A0A078BPM1_CAEEL Loading...

Fibronectin type-III domain-containing protein

AlphaFold DB , UniProt , Accession A0A078BPM1, Species CAEEL (Caenorhabditis elegans), Gene jac-1, Length 1,086 aa.

						>A0A078BPM1_CAEEL|A0A078BPM1|jac-1
MMARMGGASDHDSEDRSAPPPAPASRFLHEDSGIPSAPGVPDVVDAGIGEVTVVWSAPLQSNGGEVRGYQIEMREFPDGEWESMGVDHLLKDTTCRVTNLTSHEVQFRVSAYGRTGFGPASNPSLPVKIPISETDLATSAGAPLAPGRPTVIAVDGQGVLLEWTPPVADVHSSPPQGYQVEYRVYGSRDWIVANEQLVQENVFTVESLRPNGVYEFRVRGKNQDGLGHPSMSSGGVAIRPAAPQRHVPARKVSESVQPPGQPQMVEVGDDVVKLEWAPSVQNARYIVEYREVGDPEWHTANYDPIVQNGIQVEGLHRNSTYEFCVISIVDNIASQPSETSDIIHLRPTCNTSALRPAPNILEAPEFLEVDGDKITICWLPAQSQLPVMGYDVEFRDLQQDDRWYKVNDQPVFACKMTVGDLIMDHDYQFRVLAHNASGCSQPSPPSDFVHIEPSTNRFSSDTMESPHLGHHDVVKYVEAERFGAVPLLQEEMVRESPPLPERDDSPPPLRRANNNVQWRDPSLKEVIEYLSSADKDKQLNASGYLQHLTYTDNQIKEETREYGGIPKLIALLRSDTPRIQKNACACLKNLSFGKENDANKLAVMEADGVRLIAEVLRTTHDASVKEEAAAALWNLSSADMLKPVILESATEILSQQVIAPVLAVGTSDPTRHFGSTLFKNSTGVLRNVSAASQQARRRLRDIPNLIEALVHFLTHAIQKSQVDSPTVENAVCLLRNLSYRIQEVVDPNYDPAAAHSSSSKNMKHVASPKPEKKKKDKEKKKDKNPKNIVTGPSVLWQPHVVKLYLKLLQDSSNIETLEASAGAIQNLAACQFPPSAEVRAAVRVEKGLPVLVELIRLPEDFVVCAVATALRNLAIDPRNRELIVSGKYALRDFLDKLPEPGSPRRSAISDQTIGAVLGILFEIVRSSAAYTKDVHELKGTDKLRALSRSYPTYSHRVCKYASQVLYVMWQHKELHDGFKRSGLKEADFYSGTARRGDSSTLARPISSQGRERPSMHQLDETLSSGGGYGTMESNNRAGTLRPASATSQTIQRRYDQVPRDGPVYSSVQKPSPRGGGGGGNIDDSWV
					

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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	35.7	Very low	39	Very low	252 Å²	252	145.7 Å²	145.7	100%	1.241	86%	0.859	S	S	*	*				0	155.5	0	-99.1	174	162.1	0	0	108.9
2	M	45.4	Very low	38.7	Very low	196 Å²	196	145 Å²	145	97%	0.966	85%	0.849	S	S	*	*			trans	-93.8	163.9	-178	-70.2	-179.3	168.8	0	0	113.6
3	A	39.5	Very low	38.4	Very low	103 Å²	103	141.6 Å²	141.6	85%	0.851	84%	0.838	S	S	*	*			trans	-150	168.7	152.5	0	0	0	0	0	109.7
4	R	44.8	Very low	38.1	Very low	219 Å²	219	145 Å²	145	83%	0.826	84%	0.841	S	S	*	*			trans	-157.7	150	-160.1	-141.5	-171.4	-177.2	-169.5	1.6	115.7
5	M	44.7	Very low	37.9	Very low	165 Å²	165	144.2 Å²	144.2	81%	0.813	83%	0.832	S	S	*	*			trans	67.8	158.4	163.2	-56.3	-175.2	169.2	0	0	119
6	G	39.1	Very low	37.9	Very low	82 Å²	82	148.5 Å²	148.5	85%	0.845	83%	0.831	S	S	*	*			cis	163.1	158.7	-9.2	0	0	0	0	0	114.1
7	G	32.1	Very low	37.5	Very low	86 Å²	86	147.4 Å²	147.4	89%	0.887	84%	0.835	S	S	*	*			trans	158.2	159	171.9	0	0	0	0	0	118.7
8	A	36	Very low	37.6	Very low	106 Å²	106	144.5 Å²	144.5	88%	0.876	83%	0.832	S	S	*	*			trans	-165.4	-174.7	-179.3	0	0	0	0	0	111.9
9	S	37.3	Very low	37.6	Very low	95 Å²	95	143.3 Å²	143.3	66%	0.664	83%	0.83	S	S	*	*			cis	-169.5	177.4	-1.4	50.2	0	0	0	0	114.1
10	D	36.4	Very low	37.7	Very low	137 Å²	137	142.3 Å²	142.3	73%	0.733	83%	0.828	S	S	*	*			trans	84.9	139.2	145.7	-53.4	-37.4	0	0	0	129.6
11	H	38	Very low	39	Very low	162 Å²	162	141.7 Å²	141.7	75%	0.75	83%	0.829	S	S	*	*			trans	80.3	124.3	141.2	-80.2	-51.4	0	0	0	129.3
12	D	35.6	Very low	38.6	Very low	137 Å²	137	134.3 Å²	134.3	73%	0.733	81%	0.809	S	S	*	*				50.9	154.6	125.8	-67.1	33.9	0	0	0	125.2
13	S	34.3	Very low	38.3	Very low	101 Å²	101	131 Å²	131	71%	0.706	80%	0.801	S	S	*	*			cis	-170.3	174	-14.6	57.9	0	0	0	0	114.9
14	E	34.9	Very low	38.1	Very low	189 Å²	189	130.9 Å²	130.9	88%	0.883	80%	0.801	S	S	*	*			trans	81.5	131.5	154.9	-77.7	-161.6	158	0	0	129.3
15	D	35.4	Very low	37.3	Very low	133 Å²	133	126.1 Å²	126.1	71%	0.711	80%	0.801	S	S	*	*			trans	71.5	174.2	145.5	-138.8	49.6	0	0	0	126.7
16	R	37.8	Very low	36.6	Very low	213 Å²	213	129.8 Å²	129.8	80%	0.804	81%	0.806	S	S	*	*			trans	-107	155	-140.5	-63.4	147.1	-179.2	-174.5	-1.1	117.3
17	S	30.3	Very low	36.5	Very low	129 Å²	129	135.7 Å²	135.7	90%	0.902	81%	0.808	S	S	*	*			trans	-178.8	170.3	130.2	47.9	0	0	0	0	112.1
18	A	39.8	Very low	36.8	Very low	96 Å²	96	139.5 Å²	139.5	79%	0.793	81%	0.808	S	S	*	*			trans	-146.3	142.5	-176.6	0	0	0	0	0	114.5
19	P	36.7	Very low	36.9	Very low	122 Å²	122	143.5 Å²	143.5	79%	0.792	81%	0.808	S	S	*	*			trans	-138.4	169.3	145.7	35.1	-18.9	0	0	0	114.2
20	P	39.8	Very low	37.2	Very low	122 Å²	122	147.7 Å²	147.7	79%	0.792	82%	0.817	S	S	*	*			trans	-108	-161	-169.1	46.4	-38.1	0	0	0	113.1
21	P	65.6	Low	37.7	Very low	130 Å²	130	146 Å²	146	84%	0.844	81%	0.808	S	S	*	*				-122.8	156.5	-100.7	33.6	-14.2	0	0	0	116.1
22	A	27.6	Very low	38.5	Very low	98 Å²	98	142 Å²	142	81%	0.81	80%	0.798	S	S	*	*			trans	-147.3	162.2	172.6	0	0	0	0	0	111.4
23	P	38.5	Very low	39.7	Very low	125 Å²	125	135.5 Å²	135.5	81%	0.812	76%	0.763	S	S	*	*			trans	-110	149.4	-145.9	38.8	-34.8	0	0	0	118.6
24	A	34.7	Very low	41.4	Very low	102 Å²	102	133.9 Å²	133.9	84%	0.843	75%	0.746	S	S	*	*			trans	56.5	105.1	141.7	0	0	0	0	0	121.2
25	S	28.6	Very low	43.5	Very low	118 Å²	118	125.3 Å²	125.3	83%	0.825	71%	0.707	S	S	*	*			trans	-142.3	102.8	150.2	61	0	0	0	0	112.7
26	R	30.2	Very low	45.6	Very low	243 Å²	243	120.9 Å²	120.9	92%	0.917	69%	0.687	S	S	*	*			trans	22.9	120.8	159.6	-71.5	-178.5	166.7	117.3	-2	120.4
27	F	36.9	Very low	47.7	Very low	205 Å²	205	112.5 Å²	112.5	90%	0.899	66%	0.663	S	S	*	*			trans	-21	129.1	151.6	-58.1	-95.2	0	0	0	116.8
28	L	38	Very low	50.4	Low	166 Å²	166	106.8 Å²	106.8	87%	0.869	62%	0.623	S	S	*	*				-163.7	109.7	106.9	-98.7	170.3	0	0	0	108.8
29	H	38.1	Very low	52.5	Low	191 Å²	191	103.5 Å²	103.5	88%	0.884	60%	0.598	S	S	*	*			trans	-144.2	145.5	165.6	-104.6	-73.5	0	0	0	108
30	E	44.3	Very low	54.9	Low	183 Å²	183	100.4 Å²	100.4	86%	0.855	58%	0.576	S	S	*	*			trans	-79.8	140.2	-164.7	-67.2	161.5	120.8	0	0	112.8	S32	E30-S32 PolarHBondContact O-N 3.46Å
31	D	46.2	Very low	57.3	Low	101 Å²	101	94.6 Å²	94.6	54%	0.54	54%	0.539	S	S	.	.			trans	-73.5	84.3	178.6	-176.4	31.9	0	0	0	110	G33 R114	D31-G33 PolarHBondContact O-N 2.88Å; D31-G33 VanDerWaalsContact O-N 3.16Å; D31-R114 IonicContact OD2-NH1 3.51Å
32	S	56.3	Low	58.1	Low	77 Å²	77	93.9 Å²	93.9	54%	0.538	53%	0.528	S	S	.	.			trans	-67.1	-16.5	-166.5	65.7	0	0	0	0	114.8	E30 I34 T115	E30-S32 PolarHBondContact O-N 3.46Å; S32-I34 PolarHBondContact O-N 3Å; S32-T115 WeakPolarHBondContact O-CB 3.44Å; S32-T115 WeakPolarHBondContact O-CG2 3.47Å; S32-T115 PolarHBondContact O-OG1 2.81Å
33	G	59.1	Low	60.7	Low	1 Å²	1	91.8 Å²	91.8	1%	0.01	51%	0.505	C	S	.	.			trans	70.5	7.1	168.6	0	0	0	0	0	116.8	D31 R114 T115	D31-G33 PolarHBondContact O-N 2.88Å; D31-G33 VanDerWaalsContact O-N 3.16Å; G33-R114 PolarHBondContact O-N 3.18Å; G33-T115 PolarHBondContact O-OG1 2.89Å
