolarHBondContact O-CB 3.36Å; N1013-A1016 PolarHBondContact O-N 3.45Å; S1014-A1016 PolarHBondContact O-N 3.28Å; S1014-A1016 VanDerWaalsContact O-N 3.11Å; A1016-I1024 WeakPolarHBondContact CA-O 3.18Å; A1016-I1024 HydrophobicContact CB-CD1 4.27Å; A1016-I1024 HydrophobicContact CB-CG1 4.27Å; A1016-I1024 VanDerWaalsContact CB-O 3.31Å; A1016-I1024 WeakPolarHBondContact CB-O 3.47Å; A1016-G1026 PolarHBondContact O-N 3.13Å; A1016-M1027 HydrophobicContact CB-CB 4.22Å; A1016-M1027 WeakPolarHBondContact CB-O 3.38Å; A1016-V1029 HydrophobicContact CB-CG1 3.89Å; A1016-V1029 HydrophobicContact CB-CG2 4.33Å
1017	Q	90.3	Very high	89.6	Confident	66 Å²	66	18.4 Å²	18.4	31%	0.308	11%	0.108	S	C	.	.	H	α-helix	trans	-105.4	-36.5	179.5	-62.6	-175.2	-0.1	0	0	113	V455 S1014 A1015 E1031	V455-Q1017 PolarHBondContact N-O 3.41Å; S1014-Q1017 PolarHBondContact O-N 3.25Å; A1015-Q1017 PolarHBondContact O-N 2.62Å; Q1017-E1031 PolarHBondContact NE2-OE1 3.38Å; Q1017-E1031 PolarHBondContact OE1-OE1 2.93Å
1018	E	87.3	Confident	89.6	Confident	76 Å²	76	19.4 Å²	19.4	36%	0.355	11%	0.11	S	C	.	.	H	α-helix	trans	-88.1	-25.2	-171.6	-63	174.2	161	0	0	113.1	S1014 K1059	S1014-E1018 WeakPolarHBondContact CB-OE2 3.31Å; S1014-E1018 WeakPolarHBondContact O-CB 3.42Å; S1014-E1018 PolarHBondContact O-N 3.47Å; S1014-E1018 PolarHBondContact OG-OE2 3Å; E1018-K1059 IonicContact OE1-NZ 2.92Å; E1018-K1059 PolarHBondContact OE1-NZ 2.78Å; E1018-K1059 VanDerWaalsContact OE1-NZ 3.13Å; E1018-K1059 IonicContact OE2-NZ 3.58Å; E1018-K1059 PolarHBondContact OE2-NZ 3.45Å
1019	D	87.2	Confident	89.7	Confident	7 Å²	7	18.9 Å²	18.9	4%	0.037	11%	0.106	C	C	.	.			trans	-121.8	105	-176.2	-177.7	11.6	0	0	0	112.9	P902 M903 A1015 N1021 S1022	P902-D1019 WeakPolarHBondContact CA-OD2 3.48Å; M903-D1019 HydrophobicContact CB-CB 4.37Å; M903-D1019 PolarHBondContact N-OD2 3.42Å; A1015-D1019 HydrophobicContact CB-CB 4.38Å; A1015-D1019 PolarHBondContact O-N 2.78Å; A1015-D1019 VanDerWaalsContact O-N 3.1Å; D1019-N1021 PolarHBondContact O-N 2.89Å; D1019-N1021 VanDerWaalsContact O-N 3.17Å; D1019-N1021 WeakPolarHBondContact OD1-CB 3.43Å; D1019-N1021 PolarHBondContact OD1-N 2.88Å; D1019-N1021 PolarHBondContact OD1-ND2 3.17Å; D1019-S1022 VanDerWaalsContact O-CB 3.3Å; D1019-S1022 WeakPolarHBondContact O-CB 3.37Å; D1019-S1022 PolarHBondContact O-N 3.21Å; D1019-S1022 VanDerWaalsContact O-N 3.13Å
1020	P	85.4	Confident	89.9	Confident	3 Å²	3	18.1 Å²	18.1	2%	0.019	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-9.1	177.7	30.3	-36.2	0	0	0	114.8	Q452 V455 L458 T897 A898	Q452-P1020 HydrophobicContact CG-CG 4.49Å; V455-P1020 HydrophobicContact CG2-CB 4.21Å; L458-P1020 HydrophobicContact CD1-CB 3.45Å; L458-P1020 VanDerWaalsContact CD1-CB 3.45Å; L458-P1020 HydrophobicContact CD1-CG 3.88Å; T897-P1020 PolarHBondContact N-O 3.5Å; T897-P1020 VanDerWaalsContact N-O 3.1Å; A898-P1020 HydrophobicContact CB-CB 4.26Å; A898-P1020 HydrophobicContact CB-CG 4.46Å; A898-P1020 PolarHBondContact N-O 2.85Å; A898-P1020 VanDerWaalsContact N-O 3.08Å
1021	N	85.1	Confident	90.2	Very high	22 Å²	22	18.2 Å²	18.2	12%	0.118	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-3.4	175.4	-51.5	-75.9	0	0	0	112.5	Q452 A898 G900 K901 D1019	Q452-N1021 PolarHBondContact NE2-ND2 3.47Å; A898-N1021 WeakPolarHBondContact CB-OD1 3.21Å; A898-N1021 PolarHBondContact O-OD1 2.99Å; A898-N1021 VanDerWaalsContact O-OD1 3.09Å; G900-N1021 WeakPolarHBondContact CA-OD1 3.49Å; G900-N1021 PolarHBondContact N-OD1 3.3Å; K901-N1021 WeakPolarHBondContact O-CB 3.46Å; D1019-N1021 PolarHBondContact O-N 2.89Å; D1019-N1021 VanDerWaalsContact O-N 3.17Å; D1019-N1021 WeakPolarHBondContact OD1-CB 3.43Å; D1019-N1021 PolarHBondContact OD1-N 2.88Å; D1019-N1021 PolarHBondContact OD1-ND2 3.17Å
1022	S	85.2	Confident	90.4	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.007	10%	0.097	C	C	.	.	S	Bend	trans	-65.7	147.9	177.7	-177.9	0	0	0	0	112	D1019 I1024 A1025	D1019-S1022 VanDerWaalsContact O-CB 3.3Å; D1019-S1022 WeakPolarHBondContact O-CB 3.37Å; D1019-S1022 PolarHBondContact O-N 3.21Å; D1019-S1022 VanDerWaalsContact O-N 3.13Å; S1022-I1024 PolarHBondContact O-N 2.89Å; S1022-I1024 WeakPolarHBondContact OG-CG1 3.37Å; S1022-I1024 PolarHBondContact OG-N 3.43Å; S1022-A1025 VanDerWaalsContact O-CB 3.31Å; S1022-A1025 WeakPolarHBondContact O-CB 3.48Å; S1022-A1025 PolarHBondContact O-N 3.18Å; S1022-A1025 VanDerWaalsContact O-N 3.16Å
1023	I	80.9	Confident	90.4	Very high	58 Å²	58	19 Å²	19	30%	0.297	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.4	173.7	175.2	164.1	0	0	0	113.3	T894 A1050 V1052	T894-I1023 PolarHBondContact N-O 3.49Å; T894-I1023 PolarHBondContact OG1-O 3.07Å; I1023-A1050 HydrophobicContact CG2-CB 4.2Å; I1023-V1052 HydrophobicContact CG2-CB 3.84Å; I1023-V1052 HydrophobicContact CG2-CG1 4.21Å; I1023-V1052 HydrophobicContact CG2-CG2 4.23Å
1024	I	85.2	Confident	90.6	Very high	13 Å²	13	23.5 Å²	23.5	7%	0.067	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.3	18.9	178.5	57.7	169.8	0	0	0	111.7	N1013 A1016 S1022 G1026 M1027 A1050 V1052	N1013-I1024 HydrophobicContact CB-CD1 3.68Å; A1016-I1024 WeakPolarHBondContact CA-O 3.18Å; A1016-I1024 HydrophobicContact CB-CD1 4.27Å; A1016-I1024 HydrophobicContact CB-CG1 4.27Å; A1016-I1024 VanDerWaalsContact CB-O 3.31Å; A1016-I1024 WeakPolarHBondContact CB-O 3.47Å; S1022-I1024 PolarHBondContact O-N 2.89Å; S1022-I1024 WeakPolarHBondContact OG-CG1 3.37Å; S1022-I1024 PolarHBondContact OG-N 3.43Å; I1024-G1026 PolarHBondContact O-N 2.95Å; I1024-M1027 HydrophobicContact CB-CB 4.3Å; I1024-M1027 HydrophobicContact CB-SD 4.41Å; I1024-M1027 HydrophobicContact CG2-SD 4.42Å; I1024-M1027 WeakPolarHBondContact O-CB 3.46Å; I1024-M1027 PolarHBondContact O-N 3.32Å; I1024-A1050 HydrophobicContact CG2-CB 3.75Å; I1024-V1052 HydrophobicContact CD1-CG1 4.27Å