34	I	70.1	Confident	62.7	Low	67 Å²	67	90.2 Å²	90.2	34%	0.344	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-94.7	135.9	178.3	-58	-178.3	0	0	0	109.6	S32 T115 F117	S32-I34 PolarHBondContact O-N 3Å; I34-T115 WeakPolarHBondContact CG1-OG1 3.49Å; I34-T115 PolarHBondContact N-OG1 3.04Å; I34-F117 WeakPolarHBondContact CG2-O 3.35Å
35	P	79.5	Confident	64.4	Low	9 Å²	9	90.2 Å²	90.2	6%	0.058	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-74.6	163	178.9	-12.3	30.4	0	0	0	112.8	P58 V66 A111 G118	P35-P58 HydrophobicContact CB-CG 4.1Å; P35-V66 HydrophobicContact CB-CG2 4.06Å; P35-V66 HydrophobicContact CG-CG2 4.07Å; P35-A111 HydrophobicContact CB-CB 3.96Å; P35-A111 HydrophobicContact CG-CB 4.08Å; P35-G118 WeakPolarHBondContact O-CA 3.36Å
36	S	79.4	Confident	66.5	Low	41 Å²	41	86.5 Å²	86.5	29%	0.287	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-69.7	172.7	163.7	75.9	0	0	0	0	111.5	P58	S36-P58 WeakPolarHBondContact O-CB 3.27Å; S36-P58 WeakPolarHBondContact OG-CB 3.5Å
37	A	82.3	Confident	68.3	Low	36 Å²	36	76 Å²	76	30%	0.298	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-59.9	143.4	172.3	0	0	0	0	0	112	P119	A37-P119 VanDerWaalsContact CA-O 3.27Å; A37-P119 WeakPolarHBondContact CA-O 3.15Å; A37-P119 HydrophobicContact CB-CG 4.18Å; A37-P119 WeakPolarHBondContact CB-O 3.32Å
38	P	87.3	Confident	69.6	Low	10 Å²	10	71.8 Å²	71.8	7%	0.065	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-60.8	167.7	163.8	-22.9	35	0	0	0	113.1	Y69 V109 A111	P38-Y69 HydrophobicContact CG-CD1 4.13Å; P38-Y69 HydrophobicContact CG-CE1 4.26Å; P38-V109 WeakPolarHBondContact CD-O 3.44Å; P38-V109 HydrophobicContact CG-CB 4.38Å; P38-V109 HydrophobicContact CG-CG1 4.17Å; P38-V109 WeakPolarHBondContact CG-O 3.39Å; P38-A111 HydrophobicContact CG-CB 3.96Å
39	G	82.8	Confident	71	Confident	26 Å²	26	64.8 Å²	64.8	27%	0.268	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-62.3	161.4	162.2	0	0	0	0	0	111.9	S56 S121	G39-S56 PolarHBondContact N-O 2.81Å; G39-S121 WeakPolarHBondContact O-CB 3.38Å
40	V	88.4	Confident	72.8	Confident	57 Å²	57	58.1 Å²	58.1	35%	0.345	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-59.7	137.2	174.2	-174.2	0	0	0	0	109.5	D42 N122	V40-D42 PolarHBondContact O-N 3.17Å; V40-N122 HydrophobicContact CG2-CB 4.01Å
41	P	88.7	Confident	74.4	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.006	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-72.9	116.2	172.6	27.4	-32.7	0	0	0	110.7	V53 V54 W55 F107 V109 S121 S124	P41-V53 HydrophobicContact CB-CB 4.25Å; P41-V53 HydrophobicContact CB-CG2 4.47Å; P41-V54 WeakPolarHBondContact CA-O 3.47Å; P41-W55 HydrophobicContact CB-CB 4.46Å; P41-F107 HydrophobicContact CG-CB 4.08Å; P41-F107 WeakPolarHBondContact CG-O 3.43Å; P41-V109 HydrophobicContact CB-CG2 4.05Å; P41-V109 HydrophobicContact CG-CG2 4.13Å; P41-S121 WeakPolarHBondContact CD-OG 3.34Å; P41-S124 VanDerWaalsContact O-CB 3.28Å; P41-S124 WeakPolarHBondContact O-CB 3.28Å
42	D	84.1	Confident	76.2	Confident	114 Å²	114	45.7 Å²	45.7	61%	0.61	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	139.8	171.2	-72.9	-43.3	0	0	0	110	V40 V53 V54	V40-D42 PolarHBondContact O-N 3.17Å; D42-V53 CarbonylContact O-C 3.55Å; D42-V53 VanDerWaalsContact O-CA 3.29Å; D42-V53 WeakPolarHBondContact O-CA 3.37Å; D42-V54 PolarHBondContact N-O 2.9Å; D42-V54 PolarHBondContact O-N 2.98Å
43	V	81.7	Confident	77.5	Confident	55 Å²	55	42 Å²	42	33%	0.333	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	125.6	174.3	177.4	0	0	0	0	109.4	D45 A46 V51 V53 V127	V43-D45 WeakPolarHBondContact CG1-O 3.44Å; V43-A46 HydrophobicContact CG1-CB 4.36Å; V43-V51 HydrophobicContact CG1-CG1 3.77Å; V43-V51 HydrophobicContact CG2-CG1 4Å; V43-V53 HydrophobicContact CG2-CG1 3.97Å; V43-V127 HydrophobicContact CG1-CG1 4.27Å; V43-V127 HydrophobicContact CG2-CB 4.3Å; V43-V127 HydrophobicContact CG2-CG1 3.83Å; V43-V127 HydrophobicContact CG2-CG2 3.45Å; V43-V127 VanDerWaalsContact CG2-CG2 3.45Å
44	V	79.9	Confident	78.8	Confident	92 Å²	92	44.4 Å²	44.4	56%	0.558	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	-21	178	-60.2	0	0	0	0	113.5	T52 V54	V44-T52 HydrophobicContact CG2-CG2 3.77Å; V44-T52 WeakPolarHBondContact CG2-O 3.39Å; V44-T52 PolarHBondContact N-O 2.96Å; V44-V54 HydrophobicContact CB-CG2 4.33Å; V44-V54 HydrophobicContact CG1-CB 4.01Å; V44-V54 HydrophobicContact CG1-CG2 3.61Å; V44-V54 HydrophobicContact CG2-CG2 3.71Å
45	D	69.8	Low	79.8	Confident	102 Å²	102	41.5 Å²	41.5	55%	0.545	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	148.5	175.6	-169.4	17.4	0	0	0	110.8	V43 T52	V43-D45 WeakPolarHBondContact CG1-O 3.44Å; D45-T52 PolarHBondContact N-O 3.17Å; D45-T52 PolarHBondContact O-N 2.84Å
46	A	74.3	Confident	80	Confident	39 Å²	39	45 Å²	45	32%	0.322	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	104.5	-178.1	0	0	0	0	0	111	V43 V51	V43-A46 HydrophobicContact CG1-CB 4.36Å; A46-V51 HydrophobicContact CB-CG2 4.13Å
47	G	66.4	Low	80	Confident	24 Å²	24	45.6 Å²	45.6	25%	0.247	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-177.7	176.5	0	0	0	0	0	112.9	G49 E50	G47-G49 PolarHBondContact O-N 2.85Å; G47-G49 VanDerWaalsContact O-N 3.12Å; G47-E50 CarbonylContact C-O 3.51Å; G47-E50 PolarHBondContact N-O 3.42Å; G47-E50 PolarHBondContact O-N 3.31Å; G47-E50 VanDerWaalsContact O-O 3.07Å
48	I	65.5	Low	79.9	Confident	116 Å²	116	44.8 Å²	44.8	60%	0.595	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	112.3	178.3	-60.1	172.8	0	0	0	109.1	E50 P130	I48-E50 VanDerWaalsContact C-N 3.25Å; I48-E50 PolarHBondContact O-N 2.91Å; I48-P130 WeakPolarHBondContact CA-O 3.35Å; I48-P130 HydrophobicContact CG1-CB 4.16Å
49	G	66	Low	78.8	Confident	18 Å²	18	52.5 Å²	52.5	19%	0.186	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.9	12.1	-179.3	0	0	0	0	0	115.5	G47 T98 N99 L100	G47-G49 PolarHBondContact O-N 2.85Å; G47-G49 VanDerWaalsContact O-N 3.12Å; G49-T98 CarbonylContact O-C 3.56Å; G49-N99 PolarHBondContact O-N 3.01Å; G49-L100 PolarHBondContact O-N 3.16Å
50	E	76.6	Confident	77.6	Confident	51 Å²	51	57.3 Å²	57.3	24%	0.238	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	144.1	174.4	62.8	177.8	-171	0	0	114.3	G47 I48 R96 V97 T98	G47-E50 CarbonylContact C-O 3.51Å; G47-E50 PolarHBondContact N-O 3.42Å; G47-E50 PolarHBondContact O-N 3.31Å; G47-E50 VanDerWaalsContact O-O 3.07Å; I48-E50 VanDerWaalsContact C-N 3.25Å; I48-E50 PolarHBondContact O-N 2.91Å; E50-R96 VanDerWaalsContact CD-NE 3.33Å; E50-R96 IonicContact OE1-CZ 3.35Å; E50-R96 IonicContact OE1-NE 3.45Å; E50-R96 PolarHBondContact OE1-NE 2.81Å; E50-R96 IonicContact OE1-NH2 2.68Å; E50-R96 PolarHBondContact OE1-NH2 3.44Å; E50-R96 IonicContact OE2-CZ 3.16Å; E50-R96 IonicContact OE2-NE 2.76Å; E50-R96 PolarHBondContact OE2-NE 3.3Å; E50-R96 IonicContact OE2-NH2 2.92Å; E50-R96 PolarHBondContact OE2-NH2 2.64Å; E50-V97 CarbonylContact C-O 3.31Å; E50-V97 WeakPolarHBondContact CA-O 3.2Å; E50-V97 WeakPolarHBondContact CB-O 3.45Å; E50-T98 HydrophobicContact CB-CG2 3.88Å; E50-T98 VanDerWaalsContact OE2-CG2 3.29Å; E50-T98 WeakPolarHBondContact OE2-CG2 3.37Å
51	V	79.1	Confident	76.1	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	133.6	-179.1	172.8	0	0	0	0	109.2	V43 A46 V53 V97 L100 F107 V127 I129	V43-V51 HydrophobicContact CG1-CG1 3.77Å; V43-V51 HydrophobicContact CG2-CG1 4Å; A46-V51 HydrophobicContact CB-CG2 4.13Å; V51-V53 HydrophobicContact CG1-CG1 3.97Å; V51-V97 PolarHBondContact N-O 2.93Å; V51-V97 PolarHBondContact O-N 3.41Å; V51-L100 HydrophobicContact CB-CD1 3.79Å; V51-L100 HydrophobicContact CG2-CD1 3.54Å; V51-F107 HydrophobicContact CB-CE2 4.31Å; V51-F107 HydrophobicContact CB-CZ 4.22Å; V51-F107 HydrophobicContact CG1-CE2 3.89Å; V51-F107 HydrophobicContact CG1-CZ 4.26Å; V51-V127 HydrophobicContact CG1-CG1 4.16Å; V51-V127 HydrophobicContact CG2-CG1 4.07Å; V51-I129 HydrophobicContact CG2-CG1 4.01Å
52	T	82.1	Confident	74.3	Confident	24 Å²	24	63.2 Å²	63.2	15%	0.147	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	123.7	173.8	-53	0	0	0	0	110	V44 D45 C95 R96	V44-T52 HydrophobicContact CG2-CG2 3.77Å; V44-T52 WeakPolarHBondContact CG2-O 3.39Å; V44-T52 PolarHBondContact N-O 2.96Å; D45-T52 PolarHBondContact N-O 3.17Å; D45-T52 PolarHBondContact O-N 2.84Å; T52-C95 WeakPolarHBondContact CA-O 3.45Å; T52-R96 HydrophobicContact CG2-CB 4.3Å
53	V	85.3	Confident	72.9	Confident	0 Å²	0	60 Å²	60	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	147.4	179	-60.6	0	0	0	0	111.8	P41 D42 V43 V51 W55 I71 T94 C95 F107	P41-V53 HydrophobicContact CB-CB 4.25Å; P41-V53 HydrophobicContact CB-CG2 4.47Å; D42-V53 CarbonylContact O-C 3.55Å; D42-V53 VanDerWaalsContact O-CA 3.29Å; D42-V53 WeakPolarHBondContact O-CA 3.37Å; V43-V53 HydrophobicContact CG2-CG1 3.97Å; V51-V53 HydrophobicContact CG1-CG1 3.97Å; V53-W55 HydrophobicContact CG2-CE3 4.43Å; V53-W55 HydrophobicContact CG2-CZ3 4.21Å; V53-I71 HydrophobicContact CG2-CD1 3.48Å; V53-I71 VanDerWaalsContact CG2-CD1 3.48Å; V53-T94 WeakPolarHBondContact O-CA 3.36Å; V53-C95 HydrophobicContact CG2-CB 4.47Å; V53-C95 PolarHBondContact N-O 2.59Å; V53-C95 PolarHBondContact O-N 3.47Å; V53-F107 HydrophobicContact CG1-CD2 3.84Å; V53-F107 HydrophobicContact CG1-CE2 4.18Å; V53-F107 HydrophobicContact CG1-CG 4.18Å
54	V	86.1	Confident	71.8	Confident	50 Å²	50	57.9 Å²	57.9	30%	0.303	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	138.8	179.3	-179.6	0	0	0	0	108.7	P41 D42 V44 T93	P41-V54 WeakPolarHBondContact CA-O 3.47Å; D42-V54 PolarHBondContact N-O 2.9Å; D42-V54 PolarHBondContact O-N 2.98Å; V44-V54 HydrophobicContact CB-CG2 4.33Å; V44-V54 HydrophobicContact CG1-CB 4.01Å; V44-V54 HydrophobicContact CG1-CG2 3.61Å; V44-V54 HydrophobicContact CG2-CG2 3.71Å; V54-T93 WeakPolarHBondContact CA-O 3Å
55	W	90.1	Very high	71	Confident	7 Å²	7	60.9 Å²	60.9	3%	0.027	37%	0.365	C	S	.	.			trans	-129.2	168.8	177.3	58.4	94.2	0	0	0	111.3	P41 V53 Y69 L90 D92 T93 C95 V109	P41-W55 HydrophobicContact CB-CB 4.46Å; V53-W55 HydrophobicContact CG2-CE3 4.43Å; V53-W55 HydrophobicContact CG2-CZ3 4.21Å; W55-Y69 AromaticContact CE2-CG 3.96Å; W55-Y69 HydrophobicContact CZ2-CD2 4.01Å; W55-Y69 AromaticContact CZ2-CG 3.87Å; W55-Y69 HydrophobicContact CZ2-CG 3.87Å; W55-Y69 AromaticContact NE1-CD1 3.36Å; W55-Y69 AromaticContact NE1-CD2 3.76Å; W55-Y69 AromaticContact NE1-CE1 3.6Å; W55-Y69 AromaticContact NE1-CE2 4Å; W55-Y69 AromaticContact NE1-CG 3.46Å; W55-Y69 AromaticContact NE1-CZ 3.93Å; W55-L90 HydrophobicContact CH2-CD1 4.04Å; W55-D92 VanDerWaalsContact CZ2-O 3.28Å; W55-D92 WeakPolarHBondContact CZ2-O 3.45Å; W55-T93 PolarHBondContact N-O 3Å; W55-T93 WeakPolarHBondContact O-CB 3.42Å; W55-C95 HydrophobicContact CH2-CB 3.84Å; W55-C95 HydrophobicContact CZ3-CB 3.74Å; W55-V109 HydrophobicContact CD2-CB 4.35Å; W55-V109 HydrophobicContact CD2-CG1 3.97Å; W55-V109 HydrophobicContact CD2-CG2 3.87Å; W55-V109 HydrophobicContact CE3-CG2 3.82Å; W55-V109 HydrophobicContact CG-CB 4.43Å; W55-V109 HydrophobicContact CG-CG1 4.25Å; W55-V109 HydrophobicContact CG-CG2 4.23Å; W55-V109 HydrophobicContact CZ2-CG1 4.04Å; W55-V109 HydrophobicContact CZ3-CG2 4.29Å
56	S	83.4	Confident	71.3	Confident	83 Å²	83	58 Å²	58	58%	0.58	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-95.2	143.3	171.3	-68.2	0	0	0	0	111.3	G39	G39-S56 PolarHBondContact N-O 2.81Å
57	A	81.1	Confident	71.5	Confident	53 Å²	53	62.7 Å²	62.7	44%	0.438	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-62.8	150.6	172	0	0	0	0	0	111.8	Y69 T93	A57-Y69 WeakPolarHBondContact CB-OH 3.38Å; A57-T93 HydrophobicContact CB-CG2 4.42Å
58	P	80.3	Confident	72.2	Confident	19 Å²	19	61.6 Å²	61.6	12%	0.123	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-60.9	138	-179.8	21.9	-33	0	0	0	113.6	P35 S36 Q60 V66 A111	P35-P58 HydrophobicContact CB-CG 4.1Å; S36-P58 WeakPolarHBondContact O-CB 3.27Å; S36-P58 WeakPolarHBondContact OG-CB 3.5Å; P58-Q60 PolarHBondContact O-N 3.36Å; P58-V66 HydrophobicContact CG-CG2 3.72Å; P58-A111 HydrophobicContact CG-CB 4.19Å
59	L	62.6	Low	73.1	Confident	172 Å²	172	56.8 Å²	56.8	90%	0.901	32%	0.324	S	S	*	.	S	Bend	trans	-79.3	-12.2	-171.3	-71.4	168.9	0	0	0	115.3
60	Q	58.9	Low	74.2	Confident	126 Å²	126	58.6 Å²	58.6	59%	0.589	33%	0.327	S	S	*	.			trans	-131.3	100.7	175.9	-76.7	-173.1	-21.2	0	0	111.6	P58 N62	P58-Q60 PolarHBondContact O-N 3.36Å; Q60-N62 PolarHBondContact O-N 2.85Å
61	S	56.3	Low	74.7	Confident	89 Å²	89	56.3 Å²	56.3	62%	0.622	32%	0.317	S	S	*	.			trans	-80.7	81.2	166	41.8	0	0	0	0	110.4	G63 G64	S61-G63 VanDerWaalsContact C-N 3.32Å; S61-G63 PolarHBondContact O-N 2.86Å; S61-G64 WeakPolarHBondContact CB-O 3.32Å
62	N	51	Low	75.1	Confident	94 Å²	94	57.5 Å²	57.5	50%	0.503	32%	0.322	S	S	.	.	S	Bend	trans	-69.4	86.6	174.9	-66.3	-24	0	0	0	109.9	Q60 G64	Q60-N62 PolarHBondContact O-N 2.85Å; N62-G64 PolarHBondContact O-N 3.42Å
63	G	54.2	Low	75.3	Confident	47 Å²	47	57.8 Å²	57.8	49%	0.485	32%	0.322	S	S	.	.	S	Bend	trans	73.6	-16	175.4	0	0	0	0	0	117	S61 R114	S61-G63 VanDerWaalsContact C-N 3.32Å; S61-G63 PolarHBondContact O-N 2.86Å; G63-R114 PolarHBondContact O-NH2 3.47Å
64	G	58	Low	75.3	Confident	9 Å²	9	60.6 Å²	60.6	9%	0.093	33%	0.333	C	S	.	.			trans	-113.3	138.3	-176.2	0	0	0	0	0	114.9	S61 N62	S61-G64 WeakPolarHBondContact CB-O 3.32Å; N62-G64 PolarHBondContact O-N 3.42Å