1025	A	87.5	Confident	90.7	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	130.3	178.7	0	0	0	0	0	110.9	V455 N881 S1022 M1027	V455-A1025 HydrophobicContact CG2-CB 4.13Å; N881-A1025 PolarHBondContact ND2-O 3.18Å; S1022-A1025 VanDerWaalsContact O-CB 3.31Å; S1022-A1025 WeakPolarHBondContact O-CB 3.48Å; S1022-A1025 PolarHBondContact O-N 3.18Å; S1022-A1025 VanDerWaalsContact O-N 3.16Å; A1025-M1027 VanDerWaalsContact C-N 3.27Å; A1025-M1027 PolarHBondContact O-N 2.86Å
1026	G	87.1	Confident	91	Very high	24 Å²	24	29.8 Å²	29.8	25%	0.247	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	-1.4	-178.2	0	0	0	0	0	115.1	N881 A1016 I1024	N881-G1026 WeakPolarHBondContact ND2-CA 3.48Å; A1016-G1026 PolarHBondContact O-N 3.13Å; I1024-G1026 PolarHBondContact O-N 2.95Å
1027	M	90.6	Very high	91.3	Very high	12 Å²	12	31.9 Å²	31.9	6%	0.059	16%	0.158	C	C	.	.			trans	-62.8	125.6	168.9	-178.8	175.8	168.9	0	0	109.1	N881 H963 V965 T1011 A1016 I1024 A1025 V1029	N881-M1027 HydrophobicContact CB-CB 4.43Å; H963-M1027 WeakPolarHBondContact CE1-CE 3.44Å; V965-M1027 HydrophobicContact CG2-CE 4.03Å; T1011-M1027 HydrophobicContact CG2-CE 4.25Å; A1016-M1027 HydrophobicContact CB-CB 4.22Å; A1016-M1027 WeakPolarHBondContact CB-O 3.38Å; I1024-M1027 HydrophobicContact CB-CB 4.3Å; I1024-M1027 HydrophobicContact CB-SD 4.41Å; I1024-M1027 HydrophobicContact CG2-SD 4.42Å; I1024-M1027 WeakPolarHBondContact O-CB 3.46Å; I1024-M1027 PolarHBondContact O-N 3.32Å; A1025-M1027 VanDerWaalsContact C-N 3.27Å; A1025-M1027 PolarHBondContact O-N 2.86Å; M1027-V1029 HydrophobicContact CG-CG1 4.28Å; M1027-V1029 PolarHBondContact O-N 2.96Å
1028	P	92.2	Very high	91.7	Very high	49 Å²	49	28.7 Å²	28.7	32%	0.318	14%	0.144	S	C	.	.			trans	-65	138.5	170.2	30.6	-34.9	0	0	0	108.2	H963 M990	H963-P1028 PolarHBondContact NE2-O 3.17Å; M990-P1028 HydrophobicContact CE-CB 3.64Å; M990-P1028 HydrophobicContact CE-CG 3.96Å; M990-P1028 HydrophobicContact SD-CB 4.22Å
1029	V	95.5	Very high	92.3	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.006	13%	0.127	C	C	.	.			trans	-138.5	161.1	-175.7	-69	0	0	0	0	110	N994 T1011 A1016 M1027 E1031 W1033	N994-V1029 PolarHBondContact ND2-O 3.26Å; T1011-V1029 WeakPolarHBondContact O-CB 3.46Å; A1016-V1029 HydrophobicContact CB-CG1 3.89Å; A1016-V1029 HydrophobicContact CB-CG2 4.33Å; M1027-V1029 HydrophobicContact CG-CG1 4.28Å; M1027-V1029 PolarHBondContact O-N 2.96Å; V1029-E1031 PolarHBondContact O-N 3.38Å; V1029-W1033 HydrophobicContact CG2-CH2 3.62Å; V1029-W1033 HydrophobicContact CG2-CZ3 4.06Å
1030	L	97.9	Very high	92.8	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.01	13%	0.125	C	C	.	.			trans	-74.6	118.3	170.1	-70.7	163.2	0	0	0	108.9	T930 H963 M990 I993 N994 F997 T1011 V1012 V1032	T930-L1030 HydrophobicContact CG2-CB 4.48Å; T930-L1030 HydrophobicContact CG2-CD1 3.83Å; H963-L1030 HydrophobicContact CB-CD1 4.09Å; M990-L1030 HydrophobicContact CB-CD2 4.03Å; M990-L1030 HydrophobicContact CG-CD2 3.85Å; M990-L1030 HydrophobicContact CG-CG 4.27Å; I993-L1030 HydrophobicContact CG2-CD2 3.92Å; N994-L1030 WeakPolarHBondContact OD1-CA 3.45Å; F997-L1030 HydrophobicContact CE2-CB 4.24Å; F997-L1030 HydrophobicContact CE2-CD2 3.98Å; F997-L1030 HydrophobicContact CZ-CB 4.2Å; F997-L1030 HydrophobicContact CZ-CD2 4.09Å; T1011-L1030 PolarHBondContact O-N 3.08Å; V1012-L1030 HydrophobicContact CG1-CB 4.18Å; L1030-V1032 HydrophobicContact CB-CG1 4.15Å; L1030-V1032 PolarHBondContact O-N 3.11Å
1031	E	97.3	Very high	93.3	Very high	28 Å²	28	24.8 Å²	24.8	13%	0.131	13%	0.125	C	C	.	.			trans	-81.8	50.3	-170.3	-57.9	-178.5	138.5	0	0	113.1	N994 F997 Q1017 V1029 W1033 K1034	N994-E1031 PolarHBondContact OD1-N 2.96Å; F997-E1031 HydrophobicContact CD2-CB 4.44Å; Q1017-E1031 PolarHBondContact NE2-OE1 3.38Å; Q1017-E1031 PolarHBondContact OE1-OE1 2.93Å; V1029-E1031 PolarHBondContact O-N 3.38Å; E1031-W1033 HydrophobicContact CB-CH2 4.25Å; E1031-W1033 HydrophobicContact CB-CZ2 4.06Å; E1031-W1033 HydrophobicContact CG-CH2 4.13Å; E1031-W1033 HydrophobicContact CG-CZ2 4.03Å; E1031-W1033 PolarHBondContact O-N 3.06Å; E1031-K1034 HydrophobicContact CB-CD 4.03Å; E1031-K1034 HydrophobicContact CB-CG 4.3Å; E1031-K1034 WeakPolarHBondContact O-CB 3.23Å; E1031-K1034 PolarHBondContact O-N 3.43Å; E1031-K1034 IonicContact OE1-NZ 3.69Å; E1031-K1034 PolarHBondContact OE1-NZ 2.88Å; E1031-K1034 WeakPolarHBondContact OE2-CE 3.24Å; E1031-K1034 IonicContact OE2-NZ 3.7Å; E1031-K1034 PolarHBondContact OE2-NZ 3.5Å
1032	V	98	Very high	93.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-56.8	-27.4	-170.5	-58.1	0	0	0	0	113.8	T930 F997 V1003 V1005 V1012 L1030 K1034 S1035 V1038 I1056	T930-V1032 HydrophobicContact CG2-CG1 3.83Å; F997-V1032 HydrophobicContact CE1-CB 4.43Å; F997-V1032 HydrophobicContact CE1-CG1 3.92Å; F997-V1032 HydrophobicContact CZ-CG1 4.03Å; V1003-V1032 HydrophobicContact CB-CB 4.48Å; V1003-V1032 HydrophobicContact CG1-CB 3.91Å; V1003-V1032 HydrophobicContact CG1-CG1 3.76Å; V1005-V1032 HydrophobicContact CG2-CB 4.43Å; V1005-V1032 HydrophobicContact CG2-CG1 4.27Å; V1005-V1032 HydrophobicContact CG2-CG2 4.24Å; V1012-V1032 HydrophobicContact CB-CG1 4.3Å; V1012-V1032 HydrophobicContact CB-CG2 3.93Å; V1012-V1032 HydrophobicContact CG1-CG1 3.78Å; V1012-V1032 HydrophobicContact CG1-CG2 4.3Å; L1030-V1032 HydrophobicContact CB-CG1 4.15Å; L1030-V1032 PolarHBondContact O-N 3.11Å; V1032-K1034 PolarHBondContact O-N 3.23Å; V1032-S1035 WeakPolarHBondContact O-CB 3.19Å; V1032-S1035 PolarHBondContact O-N 3.3Å; V1032-S1035 PolarHBondContact O-OG 2.82Å; V1032-V1038 HydrophobicContact CB-CG2 4.47Å; V1032-V1038 HydrophobicContact CG2-CG1 4.39Å; V1032-V1038 VanDerWaalsContact O-CG2 3.25Å; V1032-V1038 WeakPolarHBondContact O-CG2 3.23Å; V1032-I1056 HydrophobicContact CG2-CD1 4.09Å
1033	W	96.8	Very high	93.9	Very high	29 Å²	29	35.3 Å²	35.3	11%	0.11	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-69	-12.4	-179.6	60.8	84.6	0	0	0	113.9	V1012 V1029 E1031 S1035 I1056 K1059 N1061	V1012-W1033 WeakPolarHBondContact O-CZ3 3.49Å; V1029-W1033 HydrophobicContact CG2-CH2 3.62Å; V1029-W1033 HydrophobicContact CG2-CZ3 4.06Å; E1031-W1033 HydrophobicContact CB-CH2 4.25Å; E1031-W1033 HydrophobicContact CB-CZ2 4.06Å; E1031-W1033 HydrophobicContact CG-CH2 4.13Å; E1031-W1033 HydrophobicContact CG-CZ2 4.03Å; E1031-W1033 PolarHBondContact O-N 3.06Å; W1033-S1035 VanDerWaalsContact C-N 3.28Å; W1033-I1056 HydrophobicContact CB-CG2 4.44Å; W1033-I1056 HydrophobicContact CD2-CG2 4.5Å; W1033-I1056 HydrophobicContact CE3-CG2 3.84Å; W1033-K1059 HydrophobicContact CB-CD 4Å; W1033-N1061 PolarHBondContact O-ND2 2.92Å
1034	K	97.1	Very high	94.3	Very high	95 Å²	95	35.8 Å²	35.8	41%	0.413	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-76.7	-14.9	174.1	-65.7	-175.9	179.1	176	0	113	F997 P998 E1031 V1032	F997-K1034 HydrophobicContact CB-CB 4.17Å; P998-K1034 HydrophobicContact CG-CB 4.2Å; P998-K1034 HydrophobicContact CG-CD 4.37Å; E1031-K1034 HydrophobicContact CB-CD 4.03Å; E1031-K1034 HydrophobicContact CB-CG 4.3Å; E1031-K1034 WeakPolarHBondContact O-CB 3.23Å; E1031-K1034 PolarHBondContact O-N 3.43Å; E1031-K1034 IonicContact OE1-NZ 3.69Å; E1031-K1034 PolarHBondContact OE1-NZ 2.88Å; E1031-K1034 WeakPolarHBondContact OE2-CE 3.24Å; E1031-K1034 IonicContact OE2-NZ 3.7Å; E1031-K1034 PolarHBondContact OE2-NZ 3.5Å; V1032-K1034 PolarHBondContact O-N 3.23Å
1035	S	97.5	Very high	94.4	Very high	4 Å²	4	37.6 Å²	37.6	3%	0.028	18%	0.182	C	C	.	.	S	Bend	trans	-75	165.2	177	69.3	0	0	0	0	113.4	F997 V1003 V1032 W1033 Q1037 V1038 N1061	F997-S1035 VanDerWaalsContact O-CA 3.24Å; F997-S1035 WeakPolarHBondContact O-CA 3.39Å; F997-S1035 WeakPolarHBondContact O-CB 3.26Å; V1003-S1035 VanDerWaalsContact CG2-CB 3.49Å; V1003-S1035 VanDerWaalsContact CG2-OG 3.26Å; V1003-S1035 WeakPolarHBondContact CG2-OG 3.29Å; V1032-S1035 WeakPolarHBondContact O-CB 3.19Å; V1032-S1035 PolarHBondContact O-N 3.3Å; V1032-S1035 PolarHBondContact O-OG 2.82Å; W1033-S1035 VanDerWaalsContact C-N 3.28Å; S1035-Q1037 PolarHBondContact OG-O 3.06Å; S1035-V1038 WeakPolarHBondContact OG-CG2 3.45Å; S1035-N1061 PolarHBondContact O-ND2 3.49Å
1036	K	96.3	Very high	94	Very high	136 Å²	136	39.3 Å²	39.3	59%	0.591	20%	0.199	S	C	*	.	S	Bend	trans	-65.4	-39.7	-179.2	-60.2	-178.1	-170.3	161.9	0	112.7	T1000 D1001	T1000-K1036 PolarHBondContact O-N 3.5Å; T1000-K1036 VanDerWaalsContact O-N 3.12Å; D1001-K1036 WeakPolarHBondContact O-CB 3.23Å; D1001-K1036 WeakPolarHBondContact OD1-CE 3.39Å; D1001-K1036 IonicContact OD1-NZ 3.83Å; D1001-K1036 PolarHBondContact OD1-NZ 3.38Å
1037	Q	97.9	Very high	93.6	Very high	43 Å²	43	41.9 Å²	41.9	20%	0.201	21%	0.21	C	C	.	.			trans	-146.4	141.2	178.7	-174.4	63.3	-89.6	0	0	111.2	M920 D1001 L1002 V1003 S1035 N1061	M920-Q1037 HydrophobicContact CE-CG 3.95Å; M920-Q1037 HydrophobicContact SD-CG 4.08Å; D1001-Q1037 PolarHBondContact O-N 3.28Å; L1002-Q1037 CarbonylContact C-O 3.58Å; L1002-Q1037 WeakPolarHBondContact CA-O 3.24Å; L1002-Q1037 HydrophobicContact CD1-CB 3.95Å; L1002-Q1037 HydrophobicContact CD1-CG 3.87Å; V1003-Q1037 PolarHBondContact N-O 2.67Å; S1035-Q1037 PolarHBondContact OG-O 3.06Å; Q1037-N1061 PolarHBondContact OE1-O 3.1Å
1038	V	98.5	Very high	92.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.2	176	-174.8	0	0	0	0	109.7	V1003 V1005 V1032 S1035 V1040 N1061 T1062 A1063	V1003-V1038 HydrophobicContact CB-CG2 4.37Å; V1003-V1038 CarbonylContact O-C 2.99Å; V1003-V1038 WeakPolarHBondContact O-CA 3.37Å; V1005-V1038 HydrophobicContact CG2-CG1 3.65Å; V1032-V1038 HydrophobicContact CB-CG2 4.47Å; V1032-V1038 HydrophobicContact CG2-CG1 4.39Å; V1032-V1038 VanDerWaalsContact O-CG2 3.25Å; V1032-V1038 WeakPolarHBondContact O-CG2 3.23Å; S1035-V1038 WeakPolarHBondContact OG-CG2 3.45Å; V1038-V1040 HydrophobicContact CG1-CG2 3.97Å; V1038-N1061 PolarHBondContact N-O 3.38Å; V1038-T1062 HydrophobicContact CB-CG2 4.19Å; V1038-T1062 HydrophobicContact CG1-CG2 4.29Å; V1038-T1062 CarbonylContact O-C 3.36Å; V1038-T1062 WeakPolarHBondContact O-CA 3.45Å; V1038-A1063 PolarHBondContact O-N 2.96Å
1039	I	98.4	Very high	91.7	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	118.5	168.4	-61.4	172.5	0	0	0	108.5	I912 A917 M920 L1002 V1003 L1004 V1005 M1041 A1063 L1065	I912-I1039 HydrophobicContact CD1-CD1 4.24Å; I912-I1039 HydrophobicContact CD1-CG1 4.22Å; A917-I1039 HydrophobicContact CB-CD1 4.15Å; M920-I1039 HydrophobicContact CB-CD1 4.39Å; M920-I1039 HydrophobicContact SD-CD1 4.26Å; L1002-I1039 HydrophobicContact CD1-CD1 3.93Å; L1002-I1039 HydrophobicContact CD1-CG1 4Å; L1002-I1039 HydrophobicContact CD2-CD1 4.43Å; V1003-I1039 PolarHBondContact O-N 3.07Å; L1004-I1039 HydrophobicContact CD2-CB 3.84Å; L1004-I1039 HydrophobicContact CD2-CD1 3.95Å; L1004-I1039 HydrophobicContact CD2-CG1 4.3Å; L1004-I1039 HydrophobicContact CD2-CG2 4.49Å; V1005-I1039 PolarHBondContact N-O 3.25Å; I1039-M1041 HydrophobicContact CG2-CG 4.26Å; I1039-A1063 WeakPolarHBondContact CA-O 3.36Å; I1039-L1065 HydrophobicContact CG2-CB 3.82Å; I1039-L1065 HydrophobicContact CG2-CD2 4.34Å
1040	V	97.9	Very high	90.2	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	120	176.9	-177.7	0	0	0	0	110.2	V1005 V1038 K1042 F1057 T1062 A1063 M1064 L1065	V1005-V1040 HydrophobicContact CB-CB 4.49Å; V1005-V1040 HydrophobicContact CB-CG1 4.48Å; V1005-V1040 HydrophobicContact CB-CG2 4.1Å; V1005-V1040 HydrophobicContact CG1-CG1 4.46Å; V1005-V1040 HydrophobicContact CG2-CG2 4.27Å; V1038-V1040 HydrophobicContact CG1-CG2 3.97Å; V1040-K1042 HydrophobicContact CG1-CD 4.24Å; V1040-F1057 HydrophobicContact CB-CE1 4.4Å; V1040-F1057 HydrophobicContact CG1-CD1 4.24Å; V1040-F1057 HydrophobicContact CG1-CE1 3.7Å; V1040-F1057 HydrophobicContact CG1-CZ 4.39Å; V1040-F1057 HydrophobicContact CG2-CD1 4.16Å; V1040-F1057 HydrophobicContact CG2-CE1 4.16Å; V1040-T1062 HydrophobicContact CG2-CG2 3.75Å; V1040-A1063 PolarHBondContact N-O 3.5Å; V1040-M1064 HydrophobicContact CB-CE 3.88Å; V1040-M1064 HydrophobicContact CB-SD 3.85Å; V1040-M1064 HydrophobicContact CG1-CE 3.82Å; V1040-M1064 HydrophobicContact CG1-SD 4.39Å; V1040-M1064 HydrophobicContact CG2-SD 4.32Å; V1040-L1065 PolarHBondContact O-N 3.41Å