65	E	64.1	Low	75.2	Confident	156 Å²	156	62.9 Å²	62.9	73%	0.729	34%	0.34	S	S	*	.			trans	-75.6	138.8	163.4	-179.5	177.5	-143.6	0	0	109.9	R67	E65-R67 PolarHBondContact O-N 2.92Å
66	V	75.9	Confident	74.6	Confident	41 Å²	41	66.5 Å²	66.5	25%	0.248	36%	0.356	C	S	.	.			trans	-76.3	118.2	174.4	-179	0	0	0	0	108.5	P35 P58 G68 Y69 A111	P35-V66 HydrophobicContact CB-CG2 4.06Å; P35-V66 HydrophobicContact CG-CG2 4.07Å; P58-V66 HydrophobicContact CG-CG2 3.72Å; V66-G68 WeakPolarHBondContact CG1-O 3.43Å; V66-Y69 HydrophobicContact CG1-CE1 4.01Å; V66-Y69 HydrophobicContact CG1-CE2 4.27Å; V66-A111 HydrophobicContact CG1-CB 4.12Å
67	R	77.8	Confident	73.5	Confident	138 Å²	138	65.9 Å²	65.9	52%	0.521	35%	0.35	S	S	.	.			trans	-87	-14.4	-178.2	-67	-177	168.3	165.4	-10.7	113.5	E65 Y112 G113	E65-R67 PolarHBondContact O-N 2.92Å; R67-Y112 HydrophobicContact CB-CD1 4.27Å; R67-Y112 PolarHBondContact N-O 3.38Å; R67-G113 WeakPolarHBondContact CD-O 3.4Å
68	G	81.4	Confident	73.3	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.01	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.4	-166.2	171.1	0	0	0	0	0	112.2	V66 L90 Y112	V66-G68 WeakPolarHBondContact CG1-O 3.43Å; G68-L90 CarbonylContact C-O 3.43Å; G68-L90 VanDerWaalsContact C-O 3.31Å; G68-L90 WeakPolarHBondContact CA-O 3.38Å; G68-Y112 PolarHBondContact O-N 2.78Å
69	Y	84.7	Confident	73.1	Confident	15 Å²	15	70.6 Å²	70.6	6%	0.059	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	158	-172.4	-54.9	-86.9	0	0	0	111.5	P38 W55 A57 V66 L90 T93 V109 S110 A111	P38-Y69 HydrophobicContact CG-CD1 4.13Å; P38-Y69 HydrophobicContact CG-CE1 4.26Å; W55-Y69 AromaticContact CE2-CG 3.96Å; W55-Y69 HydrophobicContact CZ2-CD2 4.01Å; W55-Y69 AromaticContact CZ2-CG 3.87Å; W55-Y69 HydrophobicContact CZ2-CG 3.87Å; W55-Y69 AromaticContact NE1-CD1 3.36Å; W55-Y69 AromaticContact NE1-CD2 3.76Å; W55-Y69 AromaticContact NE1-CE1 3.6Å; W55-Y69 AromaticContact NE1-CE2 4Å; W55-Y69 AromaticContact NE1-CG 3.46Å; W55-Y69 AromaticContact NE1-CZ 3.93Å; A57-Y69 WeakPolarHBondContact CB-OH 3.38Å; V66-Y69 HydrophobicContact CG1-CE1 4.01Å; V66-Y69 HydrophobicContact CG1-CE2 4.27Å; Y69-L90 WeakPolarHBondContact CD2-O 3.29Å; Y69-L90 PolarHBondContact N-O 2.8Å; Y69-L90 PolarHBondContact O-N 3.41Å; Y69-T93 HydrophobicContact CD2-CG2 4.48Å; Y69-T93 HydrophobicContact CE2-CG2 3.67Å; Y69-V109 HydrophobicContact CD1-CG1 4.16Å; Y69-V109 HydrophobicContact CG-CG1 4.39Å; Y69-S110 CarbonylContact C-O 3.51Å; Y69-S110 VanDerWaalsContact CA-O 3.27Å; Y69-S110 WeakPolarHBondContact CA-O 3.43Å; Y69-A111 HydrophobicContact CD1-CB 3.85Å; Y69-A111 HydrophobicContact CE1-CB 3.82Å
70	Q	88.8	Confident	73.9	Confident	55 Å²	55	70.2 Å²	70.2	26%	0.257	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.9	170.6	178.5	-179.3	18.2	0	0	108	S83 V109 S110 F117	Q70-S83 PolarHBondContact NE2-OG 3.17Å; Q70-V109 WeakPolarHBondContact O-CA 3.47Å; Q70-V109 WeakPolarHBondContact O-CG1 3.35Å; Q70-S110 PolarHBondContact N-O 3.02Å; Q70-S110 PolarHBondContact O-N 2.84Å; Q70-F117 HydrophobicContact CB-CD1 4.33Å; Q70-F117 HydrophobicContact CB-CE1 3.59Å; Q70-F117 HydrophobicContact CB-CZ 4.17Å; Q70-F117 HydrophobicContact CG-CE1 4.45Å
71	I	87	Confident	75	Confident	3 Å²	3	66.6 Å²	66.6	2%	0.015	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134	177	-176.5	170.7	0	0	0	110	V53 M84 L90 C95 V97 F107 V109	V53-I71 HydrophobicContact CG2-CD1 3.48Å; V53-I71 VanDerWaalsContact CG2-CD1 3.48Å; I71-M84 HydrophobicContact CG2-CB 3.95Å; I71-M84 HydrophobicContact CG2-CG 3.93Å; I71-M84 PolarHBondContact O-N 3.1Å; I71-L90 HydrophobicContact CG2-CD1 3.92Å; I71-C95 HydrophobicContact CD1-CB 4.5Å; I71-V97 HydrophobicContact CD1-CG2 4.03Å; I71-F107 HydrophobicContact CD1-CB 4.41Å; I71-F107 HydrophobicContact CD1-CD1 3.92Å; I71-F107 HydrophobicContact CD1-CG 4.47Å; I71-F107 HydrophobicContact CG1-CD1 4.38Å; I71-V109 HydrophobicContact CB-CG2 4.41Å; I71-V109 HydrophobicContact CG1-CG2 4.21Å
72	E	87.8	Confident	76.1	Confident	26 Å²	26	69.5 Å²	69.5	12%	0.121	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	144.6	175.6	-60.1	164.5	96.8	0	0	109	W81 E82 F107 R108	E72-W81 HydrophobicContact CB-CE3 3.99Å; E72-E82 CarbonylContact C-O 3.55Å; E72-E82 WeakPolarHBondContact CA-O 3.28Å; E72-F107 CarbonylContact O-C 3.55Å; E72-F107 WeakPolarHBondContact O-CA 3.46Å; E72-R108 HydrophobicContact CB-CG 3.93Å; E72-R108 VanDerWaalsContact CD-NE 3.32Å; E72-R108 PolarHBondContact N-O 2.88Å; E72-R108 PolarHBondContact O-N 2.88Å; E72-R108 IonicContact OE1-CZ 3.67Å; E72-R108 IonicContact OE1-NE 3.4Å; E72-R108 PolarHBondContact OE1-NE 2.76Å; E72-R108 IonicContact OE1-NH2 2.76Å; E72-R108 PolarHBondContact OE1-NH2 2.91Å; E72-R108 IonicContact OE2-CZ 3.66Å; E72-R108 IonicContact OE2-NE 2.74Å; E72-R108 PolarHBondContact OE2-NE 3.45Å; E72-R108 IonicContact OE2-NH2 3.86Å; E72-R108 PolarHBondContact OE2-NH2 2.93Å
73	M	86.8	Confident	77.3	Confident	29 Å²	29	67.5 Å²	67.5	14%	0.143	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	155.1	176.6	-167	-153.5	-52.4	0	0	109.5	W81 E82 M84 V97 L100 V105 Q106 F107	M73-W81 WeakPolarHBondContact O-CA 3.21Å; M73-E82 PolarHBondContact N-O 3.35Å; M73-E82 PolarHBondContact O-N 2.83Å; M73-M84 HydrophobicContact CB-SD 4.05Å; M73-M84 HydrophobicContact CE-CE 3.97Å; M73-M84 HydrophobicContact CE-SD 3.53Å; M73-M84 VanDerWaalsContact CE-SD 3.53Å; M73-V97 HydrophobicContact CE-CG1 3.83Å; M73-L100 HydrophobicContact CE-CD2 3.21Å; M73-L100 HydrophobicContact SD-CD2 4.05Å; M73-V105 HydrophobicContact CG-CB 4.27Å; M73-V105 HydrophobicContact SD-CB 4.23Å; M73-V105 HydrophobicContact SD-CG1 3.97Å; M73-Q106 CarbonylContact C-O 3.57Å; M73-Q106 WeakPolarHBondContact CA-O 3Å; M73-F107 HydrophobicContact CB-CD1 4.11Å; M73-F107 HydrophobicContact CB-CE1 4.13Å; M73-F107 HydrophobicContact CE-CE1 4.04Å; M73-F107 HydrophobicContact CG-CD1 3.93Å; M73-F107 HydrophobicContact CG-CE1 3.63Å; M73-F107 HydrophobicContact CG-CZ 4.25Å; M73-F107 HydrophobicContact SD-CE1 4.37Å
74	R	85.3	Confident	78	Confident	59 Å²	59	67.9 Å²	67.9	22%	0.223	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	158.6	156.6	64.9	167.9	179.7	165.9	9	111.9	G79 E80 W81 V105 Q106	R74-G79 WeakPolarHBondContact CD-O 3.31Å; R74-G79 PolarHBondContact NH1-O 3.5Å; R74-E80 WeakPolarHBondContact CB-O 3.32Å; R74-W81 HydrophobicContact CB-CD2 4.13Å; R74-W81 HydrophobicContact CB-CE3 4.12Å; R74-W81 HydrophobicContact CB-CZ3 4.44Å; R74-W81 HydrophobicContact CG-CD2 4Å; R74-W81 HydrophobicContact CG-CE3 4.03Å; R74-W81 HydrophobicContact CG-CH2 3.84Å; R74-W81 HydrophobicContact CG-CZ2 3.78Å; R74-W81 HydrophobicContact CG-CZ3 3.95Å; R74-V105 CarbonylContact O-C 3.46Å; R74-V105 WeakPolarHBondContact O-CA 3.39Å; R74-V105 WeakPolarHBondContact O-CB 3.49Å; R74-Q106 HydrophobicContact CG-CB 4.12Å; R74-Q106 PolarHBondContact N-O 2.89Å; R74-Q106 VanDerWaalsContact NE-OE1 3.11Å; R74-Q106 PolarHBondContact O-N 2.89Å