1041	M	96.6	Very high	88.8	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	112	180	-64.1	174.9	56.1	0	0	111.2	V1005 I1006 G1007 I1039 L1065 T1072 C1073 L1076	V1005-M1041 PolarHBondContact O-N 3.44Å; I1006-M1041 HydrophobicContact CD1-SD 4.22Å; I1006-M1041 HydrophobicContact CG1-SD 3.97Å; I1006-M1041 HydrophobicContact CG2-CB 4.4Å; I1006-M1041 HydrophobicContact CG2-CE 4.42Å; G1007-M1041 PolarHBondContact N-O 3.07Å; I1039-M1041 HydrophobicContact CG2-CG 4.26Å; M1041-L1065 WeakPolarHBondContact CA-O 3.48Å; M1041-L1065 HydrophobicContact CG-CB 4.18Å; M1041-L1065 HydrophobicContact CG-CD2 4.07Å; M1041-L1065 HydrophobicContact CG-CG 4.44Å; M1041-L1065 HydrophobicContact SD-CD2 4.34Å; M1041-T1072 WeakPolarHBondContact CE-OG1 3.49Å; M1041-C1073 VanDerWaalsContact CE-SG 3.58Å; M1041-L1076 HydrophobicContact CE-CD1 4.2Å; M1041-L1076 HydrophobicContact SD-CD1 4.04Å
1042	K	92.9	Very high	87.8	Confident	34 Å²	34	49.7 Å²	49.7	15%	0.148	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	164.9	178.7	67.4	-173.4	-55.1	-137.5	0	112.1	V1040 S1044 L1045 G1046 F1057 M1064 L1066 G1067	V1040-K1042 HydrophobicContact CG1-CD 4.24Å; K1042-S1044 VanDerWaalsContact CD-O 3.23Å; K1042-S1044 WeakPolarHBondContact CD-O 3.48Å; K1042-S1044 WeakPolarHBondContact CE-O 3.28Å; K1042-S1044 WeakPolarHBondContact CG-O 3.19Å; K1042-S1044 PolarHBondContact NZ-O 2.99Å; K1042-L1045 PolarHBondContact NZ-O 3.43Å; K1042-G1046 PolarHBondContact NZ-O 3.43Å; K1042-F1057 HydrophobicContact CD-CE2 4.23Å; K1042-F1057 HydrophobicContact CD-CZ 4.13Å; K1042-M1064 HydrophobicContact CD-CE 3.6Å; K1042-M1064 HydrophobicContact CG-CE 4.06Å; K1042-L1066 HydrophobicContact CG-CD2 3.97Å; K1042-L1066 CarbonylContact O-C 3.35Å; K1042-L1066 VanDerWaalsContact O-CA 3.3Å; K1042-L1066 WeakPolarHBondContact O-CA 3.48Å; K1042-G1067 CarbonylContact C-O 3.54Å; K1042-G1067 VanDerWaalsContact C-O 3.26Å; K1042-G1067 PolarHBondContact O-N 2.92Å
1043	R	90.5	Very high	87.1	Confident	209 Å²	209	53.1 Å²	53.1	79%	0.789	28%	0.281	S	S	*	.	S	Bend	trans	-69.4	-38.7	-176.3	-67.1	175.9	-68.1	173.2	0.4	114.3	G1067	R1043-G1067 WeakPolarHBondContact CA-O 3.33Å; R1043-G1067 PolarHBondContact N-O 3.29Å
1044	S	89.1	Confident	86.8	Confident	68 Å²	68	51.8 Å²	51.8	48%	0.476	28%	0.275	S	S	.	.	S	Bend	trans	-157.5	174	-179.1	69	0	0	0	0	109.8	K1042 G1046	K1042-S1044 VanDerWaalsContact CD-O 3.23Å; K1042-S1044 WeakPolarHBondContact CD-O 3.48Å; K1042-S1044 WeakPolarHBondContact CE-O 3.28Å; K1042-S1044 WeakPolarHBondContact CG-O 3.19Å; K1042-S1044 PolarHBondContact NZ-O 2.99Å; S1044-G1046 PolarHBondContact O-N 3.5Å; S1044-G1046 VanDerWaalsContact O-N 3.08Å; S1044-G1046 PolarHBondContact OG-N 3.49Å
1045	L	86	Confident	86.6	Confident	51 Å²	51	48.8 Å²	48.8	27%	0.267	27%	0.266	S	S	.	.	S	Bend	trans	-71.2	5.4	175.3	-66.6	171.9	0	0	0	114.7	H909 K1042 M1064	H909-L1045 VanDerWaalsContact CE1-CD1 3.49Å; H909-L1045 WeakPolarHBondContact CE1-CD1 3.16Å; H909-L1045 WeakPolarHBondContact ND1-CD1 3.25Å; K1042-L1045 PolarHBondContact NZ-O 3.43Å; L1045-M1064 HydrophobicContact CD2-CE 3.93Å; L1045-M1064 HydrophobicContact CD2-CG 4.34Å
1046	G	79.3	Confident	86.5	Confident	36 Å²	36	48.6 Å²	48.6	37%	0.371	26%	0.264	S	S	.	.			trans	-60.8	161.9	-179.3	0	0	0	0	0	115.1	K1042 S1044	K1042-G1046 PolarHBondContact NZ-O 3.43Å; S1044-G1046 PolarHBondContact O-N 3.5Å; S1044-G1046 VanDerWaalsContact O-N 3.08Å; S1044-G1046 PolarHBondContact OG-N 3.49Å
1047	V	79.8	Confident	86.4	Confident	78 Å²	78	42.2 Å²	42.2	47%	0.473	24%	0.237	S	C	.	.			trans	-69.5	163	-174.2	-63.4	0	0	0	0	114.5	A1051	V1047-A1051 HydrophobicContact CG2-CB 4.21Å
1048	G	73.4	Confident	86	Confident	26 Å²	26	42.9 Å²	42.9	27%	0.268	24%	0.238	S	C	.	.			trans	-81.2	-155.1	174.3	0	0	0	0	0	112.8	N1009 A1051	N1009-G1048 VanDerWaalsContact ND2-CA 3.27Å; N1009-G1048 WeakPolarHBondContact ND2-CA 3.42Å; N1009-G1048 PolarHBondContact ND2-N 3.07Å; G1048-A1051 PolarHBondContact O-N 2.85Å
1049	Y	69.6	Low	85.7	Confident	115 Å²	115	45 Å²	45	45%	0.451	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-43.2	178.8	173.4	-102.6	0	0	0	111.5	A829 D1010 A1051	A829-Y1049 HydrophobicContact CB-CD1 3.49Å; A829-Y1049 VanDerWaalsContact CB-CD1 3.49Å; A829-Y1049 HydrophobicContact CB-CD2 3.24Å; A829-Y1049 HydrophobicContact CB-CE1 3.47Å; A829-Y1049 VanDerWaalsContact CB-CE1 3.47Å; A829-Y1049 HydrophobicContact CB-CE2 3.22Å; A829-Y1049 HydrophobicContact CB-CG 3.35Å; D1010-Y1049 WeakPolarHBondContact OD2-CB 3.47Å; D1010-Y1049 PolarHBondContact OD2-N 3.46Å; Y1049-A1051 PolarHBondContact O-N 2.81Å
1050	A	64.6	Low	85.3	Confident	18 Å²	18	51 Å²	51	15%	0.149	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	0.7	176.4	0	0	0	0	0	113.6	D1010 I1023 I1024 V1052	D1010-A1050 PolarHBondContact OD2-N 3.47Å; I1023-A1050 HydrophobicContact CG2-CB 4.2Å; I1024-A1050 HydrophobicContact CG2-CB 3.75Å; A1050-V1052 HydrophobicContact CB-CG1 4.1Å; A1050-V1052 PolarHBondContact O-N 2.93Å; A1050-V1052 VanDerWaalsContact O-N 3.1Å
1051	A	68.5	Low	85.2	Confident	72 Å²	72	52.6 Å²	52.6	60%	0.595	30%	0.295	S	S	*	.			trans	53.5	28.6	-179.3	0	0	0	0	0	113.9	V1047 G1048 Y1049	V1047-A1051 HydrophobicContact CG2-CB 4.21Å; G1048-A1051 PolarHBondContact O-N 2.85Å; Y1049-A1051 PolarHBondContact O-N 2.81Å
1052	V	75.1	Confident	85.2	Confident	26 Å²	26	52.6 Å²	52.6	16%	0.158	29%	0.294	C	S	.	.			trans	-106.3	142.7	177.2	70.4	0	0	0	0	109.6	I1023 I1024 A1050	I1023-V1052 HydrophobicContact CG2-CB 3.84Å; I1023-V1052 HydrophobicContact CG2-CG1 4.21Å; I1023-V1052 HydrophobicContact CG2-CG2 4.23Å; I1024-V1052 HydrophobicContact CD1-CG1 4.27Å; A1050-V1052 HydrophobicContact CB-CG1 4.1Å; A1050-V1052 PolarHBondContact O-N 2.93Å; A1050-V1052 VanDerWaalsContact O-N 3.1Å