75	E	83.3	Confident	77.8	Confident	99 Å²	99	70.3 Å²	70.3	46%	0.463	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	147.6	162.6	-55	-157.3	-173.8	0	0	110.7	G79 S102	E75-G79 VanDerWaalsContact O-CA 3.3Å; E75-G79 WeakPolarHBondContact O-CA 3.4Å; E75-G79 PolarHBondContact O-N 2.83Å; E75-S102 VanDerWaalsContact OE2-CB 3.28Å; E75-S102 WeakPolarHBondContact OE2-CB 3.37Å; E75-S102 PolarHBondContact OE2-OG 2.77Å
76	F	76.9	Confident	77.2	Confident	82 Å²	82	66.7 Å²	66.7	36%	0.36	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	137.9	179.7	-174.5	-96.3	0	0	0	110.7	E104 Q106 P126	F76-E104 HydrophobicContact CB-CG 4.27Å; F76-E104 WeakPolarHBondContact CB-O 3.37Å; F76-E104 HydrophobicContact CD1-CG 4.19Å; F76-E104 PolarHBondContact N-O 2.97Å; F76-Q106 HydrophobicContact CB-CG 4.48Å; F76-Q106 HydrophobicContact CD2-CG 3.95Å; F76-P126 HydrophobicContact CB-CB 4.39Å; F76-P126 HydrophobicContact CD1-CB 3.91Å; F76-P126 HydrophobicContact CD1-CG 3.95Å; F76-P126 HydrophobicContact CD2-CB 4.18Å; F76-P126 HydrophobicContact CD2-CG 3.68Å; F76-P126 HydrophobicContact CE1-CB 4.25Å; F76-P126 HydrophobicContact CE1-CG 3.87Å; F76-P126 HydrophobicContact CE2-CG 3.61Å; F76-P126 HydrophobicContact CG-CB 3.88Å; F76-P126 HydrophobicContact CG-CG 3.86Å; F76-P126 HydrophobicContact CZ-CG 3.71Å
77	P	61.3	Low	75.9	Confident	70 Å²	70	72.3 Å²	72.3	46%	0.455	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.4	-29.3	6	31.4	-31.7	0	0	0	115.9
78	D	76.4	Confident	74.9	Confident	151 Å²	151	73 Å²	73	81%	0.807	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	13.4	-158.7	-57.4	-36.5	0	0	0	114.4
79	G	76.6	Confident	74.7	Confident	20 Å²	20	75.5 Å²	75.5	21%	0.206	40%	0.397	C	S	.	.			trans	-71.4	149.3	179.8	0	0	0	0	0	113.9	R74 E75	R74-G79 WeakPolarHBondContact CD-O 3.31Å; R74-G79 PolarHBondContact NH1-O 3.5Å; E75-G79 VanDerWaalsContact O-CA 3.3Å; E75-G79 WeakPolarHBondContact O-CA 3.4Å; E75-G79 PolarHBondContact O-N 2.83Å
80	E	80.1	Confident	74.4	Confident	164 Å²	164	76.6 Å²	76.6	77%	0.766	40%	0.404	S	S	*	.			trans	-77.7	157.6	167.9	-77.5	-64	171.8	0	0	111.8	R74 E82	R74-E80 WeakPolarHBondContact CB-O 3.32Å; E80-E82 PolarHBondContact O-N 2.77Å
81	W	81.8	Confident	73.9	Confident	51 Å²	51	82.2 Å²	82.2	19%	0.193	43%	0.428	C	S	.	.			trans	-84.5	108.1	179.9	-71.2	95.5	0	0	0	111.6	E72 M73 R74 Q106 R108 P123	E72-W81 HydrophobicContact CB-CE3 3.99Å; M73-W81 WeakPolarHBondContact O-CA 3.21Å; R74-W81 HydrophobicContact CB-CD2 4.13Å; R74-W81 HydrophobicContact CB-CE3 4.12Å; R74-W81 HydrophobicContact CB-CZ3 4.44Å; R74-W81 HydrophobicContact CG-CD2 4Å; R74-W81 HydrophobicContact CG-CE3 4.03Å; R74-W81 HydrophobicContact CG-CH2 3.84Å; R74-W81 HydrophobicContact CG-CZ2 3.78Å; R74-W81 HydrophobicContact CG-CZ3 3.95Å; W81-Q106 HydrophobicContact CH2-CB 3.96Å; W81-R108 HydrophobicContact CD2-CG 4.3Å; W81-R108 HydrophobicContact CE3-CG 3.75Å; W81-R108 VanDerWaalsContact CG-CZ 3.49Å; W81-R108 VanDerWaalsContact CG-NH1 3.29Å; W81-R108 HydrophobicContact CH2-CB 4Å; W81-R108 HydrophobicContact CH2-CG 4.03Å; W81-R108 HydrophobicContact CZ3-CB 3.93Å; W81-R108 HydrophobicContact CZ3-CG 3.6Å; W81-P123 HydrophobicContact CH2-CB 3.87Å; W81-P123 HydrophobicContact CH2-CG 3.99Å; W81-P123 HydrophobicContact CZ2-CB 3.96Å; W81-P123 HydrophobicContact CZ2-CG 3.62Å
82	E	79.5	Confident	73.5	Confident	150 Å²	150	87.6 Å²	87.6	70%	0.701	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	135.3	171.5	-63.4	-161.8	144.3	0	0	110.8	E72 M73 E80	E72-E82 CarbonylContact C-O 3.55Å; E72-E82 WeakPolarHBondContact CA-O 3.28Å; M73-E82 PolarHBondContact N-O 3.35Å; M73-E82 PolarHBondContact O-N 2.83Å; E80-E82 PolarHBondContact O-N 2.77Å
83	S	76.4	Confident	73.3	Confident	52 Å²	52	88.8 Å²	88.8	36%	0.364	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	132.7	167.2	178.7	0	0	0	0	109.5	Q70 G85	Q70-S83 PolarHBondContact NE2-OG 3.17Å; S83-G85 PolarHBondContact O-N 3.02Å
84	M	68.7	Low	73	Confident	54 Å²	54	90.7 Å²	90.7	27%	0.266	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-62	126.5	163.7	-61.5	-45.7	-64.7	0	0	108.6	I71 M73 V86 V97	I71-M84 HydrophobicContact CG2-CB 3.95Å; I71-M84 HydrophobicContact CG2-CG 3.93Å; I71-M84 PolarHBondContact O-N 3.1Å; M73-M84 HydrophobicContact CB-SD 4.05Å; M73-M84 HydrophobicContact CE-CE 3.97Å; M73-M84 HydrophobicContact CE-SD 3.53Å; M73-M84 VanDerWaalsContact CE-SD 3.53Å; M84-V86 PolarHBondContact O-N 2.92Å; M84-V97 HydrophobicContact CE-CG1 3.62Å; M84-V97 HydrophobicContact CG-CG1 4.14Å; M84-V97 HydrophobicContact SD-CG1 4.08Å
85	G	54.2	Low	72.8	Confident	60 Å²	60	89 Å²	89	62%	0.619	48%	0.476	S	S	*	.			trans	-71.5	84.5	-171	0	0	0	0	0	112.6	S83	S83-G85 PolarHBondContact O-N 3.02Å
86	V	50.4	Low	72.7	Confident	80 Å²	80	90.6 Å²	90.6	49%	0.485	48%	0.477	S	S	.	.			trans	-121.8	110	171.5	-158.1	0	0	0	0	108	M84 H88	M84-V86 PolarHBondContact O-N 2.92Å; V86-H88 WeakPolarHBondContact CG1-O 3.4Å; V86-H88 PolarHBondContact O-N 3.07Å
87	D	47.9	Very low	72.7	Confident	159 Å²	159	87 Å²	87	85%	0.85	46%	0.462	S	S	*	.	S	Bend	trans	-65	-3	177.5	-71	-43	0	0	0	113.3
88	H	57.2	Low	73.3	Confident	154 Å²	154	85.9 Å²	85.9	71%	0.713	45%	0.454	S	S	*	.	S	Bend	trans	-132	140.7	-179.8	-61.6	-13.6	0	0	0	110.6	V86	V86-H88 WeakPolarHBondContact CG1-O 3.4Å; V86-H88 PolarHBondContact O-N 3.07Å
89	L	76.9	Confident	72.6	Confident	53 Å²	53	83.8 Å²	83.8	28%	0.277	44%	0.443	S	S	.	.			trans	-66	133.6	-180	-60.7	163	0	0	0	111.6	K91 Y112 F117	L89-K91 PolarHBondContact O-N 3.48Å; L89-Y112 HydrophobicContact CD1-CD1 3.43Å; L89-Y112 VanDerWaalsContact CD1-CD1 3.43Å; L89-Y112 HydrophobicContact CD1-CD2 4.27Å; L89-Y112 HydrophobicContact CD1-CE1 4.06Å; L89-Y112 HydrophobicContact CD1-CG 3.55Å; L89-Y112 HydrophobicContact CD2-CD2 4.2Å; L89-Y112 HydrophobicContact CD2-CG 3.95Å; L89-Y112 HydrophobicContact CG-CG 4.41Å; L89-F117 HydrophobicContact CD2-CE1 3.47Å; L89-F117 VanDerWaalsContact CD2-CE1 3.47Å; L89-F117 HydrophobicContact CD2-CZ 3.58Å