1053	D	83.5	Confident	85.4	Confident	72 Å²	72	51.1 Å²	51.1	39%	0.385	29%	0.288	S	S	.	.			trans	-71	156.6	169.3	-77.7	-35.9	0	0	0	110.4	I905 N1013	I905-D1053 HydrophobicContact CD1-CB 3.18Å; N1013-D1053 PolarHBondContact ND2-O 3.25Å
1054	N	91.3	Very high	85.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.251	C	S	.	.			trans	-110.8	113.1	-175.7	-167.2	-22.9	0	0	0	110.3	N1009 N1013 I1056 F1057	N1009-N1054 PolarHBondContact O-ND2 3.4Å; N1009-N1054 VanDerWaalsContact OD1-CB 3.29Å; N1009-N1054 WeakPolarHBondContact OD1-CB 3.26Å; N1009-N1054 PolarHBondContact OD1-ND2 3.39Å; N1013-N1054 PolarHBondContact OD1-OD1 3.35Å; N1054-I1056 WeakPolarHBondContact ND2-CD1 3.35Å; N1054-I1056 PolarHBondContact O-N 3.25Å; N1054-I1056 VanDerWaalsContact O-N 3.12Å; N1054-I1056 VanDerWaalsContact OD1-CG1 3.26Å; N1054-I1056 WeakPolarHBondContact OD1-CG1 3.38Å; N1054-I1056 WeakPolarHBondContact OD1-CG2 3.43Å; N1054-I1056 PolarHBondContact OD1-N 2.79Å; N1054-I1056 VanDerWaalsContact OD1-N 3.14Å; N1054-F1057 HydrophobicContact CB-CD1 4.26Å; N1054-F1057 HydrophobicContact CB-CD2 3.81Å; N1054-F1057 HydrophobicContact CB-CE1 3.97Å; N1054-F1057 HydrophobicContact CB-CE2 3.52Å; N1054-F1057 HydrophobicContact CB-CG 4.17Å; N1054-F1057 HydrophobicContact CB-CZ 3.61Å; N1054-F1057 PolarHBondContact O-N 3.04Å; N1054-F1057 VanDerWaalsContact O-N 3.16Å
1055	P	92.1	Very high	86	Confident	32 Å²	32	38.2 Å²	38.2	21%	0.208	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-58.1	-26.8	-179.5	-24.7	35.1	0	0	0	113.4	N1013 A1015 F1057 Y1058 K1059	N1013-P1055 WeakPolarHBondContact OD1-CD 3.19Å; A1015-P1055 HydrophobicContact CB-CG 4.05Å; P1055-F1057 PolarHBondContact O-N 3.44Å; P1055-Y1058 PolarHBondContact O-N 3.19Å; P1055-Y1058 VanDerWaalsContact O-N 3.1Å; P1055-K1059 PolarHBondContact O-N 3.32Å
1056	I	94.5	Very high	86.5	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-61.8	-30.1	-179.1	81.9	-172.5	0	0	0	112.1	V1012 V1032 W1033 N1054 Y1058 K1059 T1062	V1012-I1056 HydrophobicContact CB-CD1 4.14Å; V1012-I1056 HydrophobicContact CG2-CD1 3.67Å; V1012-I1056 WeakPolarHBondContact O-CD1 3.48Å; V1032-I1056 HydrophobicContact CG2-CD1 4.09Å; W1033-I1056 HydrophobicContact CB-CG2 4.44Å; W1033-I1056 HydrophobicContact CD2-CG2 4.5Å; W1033-I1056 HydrophobicContact CE3-CG2 3.84Å; N1054-I1056 WeakPolarHBondContact ND2-CD1 3.35Å; N1054-I1056 PolarHBondContact O-N 3.25Å; N1054-I1056 VanDerWaalsContact O-N 3.12Å; N1054-I1056 VanDerWaalsContact OD1-CG1 3.26Å; N1054-I1056 WeakPolarHBondContact OD1-CG1 3.38Å; N1054-I1056 WeakPolarHBondContact OD1-CG2 3.43Å; N1054-I1056 PolarHBondContact OD1-N 2.79Å; N1054-I1056 VanDerWaalsContact OD1-N 3.14Å; I1056-Y1058 PolarHBondContact O-N 3.41Å; I1056-K1059 HydrophobicContact CG2-CD 4.48Å; I1056-K1059 PolarHBondContact O-N 3.37Å; I1056-K1059 VanDerWaalsContact O-N 3.07Å; I1056-T1062 WeakPolarHBondContact O-CB 3.41Å; I1056-T1062 WeakPolarHBondContact O-CG2 3.35Å; I1056-T1062 PolarHBondContact O-OG1 3.05Å
1057	F	93.9	Very high	87.1	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.009	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-64.2	-16.7	-179.6	-57.9	-19.3	0	0	0	112.8	H909 N1009 V1040 K1042 N1054 P1055 M1064	H909-F1057 WeakPolarHBondContact CA-O 3.33Å; H909-F1057 VanDerWaalsContact CB-O 3.26Å; H909-F1057 WeakPolarHBondContact CB-O 3.38Å; N1009-F1057 VanDerWaalsContact OD1-CZ 3.28Å; N1009-F1057 WeakPolarHBondContact OD1-CZ 3.32Å; V1040-F1057 HydrophobicContact CB-CE1 4.4Å; V1040-F1057 HydrophobicContact CG1-CD1 4.24Å; V1040-F1057 HydrophobicContact CG1-CE1 3.7Å; V1040-F1057 HydrophobicContact CG1-CZ 4.39Å; V1040-F1057 HydrophobicContact CG2-CD1 4.16Å; V1040-F1057 HydrophobicContact CG2-CE1 4.16Å; K1042-F1057 HydrophobicContact CD-CE2 4.23Å; K1042-F1057 HydrophobicContact CD-CZ 4.13Å; N1054-F1057 HydrophobicContact CB-CD1 4.26Å; N1054-F1057 HydrophobicContact CB-CD2 3.81Å; N1054-F1057 HydrophobicContact CB-CE1 3.97Å; N1054-F1057 HydrophobicContact CB-CE2 3.52Å; N1054-F1057 HydrophobicContact CB-CG 4.17Å; N1054-F1057 HydrophobicContact CB-CZ 3.61Å; N1054-F1057 PolarHBondContact O-N 3.04Å; N1054-F1057 VanDerWaalsContact O-N 3.16Å; P1055-F1057 PolarHBondContact O-N 3.44Å; F1057-M1064 HydrophobicContact CB-CE 4.37Å; F1057-M1064 HydrophobicContact CB-SD 3.87Å; F1057-M1064 HydrophobicContact CD1-CE 3.91Å; F1057-M1064 HydrophobicContact CD1-SD 3.85Å; F1057-M1064 HydrophobicContact CD2-CE 4.36Å; F1057-M1064 HydrophobicContact CE1-CE 4.33Å; F1057-M1064 HydrophobicContact CG-CE 3.95Å; F1057-M1064 HydrophobicContact CG-SD 3.96Å
1058	Y	91.4	Very high	87.8	Confident	57 Å²	57	37 Å²	37	22%	0.224	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-111.5	2.2	-177.8	-54	-94.7	0	0	0	111.9	I905 H909 P1055 I1056	I905-Y1058 HydrophobicContact CD1-CD2 4.49Å; I905-Y1058 HydrophobicContact CD1-CE2 4.19Å; I905-Y1058 HydrophobicContact CG2-CD1 4.04Å; I905-Y1058 HydrophobicContact CG2-CD2 3.36Å; I905-Y1058 HydrophobicContact CG2-CE1 4.23Å; I905-Y1058 HydrophobicContact CG2-CE2 3.62Å; I905-Y1058 HydrophobicContact CG2-CG 3.6Å; H909-Y1058 HydrophobicContact CB-CD1 4.49Å; P1055-Y1058 PolarHBondContact O-N 3.19Å; P1055-Y1058 VanDerWaalsContact O-N 3.1Å; I1056-Y1058 PolarHBondContact O-N 3.41Å
1059	K	91.6	Very high	88.6	Confident	45 Å²	45	36.4 Å²	36.4	20%	0.196	21%	0.21	C	C	.	.	S	Bend	trans	-76.8	144.7	173.9	-69.3	-177.5	-163	-91.5	0	109.7	S1014 E1018 W1033 P1055 I1056 N1061 T1062	S1014-K1059 VanDerWaalsContact OG-CE 3.3Å; S1014-K1059 WeakPolarHBondContact OG-CE 3.3Å; S1014-K1059 PolarHBondContact OG-NZ 3.03Å; E1018-K1059 IonicContact OE1-NZ 2.92Å; E1018-K1059 PolarHBondContact OE1-NZ 2.78Å; E1018-K1059 VanDerWaalsContact OE1-NZ 3.13Å; E1018-K1059 IonicContact OE2-NZ 3.58Å; E1018-K1059 PolarHBondContact OE2-NZ 3.45Å; W1033-K1059 HydrophobicContact CB-CD 4Å; P1055-K1059 PolarHBondContact O-N 3.32Å; I1056-K1059 HydrophobicContact CG2-CD 4.48Å; I1056-K1059 PolarHBondContact O-N 3.37Å; I1056-K1059 VanDerWaalsContact O-N 3.07Å; K1059-N1061 VanDerWaalsContact C-N 3.27Å; K1059-N1061 PolarHBondContact O-N 3.2Å; K1059-T1062 PolarHBondContact O-N 2.95Å; K1059-T1062 VanDerWaalsContact O-N 3.13Å