90	L	79	Confident	72.3	Confident	38 Å²	38	83.6 Å²	83.6	20%	0.199	44%	0.437	C	S	.	.	B	Isolated β-bridge	trans	-65	126.3	173.1	-59.8	177.1	0	0	0	109.4	W55 G68 Y69 I71 C95	W55-L90 HydrophobicContact CH2-CD1 4.04Å; G68-L90 CarbonylContact C-O 3.43Å; G68-L90 VanDerWaalsContact C-O 3.31Å; G68-L90 WeakPolarHBondContact CA-O 3.38Å; Y69-L90 WeakPolarHBondContact CD2-O 3.29Å; Y69-L90 PolarHBondContact N-O 2.8Å; Y69-L90 PolarHBondContact O-N 3.41Å; I71-L90 HydrophobicContact CG2-CD1 3.92Å; L90-C95 HydrophobicContact CD1-CB 4.04Å
91	K	77.8	Confident	71.4	Confident	173 Å²	173	81.8 Å²	81.8	75%	0.752	44%	0.437	S	S	*	.			trans	-88	-31.8	-177.9	-66.3	-178.6	-178.2	175.2	0	112.9	L89	L89-K91 PolarHBondContact O-N 3.48Å
92	D	78.8	Confident	70.7	Confident	116 Å²	116	80.4 Å²	80.4	62%	0.62	44%	0.436	S	S	*	.	S	Bend	trans	-84.7	161.3	177.8	-56.9	-60.7	0	0	0	111.6	W55 T94	W55-D92 VanDerWaalsContact CZ2-O 3.28Å; W55-D92 WeakPolarHBondContact CZ2-O 3.45Å; D92-T94 VanDerWaalsContact C-N 3.28Å; D92-T94 HydrophobicContact CB-CG2 4.18Å; D92-T94 PolarHBondContact O-N 2.68Å
93	T	84.8	Confident	70.2	Confident	51 Å²	51	77.8 Å²	77.8	31%	0.313	42%	0.423	S	S	.	.	S	Bend	trans	-94.5	25.9	177.6	52	0	0	0	0	113	V54 W55 A57 Y69	V54-T93 WeakPolarHBondContact CA-O 3Å; W55-T93 PolarHBondContact N-O 3Å; W55-T93 WeakPolarHBondContact O-CB 3.42Å; A57-T93 HydrophobicContact CB-CG2 4.42Å; Y69-T93 HydrophobicContact CD2-CG2 4.48Å; Y69-T93 HydrophobicContact CE2-CG2 3.67Å
94	T	79.8	Confident	70.4	Confident	69 Å²	69	77.4 Å²	77.4	42%	0.423	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	141.2	178.9	178.4	0	0	0	0	109.7	V53 D92	V53-T94 WeakPolarHBondContact O-CA 3.36Å; D92-T94 VanDerWaalsContact C-N 3.28Å; D92-T94 HydrophobicContact CB-CG2 4.18Å; D92-T94 PolarHBondContact O-N 2.68Å
95	C	80.8	Confident	71.2	Confident	23 Å²	23	74.9 Å²	74.9	16%	0.155	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	133.4	177.9	-173.2	0	0	0	0	110.9	T52 V53 W55 I71 L90	T52-C95 WeakPolarHBondContact CA-O 3.45Å; V53-C95 HydrophobicContact CG2-CB 4.47Å; V53-C95 PolarHBondContact N-O 2.59Å; V53-C95 PolarHBondContact O-N 3.47Å; W55-C95 HydrophobicContact CH2-CB 3.84Å; W55-C95 HydrophobicContact CZ3-CB 3.74Å; I71-C95 HydrophobicContact CD1-CB 4.5Å; L90-C95 HydrophobicContact CD1-CB 4.04Å
96	R	81.4	Confident	72.9	Confident	133 Å²	133	72.9 Å²	72.9	50%	0.502	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	111.5	170.1	174.7	173.1	159.7	-171.5	2.9	109	E50 T52 T98	E50-R96 VanDerWaalsContact CD-NE 3.33Å; E50-R96 IonicContact OE1-CZ 3.35Å; E50-R96 IonicContact OE1-NE 3.45Å; E50-R96 PolarHBondContact OE1-NE 2.81Å; E50-R96 IonicContact OE1-NH2 2.68Å; E50-R96 PolarHBondContact OE1-NH2 3.44Å; E50-R96 IonicContact OE2-CZ 3.16Å; E50-R96 IonicContact OE2-NE 2.76Å; E50-R96 PolarHBondContact OE2-NE 3.3Å; E50-R96 IonicContact OE2-NH2 2.92Å; E50-R96 PolarHBondContact OE2-NH2 2.64Å; T52-R96 HydrophobicContact CG2-CB 4.3Å; R96-T98 HydrophobicContact CG-CG2 4.1Å
97	V	76.2	Confident	74.8	Confident	7 Å²	7	69.1 Å²	69.1	4%	0.042	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	132.2	-178.3	-160.2	0	0	0	0	108.6	E50 V51 I71 M73 M84 L100 F107	E50-V97 CarbonylContact C-O 3.31Å; E50-V97 WeakPolarHBondContact CA-O 3.2Å; E50-V97 WeakPolarHBondContact CB-O 3.45Å; V51-V97 PolarHBondContact N-O 2.93Å; V51-V97 PolarHBondContact O-N 3.41Å; I71-V97 HydrophobicContact CD1-CG2 4.03Å; M73-V97 HydrophobicContact CE-CG1 3.83Å; M84-V97 HydrophobicContact CE-CG1 3.62Å; M84-V97 HydrophobicContact CG-CG1 4.14Å; M84-V97 HydrophobicContact SD-CG1 4.08Å; V97-L100 HydrophobicContact CB-CD2 4.38Å; V97-L100 HydrophobicContact CG1-CD2 3.89Å; V97-F107 HydrophobicContact CB-CE1 4.16Å; V97-F107 HydrophobicContact CG1-CE1 4.26Å; V97-F107 HydrophobicContact CG2-CD1 4.42Å; V97-F107 HydrophobicContact CG2-CE1 3.84Å; V97-F107 HydrophobicContact CG2-CZ 4.47Å
98	T	74.6	Confident	76.9	Confident	45 Å²	45	64.4 Å²	64.4	28%	0.276	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	162.4	-170.1	66.5	0	0	0	0	112.1	G49 E50 R96	G49-T98 CarbonylContact O-C 3.56Å; E50-T98 HydrophobicContact CB-CG2 3.88Å; E50-T98 VanDerWaalsContact OE2-CG2 3.29Å; E50-T98 WeakPolarHBondContact OE2-CG2 3.37Å; R96-T98 HydrophobicContact CG-CG2 4.1Å
99	N	62.6	Low	78.4	Confident	107 Å²	107	57.1 Å²	57.1	57%	0.572	29%	0.291	S	S	*	.			trans	68.3	36	-174	-41.9	-73.6	0	0	0	113.6	G49 T101	G49-N99 PolarHBondContact O-N 3.01Å; N99-T101 PolarHBondContact O-N 2.82Å
100	L	69.1	Low	78.9	Confident	17 Å²	17	55 Å²	55	9%	0.089	28%	0.281	C	S	.	.			trans	-74.7	119.3	179.3	-50.2	178.7	0	0	0	110.4	G49 V51 M73 V97 F107 I129	G49-L100 PolarHBondContact O-N 3.16Å; V51-L100 HydrophobicContact CB-CD1 3.79Å; V51-L100 HydrophobicContact CG2-CD1 3.54Å; M73-L100 HydrophobicContact CE-CD2 3.21Å; M73-L100 HydrophobicContact SD-CD2 4.05Å; V97-L100 HydrophobicContact CB-CD2 4.38Å; V97-L100 HydrophobicContact CG1-CD2 3.89Å; L100-F107 HydrophobicContact CD1-CZ 4.48Å; L100-I129 HydrophobicContact CB-CD1 3.68Å; L100-I129 HydrophobicContact CD1-CD1 3.8Å; L100-I129 HydrophobicContact CD1-CG1 4.13Å; L100-I129 HydrophobicContact CG-CD1 4.36Å
101	T	61.3	Low	79.1	Confident	126 Å²	126	53.2 Å²	53.2	77%	0.773	27%	0.272	S	S	*	.			trans	-100.1	-21.9	-176.7	46.9	0	0	0	0	114.4	N99	N99-T101 PolarHBondContact O-N 2.82Å
102	S	67.8	Low	79.4	Confident	22 Å²	22	48.1 Å²	48.1	15%	0.154	25%	0.248	C	C	.	.	S	Bend	trans	-80.8	154.4	178.2	-159	0	0	0	0	111.8	E75 I129	E75-S102 VanDerWaalsContact OE2-CB 3.28Å; E75-S102 WeakPolarHBondContact OE2-CB 3.37Å; E75-S102 PolarHBondContact OE2-OG 2.77Å; S102-I129 WeakPolarHBondContact O-CD1 3.36Å
103	H	67.5	Low	79.3	Confident	95 Å²	95	42.6 Å²	42.6	44%	0.44	22%	0.219	S	C	.	.	S	Bend	trans	-77	-28.7	177.8	172	-88.7	0	0	0	112.6	K128 I129 I131	H103-K128 WeakPolarHBondContact O-CA 3.11Å; H103-I129 PolarHBondContact O-N 3.14Å; H103-I131 HydrophobicContact CB-CD1 4.46Å
104	E	82.1	Confident	78.7	Confident	44 Å²	44	46 Å²	46	21%	0.206	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	121.9	-175.4	-165.2	159.2	-163.1	0	0	111.4	F76 P126 V127 K128	F76-E104 HydrophobicContact CB-CG 4.27Å; F76-E104 WeakPolarHBondContact CB-O 3.37Å; F76-E104 HydrophobicContact CD1-CG 4.19Å; F76-E104 PolarHBondContact N-O 2.97Å; E104-P126 HydrophobicContact CG-CB 3.8Å; E104-V127 WeakPolarHBondContact CA-O 3.42Å; E104-K128 HydrophobicContact CB-CG 4.37Å; E104-K128 HydrophobicContact CG-CG 3.93Å; E104-K128 WeakPolarHBondContact OE1-CE 3.27Å; E104-K128 IonicContact OE1-NZ 3.6Å; E104-K128 WeakPolarHBondContact OE2-CE 3.35Å; E104-K128 IonicContact OE2-NZ 3.95Å