1060	P	89.5	Confident	89.7	Confident	126 Å²	126	34 Å²	34	82%	0.818	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-22	-172.1	26.6	-35.6	0	0	0	114.3	T1062	P1060-T1062 VanDerWaalsContact C-N 3.28Å
1061	N	95.1	Very high	91.2	Very high	36 Å²	36	40.6 Å²	40.6	19%	0.193	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	22.1	175	68.6	-30.1	0	0	0	112.7	W1033 S1035 Q1037 V1038 K1059	W1033-N1061 PolarHBondContact O-ND2 2.92Å; S1035-N1061 PolarHBondContact O-ND2 3.49Å; Q1037-N1061 PolarHBondContact OE1-O 3.1Å; V1038-N1061 PolarHBondContact N-O 3.38Å; K1059-N1061 VanDerWaalsContact C-N 3.27Å; K1059-N1061 PolarHBondContact O-N 3.2Å
1062	T	97.1	Very high	92.4	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	126.5	178	-60.4	0	0	0	0	110.4	V1038 V1040 I1056 K1059 P1060 M1064	V1038-T1062 HydrophobicContact CB-CG2 4.19Å; V1038-T1062 HydrophobicContact CG1-CG2 4.29Å; V1038-T1062 CarbonylContact O-C 3.36Å; V1038-T1062 WeakPolarHBondContact O-CA 3.45Å; V1040-T1062 HydrophobicContact CG2-CG2 3.75Å; I1056-T1062 WeakPolarHBondContact O-CB 3.41Å; I1056-T1062 WeakPolarHBondContact O-CG2 3.35Å; I1056-T1062 PolarHBondContact O-OG1 3.05Å; K1059-T1062 PolarHBondContact O-N 2.95Å; K1059-T1062 VanDerWaalsContact O-N 3.13Å; P1060-T1062 VanDerWaalsContact C-N 3.28Å; T1062-M1064 HydrophobicContact CG2-SD 4.4Å
1063	A	96.7	Very high	93.4	Very high	3 Å²	3	36.5 Å²	36.5	3%	0.025	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	131.8	176.1	0	0	0	0	0	110.7	T910 I912 V1038 I1039 V1040	T910-A1063 CarbonylContact O-C 3.03Å; I912-A1063 HydrophobicContact CB-CB 4.49Å; I912-A1063 HydrophobicContact CD1-CB 3.69Å; I912-A1063 HydrophobicContact CG1-CB 3.88Å; I912-A1063 HydrophobicContact CG2-CB 3.86Å; V1038-A1063 PolarHBondContact O-N 2.96Å; I1039-A1063 WeakPolarHBondContact CA-O 3.36Å; V1040-A1063 PolarHBondContact N-O 3.5Å
1064	M	96.9	Very high	94	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.1	176.8	-55.6	-54.6	-64.8	0	0	109.4	H909 T910 E911 I912 V1040 K1042 L1045 F1057 T1062 L1066	H909-M1064 HydrophobicContact CB-CG 4.03Å; T910-M1064 WeakPolarHBondContact O-CB 3.45Å; T910-M1064 PolarHBondContact O-N 2.93Å; E911-M1064 WeakPolarHBondContact CA-O 3.36Å; I912-M1064 PolarHBondContact N-O 3.4Å; V1040-M1064 HydrophobicContact CB-CE 3.88Å; V1040-M1064 HydrophobicContact CB-SD 3.85Å; V1040-M1064 HydrophobicContact CG1-CE 3.82Å; V1040-M1064 HydrophobicContact CG1-SD 4.39Å; V1040-M1064 HydrophobicContact CG2-SD 4.32Å; K1042-M1064 HydrophobicContact CD-CE 3.6Å; K1042-M1064 HydrophobicContact CG-CE 4.06Å; L1045-M1064 HydrophobicContact CD2-CE 3.93Å; L1045-M1064 HydrophobicContact CD2-CG 4.34Å; F1057-M1064 HydrophobicContact CB-CE 4.37Å; F1057-M1064 HydrophobicContact CB-SD 3.87Å; F1057-M1064 HydrophobicContact CD1-CE 3.91Å; F1057-M1064 HydrophobicContact CD1-SD 3.85Å; F1057-M1064 HydrophobicContact CD2-CE 4.36Å; F1057-M1064 HydrophobicContact CE1-CE 4.33Å; F1057-M1064 HydrophobicContact CG-CE 3.95Å; F1057-M1064 HydrophobicContact CG-SD 3.96Å; T1062-M1064 HydrophobicContact CG2-SD 4.4Å; M1064-L1066 HydrophobicContact CB-CD2 4.41Å; M1064-L1066 HydrophobicContact CE-CD2 4.47Å
1065	L	96.8	Very high	94.2	Very high	6 Å²	6	36.9 Å²	36.9	3%	0.031	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	91.8	169.5	-179.8	62.6	0	0	0	108.2	L914 A917 I1039 V1040 M1041 L1076	L914-L1065 HydrophobicContact CD2-CD1 4.38Å; L914-L1065 HydrophobicContact CD2-CD2 4.15Å; L914-L1065 HydrophobicContact CG-CD1 4.41Å; A917-L1065 HydrophobicContact CB-CD2 4.03Å; I1039-L1065 HydrophobicContact CG2-CB 3.82Å; I1039-L1065 HydrophobicContact CG2-CD2 4.34Å; V1040-L1065 PolarHBondContact O-N 3.41Å; M1041-L1065 WeakPolarHBondContact CA-O 3.48Å; M1041-L1065 HydrophobicContact CG-CB 4.18Å; M1041-L1065 HydrophobicContact CG-CD2 4.07Å; M1041-L1065 HydrophobicContact CG-CG 4.44Å; M1041-L1065 HydrophobicContact SD-CD2 4.34Å; L1065-L1076 HydrophobicContact CD2-CD1 4.41Å
1066	L	95.4	Very high	94.3	Very high	53 Å²	53	35.5 Å²	35.5	28%	0.277	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	137.8	-174.3	-62.1	-175.7	0	0	0	112	K1042 M1064	K1042-L1066 HydrophobicContact CG-CD2 3.97Å; K1042-L1066 CarbonylContact O-C 3.35Å; K1042-L1066 VanDerWaalsContact O-CA 3.3Å; K1042-L1066 WeakPolarHBondContact O-CA 3.48Å; M1064-L1066 HydrophobicContact CB-CD2 4.41Å; M1064-L1066 HydrophobicContact CE-CD2 4.47Å
1067	G	92.9	Very high	94.3	Very high	23 Å²	23	37 Å²	37	24%	0.237	20%	0.199	C	C	.	.	S	Bend	trans	156.9	174	177.7	0	0	0	0	0	113.6	K1042 R1043	K1042-G1067 CarbonylContact C-O 3.54Å; K1042-G1067 VanDerWaalsContact C-O 3.26Å; K1042-G1067 PolarHBondContact O-N 2.92Å; R1043-G1067 WeakPolarHBondContact CA-O 3.33Å; R1043-G1067 PolarHBondContact N-O 3.29Å
1068	D	93.3	Very high	94.3	Very high	65 Å²	65	39 Å²	39	35%	0.348	22%	0.216	S	C	.	.			trans	-66.9	136.3	167.3	175.4	-101.9	0	0	0	110.1	K1070 K1071 T1072	D1068-K1070 VanDerWaalsContact C-N 3.34Å; D1068-K1070 PolarHBondContact O-N 3.26Å; D1068-K1070 WeakPolarHBondContact OD1-CB 3.39Å; D1068-K1070 PolarHBondContact OD1-N 3.14Å; D1068-K1071 HydrophobicContact CB-CB 4.39Å; D1068-K1071 HydrophobicContact CB-CD 4.33Å; D1068-K1071 HydrophobicContact CB-CG 4.32Å; D1068-K1071 PolarHBondContact O-N 2.92Å; D1068-K1071 PolarHBondContact OD1-N 3.26Å; D1068-T1072 WeakPolarHBondContact O-CB 3.25Å; D1068-T1072 WeakPolarHBondContact O-CG2 3.46Å; D1068-T1072 PolarHBondContact O-N 3.24Å; D1068-T1072 PolarHBondContact O-OG1 3.38Å
1069	A	91.1	Very high	94.3	Very high	12 Å²	12	39 Å²	39	10%	0.099	22%	0.216	C	C	.	.	H	α-helix	trans	-62	-39.7	-174.2	0	0	0	0	0	112.1	A938 A940 T1072 C1073	A938-A1069 HydrophobicContact CB-CB 3.96Å; A940-A1069 HydrophobicContact CB-CB 4.3Å; A1069-T1072 WeakPolarHBondContact CA-OG1 3.34Å; A1069-T1072 PolarHBondContact O-OG1 2.89Å; A1069-T1072 VanDerWaalsContact O-OG1 3.1Å; A1069-C1073 VanDerWaalsContact O-CB 3.27Å; A1069-C1073 WeakPolarHBondContact O-CB 3.49Å; A1069-C1073 PolarHBondContact O-N 3.43Å; A1069-C1073 PolarHBondContact O-SG 2.85Å