105	V	86.1	Confident	77.9	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	161.8	-170.9	-62.5	0	0	0	0	113	M73 R74 F107 P126 V127 I129	M73-V105 HydrophobicContact CG-CB 4.27Å; M73-V105 HydrophobicContact SD-CB 4.23Å; M73-V105 HydrophobicContact SD-CG1 3.97Å; R74-V105 CarbonylContact O-C 3.46Å; R74-V105 WeakPolarHBondContact O-CA 3.39Å; R74-V105 WeakPolarHBondContact O-CB 3.49Å; V105-F107 HydrophobicContact CG2-CE2 3.64Å; V105-F107 HydrophobicContact CG2-CZ 3.76Å; V105-P126 CarbonylContact O-C 3.47Å; V105-P126 WeakPolarHBondContact O-CA 3.46Å; V105-V127 HydrophobicContact CG2-CB 4.11Å; V105-V127 PolarHBondContact N-O 2.74Å; V105-V127 PolarHBondContact O-N 2.75Å; V105-I129 HydrophobicContact CB-CD1 4.45Å; V105-I129 HydrophobicContact CG1-CD1 3.87Å; V105-I129 HydrophobicContact CG2-CD1 3.73Å; V105-I129 HydrophobicContact CG2-CG1 4.49Å
106	Q	89.8	Confident	77.4	Confident	18 Å²	18	46.2 Å²	46.2	8%	0.084	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	150.7	168.2	-69.9	-172.1	-64.7	0	0	111.5	M73 R74 F76 W81 S124 P126	M73-Q106 CarbonylContact C-O 3.57Å; M73-Q106 WeakPolarHBondContact CA-O 3Å; R74-Q106 HydrophobicContact CG-CB 4.12Å; R74-Q106 PolarHBondContact N-O 2.89Å; R74-Q106 VanDerWaalsContact NE-OE1 3.11Å; R74-Q106 PolarHBondContact O-N 2.89Å; F76-Q106 HydrophobicContact CB-CG 4.48Å; F76-Q106 HydrophobicContact CD2-CG 3.95Å; W81-Q106 HydrophobicContact CH2-CB 3.96Å; Q106-S124 PolarHBondContact NE2-O 2.97Å; Q106-P126 HydrophobicContact CG-CB 4.39Å; Q106-P126 HydrophobicContact CG-CG 4.18Å
107	F	90.3	Very high	77.4	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	148.6	178.1	-59.6	-82.2	0	0	0	111.6	P41 V51 V53 I71 E72 M73 V97 L100 V105 P123 S124 V127	P41-F107 HydrophobicContact CG-CB 4.08Å; P41-F107 WeakPolarHBondContact CG-O 3.43Å; V51-F107 HydrophobicContact CB-CE2 4.31Å; V51-F107 HydrophobicContact CB-CZ 4.22Å; V51-F107 HydrophobicContact CG1-CE2 3.89Å; V51-F107 HydrophobicContact CG1-CZ 4.26Å; V53-F107 HydrophobicContact CG1-CD2 3.84Å; V53-F107 HydrophobicContact CG1-CE2 4.18Å; V53-F107 HydrophobicContact CG1-CG 4.18Å; I71-F107 HydrophobicContact CD1-CB 4.41Å; I71-F107 HydrophobicContact CD1-CD1 3.92Å; I71-F107 HydrophobicContact CD1-CG 4.47Å; I71-F107 HydrophobicContact CG1-CD1 4.38Å; E72-F107 CarbonylContact O-C 3.55Å; E72-F107 WeakPolarHBondContact O-CA 3.46Å; M73-F107 HydrophobicContact CB-CD1 4.11Å; M73-F107 HydrophobicContact CB-CE1 4.13Å; M73-F107 HydrophobicContact CE-CE1 4.04Å; M73-F107 HydrophobicContact CG-CD1 3.93Å; M73-F107 HydrophobicContact CG-CE1 3.63Å; M73-F107 HydrophobicContact CG-CZ 4.25Å; M73-F107 HydrophobicContact SD-CE1 4.37Å; V97-F107 HydrophobicContact CB-CE1 4.16Å; V97-F107 HydrophobicContact CG1-CE1 4.26Å; V97-F107 HydrophobicContact CG2-CD1 4.42Å; V97-F107 HydrophobicContact CG2-CE1 3.84Å; V97-F107 HydrophobicContact CG2-CZ 4.47Å; L100-F107 HydrophobicContact CD1-CZ 4.48Å; V105-F107 HydrophobicContact CG2-CE2 3.64Å; V105-F107 HydrophobicContact CG2-CZ 3.76Å; F107-P123 CarbonylContact O-C 3.59Å; F107-P123 WeakPolarHBondContact O-CA 2.97Å; F107-S124 PolarHBondContact N-OG 3.41Å; F107-S124 PolarHBondContact O-N 3.36Å; F107-V127 HydrophobicContact CD2-CG2 4.15Å; F107-V127 HydrophobicContact CE2-CG2 4.06Å
108	R	91.4	Very high	77.5	Confident	61 Å²	61	44 Å²	44	23%	0.23	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	158.8	165.6	74.4	-177.3	-168.6	-155.5	-4.8	110.2	E72 W81 A120 S121	E72-R108 HydrophobicContact CB-CG 3.93Å; E72-R108 VanDerWaalsContact CD-NE 3.32Å; E72-R108 PolarHBondContact N-O 2.88Å; E72-R108 PolarHBondContact O-N 2.88Å; E72-R108 IonicContact OE1-CZ 3.67Å; E72-R108 IonicContact OE1-NE 3.4Å; E72-R108 PolarHBondContact OE1-NE 2.76Å; E72-R108 IonicContact OE1-NH2 2.76Å; E72-R108 PolarHBondContact OE1-NH2 2.91Å; E72-R108 IonicContact OE2-CZ 3.66Å; E72-R108 IonicContact OE2-NE 2.74Å; E72-R108 PolarHBondContact OE2-NE 3.45Å; E72-R108 IonicContact OE2-NH2 3.86Å; E72-R108 PolarHBondContact OE2-NH2 2.93Å; W81-R108 HydrophobicContact CD2-CG 4.3Å; W81-R108 HydrophobicContact CE3-CG 3.75Å; W81-R108 VanDerWaalsContact CG-CZ 3.49Å; W81-R108 VanDerWaalsContact CG-NH1 3.29Å; W81-R108 HydrophobicContact CH2-CB 4Å; W81-R108 HydrophobicContact CH2-CG 4.03Å; W81-R108 HydrophobicContact CZ3-CB 3.93Å; W81-R108 HydrophobicContact CZ3-CG 3.6Å; R108-A120 HydrophobicContact CG-CB 4.15Å; R108-S121 WeakPolarHBondContact CA-OG 2.96Å
109	V	89.1	Confident	77.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	136.5	-174.7	-173.5	0	0	0	0	111.5	P38 P41 W55 Y69 Q70 I71 A120 S121	P38-V109 WeakPolarHBondContact CD-O 3.44Å; P38-V109 HydrophobicContact CG-CB 4.38Å; P38-V109 HydrophobicContact CG-CG1 4.17Å; P38-V109 WeakPolarHBondContact CG-O 3.39Å; P41-V109 HydrophobicContact CB-CG2 4.05Å; P41-V109 HydrophobicContact CG-CG2 4.13Å; W55-V109 HydrophobicContact CD2-CB 4.35Å; W55-V109 HydrophobicContact CD2-CG1 3.97Å; W55-V109 HydrophobicContact CD2-CG2 3.87Å; W55-V109 HydrophobicContact CE3-CG2 3.82Å; W55-V109 HydrophobicContact CG-CB 4.43Å; W55-V109 HydrophobicContact CG-CG1 4.25Å; W55-V109 HydrophobicContact CG-CG2 4.23Å; W55-V109 HydrophobicContact CZ2-CG1 4.04Å; W55-V109 HydrophobicContact CZ3-CG2 4.29Å; Y69-V109 HydrophobicContact CD1-CG1 4.16Å; Y69-V109 HydrophobicContact CG-CG1 4.39Å; Q70-V109 WeakPolarHBondContact O-CA 3.47Å; Q70-V109 WeakPolarHBondContact O-CG1 3.35Å; I71-V109 HydrophobicContact CB-CG2 4.41Å; I71-V109 HydrophobicContact CG1-CG2 4.21Å; V109-A120 CarbonylContact O-C 3.59Å; V109-A120 WeakPolarHBondContact O-CA 3.33Å; V109-S121 PolarHBondContact N-OG 2.59Å; V109-S121 PolarHBondContact O-N 3.46Å
110	S	87.4	Confident	79	Confident	10 Å²	10	42.4 Å²	42.4	7%	0.07	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	139.7	175.3	-62.4	0	0	0	0	110.6	Y69 Q70 A120	Y69-S110 CarbonylContact C-O 3.51Å; Y69-S110 VanDerWaalsContact CA-O 3.27Å; Y69-S110 WeakPolarHBondContact CA-O 3.43Å; Q70-S110 PolarHBondContact N-O 3.02Å; Q70-S110 PolarHBondContact O-N 2.84Å; S110-A120 WeakPolarHBondContact OG-CA 3.32Å; S110-A120 WeakPolarHBondContact OG-CB 3.45Å
111	A	83.1	Confident	79.9	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	140.7	177.4	0	0	0	0	0	111.7	P35 P38 P58 V66 Y69 F117 G118	P35-A111 HydrophobicContact CB-CB 3.96Å; P35-A111 HydrophobicContact CG-CB 4.08Å; P38-A111 HydrophobicContact CG-CB 3.96Å; P58-A111 HydrophobicContact CG-CB 4.19Å; V66-A111 HydrophobicContact CG1-CB 4.12Å; Y69-A111 HydrophobicContact CD1-CB 3.85Å; Y69-A111 HydrophobicContact CE1-CB 3.82Å; A111-F117 CarbonylContact O-C 3.56Å; A111-F117 WeakPolarHBondContact O-CA 3.34Å; A111-G118 PolarHBondContact O-N 2.81Å