1070	K	93.3	Very high	94.2	Very high	65 Å²	65	36.9 Å²	36.9	28%	0.283	21%	0.207	S	C	.	.	H	α-helix	trans	-65	-50.5	-179.7	-176.2	61.4	169.6	75.8	0	110.8	A938 K939 A940 P943 D1068 T1072 C1073 D1074	A938-K1070 HydrophobicContact CB-CB 4.28Å; A938-K1070 WeakPolarHBondContact O-CB 3.31Å; K939-K1070 WeakPolarHBondContact O-CD 3.02Å; A940-K1070 HydrophobicContact CB-CD 4.39Å; P943-K1070 HydrophobicContact CG-CD 4.3Å; D1068-K1070 VanDerWaalsContact C-N 3.34Å; D1068-K1070 PolarHBondContact O-N 3.26Å; D1068-K1070 WeakPolarHBondContact OD1-CB 3.39Å; D1068-K1070 PolarHBondContact OD1-N 3.14Å; K1070-T1072 VanDerWaalsContact C-N 3.34Å; K1070-T1072 PolarHBondContact O-N 3.03Å; K1070-C1073 PolarHBondContact O-N 3.04Å; K1070-D1074 IonicContact NZ-OD1 3.37Å; K1070-D1074 PolarHBondContact NZ-OD1 3.03Å; K1070-D1074 IonicContact NZ-OD2 2.81Å; K1070-D1074 PolarHBondContact NZ-OD2 3.39Å; K1070-D1074 WeakPolarHBondContact O-CB 3.38Å; K1070-D1074 PolarHBondContact O-N 3.4Å
1071	K	95.4	Very high	94.2	Very high	157 Å²	157	35.8 Å²	35.8	68%	0.683	19%	0.187	S	C	*	.	H	α-helix	trans	-60.2	-43.9	-179.1	-67.7	-174.9	178.9	-178.5	0	112.5	D1068 A1075	D1068-K1071 HydrophobicContact CB-CB 4.39Å; D1068-K1071 HydrophobicContact CB-CD 4.33Å; D1068-K1071 HydrophobicContact CB-CG 4.32Å; D1068-K1071 PolarHBondContact O-N 2.92Å; D1068-K1071 PolarHBondContact OD1-N 3.26Å; K1071-A1075 WeakPolarHBondContact O-CB 3.18Å; K1071-A1075 PolarHBondContact O-N 2.98Å
1072	T	94.4	Very high	93.9	Very high	11 Å²	11	40.5 Å²	40.5	7%	0.067	21%	0.208	C	C	.	.	H	α-helix	trans	-69.8	-42.2	-179.5	47.3	0	0	0	0	111.6	M1041 D1068 A1069 K1070 A1075 L1076	M1041-T1072 WeakPolarHBondContact CE-OG1 3.49Å; D1068-T1072 WeakPolarHBondContact O-CB 3.25Å; D1068-T1072 WeakPolarHBondContact O-CG2 3.46Å; D1068-T1072 PolarHBondContact O-N 3.24Å; D1068-T1072 PolarHBondContact O-OG1 3.38Å; A1069-T1072 WeakPolarHBondContact CA-OG1 3.34Å; A1069-T1072 PolarHBondContact O-OG1 2.89Å; A1069-T1072 VanDerWaalsContact O-OG1 3.1Å; K1070-T1072 VanDerWaalsContact C-N 3.34Å; K1070-T1072 PolarHBondContact O-N 3.03Å; T1072-A1075 PolarHBondContact O-N 3.01Å; T1072-L1076 WeakPolarHBondContact O-CG 3.4Å; T1072-L1076 PolarHBondContact O-N 3.49Å
1073	C	95.7	Very high	93.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64	-42.9	175.6	-64.6	0	0	0	0	112.4	A940 P943 I944 M1041 A1069 K1070 A1075 L1076 Q1077	A940-C1073 HydrophobicContact CB-CB 4.32Å; P943-C1073 HydrophobicContact CB-CB 4.25Å; P943-C1073 HydrophobicContact CG-CB 3.83Å; I944-C1073 HydrophobicContact CD1-CB 4.02Å; I944-C1073 VanDerWaalsContact CD1-SG 3.58Å; I944-C1073 HydrophobicContact CG1-CB 4.06Å; M1041-C1073 VanDerWaalsContact CE-SG 3.58Å; A1069-C1073 VanDerWaalsContact O-CB 3.27Å; A1069-C1073 WeakPolarHBondContact O-CB 3.49Å; A1069-C1073 PolarHBondContact O-N 3.43Å; A1069-C1073 PolarHBondContact O-SG 2.85Å; K1070-C1073 PolarHBondContact O-N 3.04Å; C1073-A1075 VanDerWaalsContact C-N 3.31Å; C1073-A1075 PolarHBondContact O-N 3.17Å; C1073-L1076 PolarHBondContact O-N 3.17Å; C1073-Q1077 WeakPolarHBondContact O-CB 3.24Å; C1073-Q1077 PolarHBondContact O-N 3.16Å
1074	D	95.6	Very high	92.3	Very high	54 Å²	54	45.9 Å²	45.9	29%	0.289	23%	0.234	S	C	.	.	H	α-helix	trans	-60.8	-41.8	175.2	-70	-22.9	0	0	0	111.5	P943 K1070 Q1077 A1078	P943-D1074 WeakPolarHBondContact CB-OD1 3.47Å; P943-D1074 WeakPolarHBondContact CG-OD1 3.03Å; K1070-D1074 IonicContact NZ-OD1 3.37Å; K1070-D1074 PolarHBondContact NZ-OD1 3.03Å; K1070-D1074 IonicContact NZ-OD2 2.81Å; K1070-D1074 PolarHBondContact NZ-OD2 3.39Å; K1070-D1074 WeakPolarHBondContact O-CB 3.38Å; K1070-D1074 PolarHBondContact O-N 3.4Å; D1074-Q1077 PolarHBondContact O-N 2.89Å; D1074-A1078 WeakPolarHBondContact O-CB 3.49Å; D1074-A1078 PolarHBondContact O-N 3.26Å
1075	A	94.9	Very high	90.9	Very high	27 Å²	27	53.2 Å²	53.2	22%	0.223	27%	0.268	C	S	.	.	H	α-helix	trans	-68.6	-39.4	179.4	0	0	0	0	0	112.4	L914 K1071 T1072 C1073 A1078 K1079	L914-A1075 HydrophobicContact CD1-CB 3.59Å; L914-A1075 HydrophobicContact CD2-CB 4.16Å; K1071-A1075 WeakPolarHBondContact O-CB 3.18Å; K1071-A1075 PolarHBondContact O-N 2.98Å; T1072-A1075 PolarHBondContact O-N 3.01Å; C1073-A1075 VanDerWaalsContact C-N 3.31Å; C1073-A1075 PolarHBondContact O-N 3.17Å; A1075-A1078 PolarHBondContact O-N 3.28Å; A1075-K1079 WeakPolarHBondContact O-CB 3.17Å; A1075-K1079 WeakPolarHBondContact O-CG 3.38Å; A1075-K1079 PolarHBondContact O-N 3.45Å
1076	L	94.4	Very high	88.4	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-61.8	-48.4	172.9	-72.5	175.3	0	0	0	110.8	L914 A917 V918 I921 L947 M1041 L1065 T1072 C1073 A1078 K1079 V1080	L914-L1076 HydrophobicContact CD2-CD2 3.81Å; L914-L1076 HydrophobicContact CD2-CG 3.95Å; A917-L1076 HydrophobicContact CB-CD2 4.25Å; V918-L1076 HydrophobicContact CG2-CD2 3.68Å; I921-L1076 HydrophobicContact CD1-CD1 4.47Å; I921-L1076 HydrophobicContact CD1-CD2 4.07Å; L947-L1076 HydrophobicContact CD2-CB 4.31Å; M1041-L1076 HydrophobicContact CE-CD1 4.2Å; M1041-L1076 HydrophobicContact SD-CD1 4.04Å; L1065-L1076 HydrophobicContact CD2-CD1 4.41Å; T1072-L1076 WeakPolarHBondContact O-CG 3.4Å; T1072-L1076 PolarHBondContact O-N 3.49Å; C1073-L1076 PolarHBondContact O-N 3.17Å; L1076-A1078 PolarHBondContact O-N 2.75Å; L1076-K1079 PolarHBondContact O-N 2.89Å; L1076-V1080 WeakPolarHBondContact O-CB 3.1Å; L1076-V1080 VanDerWaalsContact O-CG2 3.26Å; L1076-V1080 WeakPolarHBondContact O-CG2 3.33Å; L1076-V1080 PolarHBondContact O-N 2.98Å
1077	Q	94.1	Very high	88	Confident	33 Å²	33	60.2 Å²	60.2	15%	0.154	32%	0.316	C	S	.	.	H	α-helix	trans	-56	-48.6	176.5	-176.5	-164.9	13.4	0	0	111.4	P943 D946 M950 C1073 D1074 R1081	P943-Q1077 HydrophobicContact CB-CB 4.44Å; D946-Q1077 VanDerWaalsContact CB-NE2 3.32Å; D946-Q1077 PolarHBondContact OD2-NE2 2.85Å; M950-Q1077 HydrophobicContact CE-CB 4.49Å; M950-Q1077 HydrophobicContact CE-CG 3.58Å; C1073-Q1077 WeakPolarHBondContact O-CB 3.24Å; C1073-Q1077 PolarHBondContact O-N 3.16Å; D1074-Q1077 PolarHBondContact O-N 2.89Å; Q1077-R1081 WeakPolarHBondContact O-CB 3.38Å; Q1077-R1081 PolarHBondContact O-N 3.39Å
1078	A	94.1	Very high	87.8	Confident	44 Å²	44	62.1 Å²	62.1	36%	0.364	32%	0.321	S	S	.	.	H	α-helix	trans	-61.8	-49.4	179.8	0	0	0	0	0	112.1	D1074 A1075 L1076 V1080 R1081 E1082	D1074-A1078 WeakPolarHBondContact O-CB 3.49Å; D1074-A1078 PolarHBondContact O-N 3.26Å; A1075-A1078 PolarHBondContact O-N 3.28Å; L1076-A1078 PolarHBondContact O-N 2.75Å; A1078-V1080 PolarHBondContact O-N 3.34Å; A1078-R1081 WeakPolarHBondContact O-CB 3.15Å; A1078-R1081 PolarHBondContact O-N 3.01Å; A1078-E1082 WeakPolarHBondContact O-CG 3.37Å; A1078-E1082 PolarHBondContact O-N 2.69Å
1079	K	92.9	Very high	87.5	Confident	55 Å²	55	61.9 Å²	61.9	24%	0.239	32%	0.319	C	S	.	.	H	α-helix	trans	-66.2	-38	-179	-75.7	-168.1	172.7	-166.8	0	113.2	D915 V918 A1075 L1076 S1083	D915-K1079 IonicContact OD1-NZ 3.53Å; D915-K1079 PolarHBondContact OD1-NZ 3.26Å; D915-K1079 IonicContact OD2-NZ 3.58Å; D915-K1079 PolarHBondContact OD2-NZ 2.95Å; V918-K1079 HydrophobicContact CG1-CB 4.43Å; V918-K1079 HydrophobicContact CG2-CB 3.82Å; V918-K1079 HydrophobicContact CG2-CD 4.09Å; A1075-K1079 WeakPolarHBondContact O-CB 3.17Å; A1075-K1079 WeakPolarHBondContact O-CG 3.38Å; A1075-K1079 PolarHBondContact O-N 3.45Å; L1076-K1079 PolarHBondContact O-N 2.89Å; K1079-S1083 VanDerWaalsContact O-CB 3.23Å; K1079-S1083 WeakPolarHBondContact O-CB 3.31Å; K1079-S1083 PolarHBondContact O-N 3.48Å; K1079-S1083 PolarHBondContact O-OG 2.72Å
1080	V	88.6	Confident	87.2	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.006	33%	0.332	C	S	.	.	H	α-helix	trans	-64.6	-44.2	174.8	169.2	0	0	0	0	109.7	V918 L947 L951 L1076 A1078 S1083 Y1084	V918-V1080 HydrophobicContact CG1-CG2 4.34Å; L947-V1080 HydrophobicContact CD1-CB 3.84Å; L947-V1080 HydrophobicContact CD1-CG1 3.8Å; L947-V1080 HydrophobicContact CD1-CG2 3.78Å; L951-V1080 HydrophobicContact CD2-CG1 4.16Å; L1076-V1080 WeakPolarHBondContact O-CB 3.1Å; L1076-V1080 VanDerWaalsContact O-CG2 3.26Å; L1076-V1080 WeakPolarHBondContact O-CG2 3.33Å; L1076-V1080 PolarHBondContact O-N 2.98Å; A1078-V1080 PolarHBondContact O-N 3.34Å; V1080-S1083 PolarHBondContact O-N 3.29Å; V1080-Y1084 HydrophobicContact CG1-CD2 3.72Å; V1080-Y1084 HydrophobicContact CG1-CE2 3.92Å; V1080-Y1084 VanDerWaalsContact O-CD2 3.22Å; V1080-Y1084 WeakPolarHBondContact O-CD2 3.32Å; V1080-Y1084 PolarHBondContact O-N 3.48Å
1081	R	89.5	Confident	86.9	Confident	104 Å²	104	64.9 Å²	64.9	39%	0.392	34%	0.335	S	S	.	.	H	α-helix	trans	-58.8	-51.1	175.6	-173.2	179.6	-65.4	-179.9	-1.4	112.2	D946 M950 Q1077 A1078 S1083 Y1084 Q1085	D946-R1081 IonicContact OD2-CZ 3.79Å; D946-R1081 IonicContact OD2-NH2 2.78Å; D946-R1081 PolarHBondContact OD2-NH2 3.04Å; M950-R1081 HydrophobicContact SD-CB 3.91Å; M950-R1081 HydrophobicContact SD-CG 4.22Å; Q1077-R1081 WeakPolarHBondContact O-CB 3.38Å; Q1077-R1081 PolarHBondContact O-N 3.39Å; A1078-R1081 WeakPolarHBondContact O-CB 3.15Å; A1078-R1081 PolarHBondContact O-N 3.01Å; R1081-S1083 PolarHBondContact O-N 3.15Å; R1081-Y1084 PolarHBondContact O-N 3.38Å; R1081-Q1085 HydrophobicContact CG-CG 4.39Å; R1081-Q1085 VanDerWaalsContact CG-OE1 3.32Å; R1081-Q1085 WeakPolarHBondContact O-CB 3.43Å; R1081-Q1085 PolarHBondContact O-N 3.14Å
1082	E	89	Confident	86.3	Confident	134 Å²	134	58.7 Å²	58.7	63%	0.626	31%	0.312	S	S	*	.	H	α-helix	trans	-58.5	-37.8	178.4	-73.4	173	-176.8	0	0	112.1	A1078 Y1084 S1086	A1078-E1082 WeakPolarHBondContact O-CG 3.37Å; A1078-E1082 PolarHBondContact O-N 2.69Å; E1082-Y1084 PolarHBondContact O-N 3.03Å; E1082-S1086 WeakPolarHBondContact O-CB 3.39Å; E1082-S1086 PolarHBondContact O-N 3.49Å; E1082-S1086 PolarHBondContact O-OG 3.26Å
1083	S	80.8	Confident	85.7	Confident	39 Å²	39	62.1 Å²	62.1	27%	0.273	33%	0.33	S	S	.	.	H	α-helix	trans	-74.9	-21.8	-176	-67.4	0	0	0	0	115.7	K922 K1079 V1080 R1081	K922-S1083 VanDerWaalsContact CE-OG 3.27Å; K922-S1083 WeakPolarHBondContact CE-OG 3.41Å; K922-S1083 PolarHBondContact NZ-OG 3.32Å; K1079-S1083 VanDerWaalsContact O-CB 3.23Å; K1079-S1083 WeakPolarHBondContact O-CB 3.31Å; K1079-S1083 PolarHBondContact O-N 3.48Å; K1079-S1083 PolarHBondContact O-OG 2.72Å; V1080-S1083 PolarHBondContact O-N 3.29Å; R1081-S1083 PolarHBondContact O-N 3.15Å
1084	Y	79.5	Confident	84.9	Confident	79 Å²	79	66.9 Å²	66.9	31%	0.31	36%	0.355	S	S	.	.	H	α-helix	trans	-118.4	-11.2	-172.9	-72	-68.2	0	0	0	113.5	K922 Q954 K956 V1080 R1081 E1082	K922-Y1084 HydrophobicContact CG-CE2 4.12Å; K922-Y1084 WeakPolarHBondContact CG-OH 3.33Å; Q954-Y1084 PolarHBondContact OE1-OH 2.85Å; K956-Y1084 WeakPolarHBondContact CE-OH 3.45Å; V1080-Y1084 HydrophobicContact CG1-CD2 3.72Å; V1080-Y1084 HydrophobicContact CG1-CE2 3.92Å; V1080-Y1084 VanDerWaalsContact O-CD2 3.22Å; V1080-Y1084 WeakPolarHBondContact O-CD2 3.32Å; V1080-Y1084 PolarHBondContact O-N 3.48Å; R1081-Y1084 PolarHBondContact O-N 3.38Å; E1082-Y1084 PolarHBondContact O-N 3.03Å
1085	Q	66.7	Low	84.1	Confident	154 Å²	154	68 Å²	68	72%	0.72	36%	0.36	S	S	*	.	H	α-helix	trans	-101.4	-0.5	170.1	-65.2	-172.2	-23.1	0	0	113	R1081	R1081-Q1085 HydrophobicContact CG-CG 4.39Å; R1081-Q1085 VanDerWaalsContact CG-OE1 3.32Å; R1081-Q1085 WeakPolarHBondContact O-CB 3.43Å; R1081-Q1085 PolarHBondContact O-N 3.14Å
1086	S	44.3	Very low	83.1	Confident	144 Å²	144	71.7 Å²	71.7	100%	1.007	37%	0.373	S	S	*	.			trans	-89.7	0	161.4	45.5	0	0	0	0	110.2	E1082	E1082-S1086 WeakPolarHBondContact O-CB 3.39Å; E1082-S1086 PolarHBondContact O-N 3.49Å; E1082-S1086 PolarHBondContact O-OG 3.26Å

Retrieved 1,086 of 1,086 residues in 1271.9 ms (Link to these results)

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