112	Y	83.7	Confident	81.1	Confident	65 Å²	65	41.7 Å²	41.7	26%	0.255	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	130.5	178.3	-171.1	-83.1	0	0	0	111.7	R67 G68 L89 F117	R67-Y112 HydrophobicContact CB-CD1 4.27Å; R67-Y112 PolarHBondContact N-O 3.38Å; G68-Y112 PolarHBondContact O-N 2.78Å; L89-Y112 HydrophobicContact CD1-CD1 3.43Å; L89-Y112 VanDerWaalsContact CD1-CD1 3.43Å; L89-Y112 HydrophobicContact CD1-CD2 4.27Å; L89-Y112 HydrophobicContact CD1-CE1 4.06Å; L89-Y112 HydrophobicContact CD1-CG 3.55Å; L89-Y112 HydrophobicContact CD2-CD2 4.2Å; L89-Y112 HydrophobicContact CD2-CG 3.95Å; L89-Y112 HydrophobicContact CG-CG 4.41Å; Y112-F117 AromaticContact CD2-CD1 3.74Å; Y112-F117 HydrophobicContact CD2-CD1 3.74Å; Y112-F117 AromaticContact CD2-CD2 3.75Å; Y112-F117 HydrophobicContact CD2-CD2 3.75Å; Y112-F117 AromaticContact CD2-CE1 3.68Å; Y112-F117 HydrophobicContact CD2-CE1 3.68Å; Y112-F117 AromaticContact CD2-CE2 3.69Å; Y112-F117 HydrophobicContact CD2-CE2 3.69Å; Y112-F117 AromaticContact CD2-CG 3.77Å; Y112-F117 HydrophobicContact CD2-CG 3.77Å; Y112-F117 AromaticContact CD2-CZ 3.66Å; Y112-F117 HydrophobicContact CD2-CZ 3.66Å; Y112-F117 HydrophobicContact CE2-CD2 4.19Å; Y112-F117 HydrophobicContact CE2-CE2 4.06Å; Y112-F117 HydrophobicContact CE2-CZ 4.36Å; Y112-F117 HydrophobicContact CG-CD1 4.28Å; Y112-F117 HydrophobicContact CG-CE1 4.19Å; Y112-F117 HydrophobicContact CG-CZ 4.49Å
113	G	77.4	Confident	82.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.225	C	C	.	.			trans	-106	-139.7	-176.5	0	0	0	0	0	114.4	R67 G116	R67-G113 WeakPolarHBondContact CD-O 3.4Å; G113-G116 PolarHBondContact N-O 3.18Å
114	R	70.8	Confident	83.1	Confident	124 Å²	124	38.9 Å²	38.9	47%	0.468	21%	0.205	S	C	.	.	S	Bend	trans	-79.4	-28.1	177.1	-171.5	179.9	-67.4	138.3	6.1	112.3	D31 G33 G63	D31-R114 IonicContact OD2-NH1 3.51Å; G33-R114 PolarHBondContact O-N 3.18Å; G63-R114 PolarHBondContact O-NH2 3.47Å
115	T	63	Low	83.1	Confident	82 Å²	82	43.9 Å²	43.9	50%	0.503	23%	0.233	S	C	.	.	S	Bend	trans	-125.9	-14.6	-163.6	44.9	0	0	0	0	114.6	S32 G33 I34	S32-T115 WeakPolarHBondContact O-CB 3.44Å; S32-T115 WeakPolarHBondContact O-CG2 3.47Å; S32-T115 PolarHBondContact O-OG1 2.81Å; G33-T115 PolarHBondContact O-OG1 2.89Å; I34-T115 WeakPolarHBondContact CG1-OG1 3.49Å; I34-T115 PolarHBondContact N-OG1 3.04Å
116	G	71.5	Confident	82.9	Confident	14 Å²	14	46 Å²	46	14%	0.144	25%	0.246	C	C	.	.	S	Bend	trans	166.4	-173.8	179.8	0	0	0	0	0	113.6	G113	G113-G116 PolarHBondContact N-O 3.18Å
117	F	79.8	Confident	82.5	Confident	87 Å²	87	45.8 Å²	45.8	38%	0.382	25%	0.246	S	C	.	.	B	Isolated β-bridge	trans	-75.7	137.3	170.6	-68.1	-77.3	0	0	0	111.4	I34 Q70 L89 A111 Y112	I34-F117 WeakPolarHBondContact CG2-O 3.35Å; Q70-F117 HydrophobicContact CB-CD1 4.33Å; Q70-F117 HydrophobicContact CB-CE1 3.59Å; Q70-F117 HydrophobicContact CB-CZ 4.17Å; Q70-F117 HydrophobicContact CG-CE1 4.45Å; L89-F117 HydrophobicContact CD2-CE1 3.47Å; L89-F117 VanDerWaalsContact CD2-CE1 3.47Å; L89-F117 HydrophobicContact CD2-CZ 3.58Å; A111-F117 CarbonylContact O-C 3.56Å; A111-F117 WeakPolarHBondContact O-CA 3.34Å; Y112-F117 AromaticContact CD2-CD1 3.74Å; Y112-F117 HydrophobicContact CD2-CD1 3.74Å; Y112-F117 AromaticContact CD2-CD2 3.75Å; Y112-F117 HydrophobicContact CD2-CD2 3.75Å; Y112-F117 AromaticContact CD2-CE1 3.68Å; Y112-F117 HydrophobicContact CD2-CE1 3.68Å; Y112-F117 AromaticContact CD2-CE2 3.69Å; Y112-F117 HydrophobicContact CD2-CE2 3.69Å; Y112-F117 AromaticContact CD2-CG 3.77Å; Y112-F117 HydrophobicContact CD2-CG 3.77Å; Y112-F117 AromaticContact CD2-CZ 3.66Å; Y112-F117 HydrophobicContact CD2-CZ 3.66Å; Y112-F117 HydrophobicContact CE2-CD2 4.19Å; Y112-F117 HydrophobicContact CE2-CE2 4.06Å; Y112-F117 HydrophobicContact CE2-CZ 4.36Å; Y112-F117 HydrophobicContact CG-CD1 4.28Å; Y112-F117 HydrophobicContact CG-CE1 4.19Å; Y112-F117 HydrophobicContact CG-CZ 4.49Å
118	G	78.3	Confident	81.9	Confident	7 Å²	7	51.8 Å²	51.8	7%	0.072	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-79.5	173.2	163.8	0	0	0	0	0	112.1	P35 A111	P35-G118 WeakPolarHBondContact O-CA 3.36Å; A111-G118 PolarHBondContact O-N 2.81Å
119	P	82.2	Confident	81.1	Confident	84 Å²	84	49.2 Å²	49.2	55%	0.545	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-59.6	147	177.4	24.8	-32.9	0	0	0	111.5	A37	A37-P119 VanDerWaalsContact CA-O 3.27Å; A37-P119 WeakPolarHBondContact CA-O 3.15Å; A37-P119 HydrophobicContact CB-CG 4.18Å; A37-P119 WeakPolarHBondContact CB-O 3.32Å
120	A	86.8	Confident	79.5	Confident	33 Å²	33	52.2 Å²	52.2	27%	0.273	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-65	154.6	175.4	0	0	0	0	0	112	R108 V109 S110	R108-A120 HydrophobicContact CG-CB 4.15Å; V109-A120 CarbonylContact O-C 3.59Å; V109-A120 WeakPolarHBondContact O-CA 3.33Å; S110-A120 WeakPolarHBondContact OG-CA 3.32Å; S110-A120 WeakPolarHBondContact OG-CB 3.45Å
121	S	89.1	Confident	78	Confident	6 Å²	6	57.3 Å²	57.3	4%	0.042	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-59.9	163.7	165.7	73.3	0	0	0	0	111.2	G39 P41 R108 V109	G39-S121 WeakPolarHBondContact O-CB 3.38Å; P41-S121 WeakPolarHBondContact CD-OG 3.34Å; R108-S121 WeakPolarHBondContact CA-OG 2.96Å; V109-S121 PolarHBondContact N-OG 2.59Å; V109-S121 PolarHBondContact O-N 3.46Å
122	N	86.3	Confident	76.1	Confident	123 Å²	123	59.1 Å²	59.1	66%	0.658	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-59.9	151.5	159.2	-64.8	-39	0	0	0	109.6	V40	V40-N122 HydrophobicContact CG2-CB 4.01Å
123	P	87.9	Confident	74	Confident	53 Å²	53	64.5 Å²	64.5	34%	0.344	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-60	150.3	174	-26.6	37.2	0	0	0	113.2	W81 F107	W81-P123 HydrophobicContact CH2-CB 3.87Å; W81-P123 HydrophobicContact CH2-CG 3.99Å; W81-P123 HydrophobicContact CZ2-CB 3.96Å; W81-P123 HydrophobicContact CZ2-CG 3.62Å; F107-P123 CarbonylContact O-C 3.59Å; F107-P123 WeakPolarHBondContact O-CA 2.97Å
124	S	88.3	Confident	72.3	Confident	4 Å²	4	69.7 Å²	69.7	3%	0.028	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-58.5	164.2	164.4	72.2	0	0	0	0	111.3	P41 Q106 F107	P41-S124 VanDerWaalsContact O-CB 3.28Å; P41-S124 WeakPolarHBondContact O-CB 3.28Å; Q106-S124 PolarHBondContact NE2-O 2.97Å; F107-S124 PolarHBondContact N-OG 3.41Å; F107-S124 PolarHBondContact O-N 3.36Å
125	L	83.4	Confident	70.9	Confident	150 Å²	150	69.4 Å²	69.4	79%	0.785	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-60	152	158.5	-64.6	177.5	0	0	0	109.9	V127	L125-V127 WeakPolarHBondContact O-CG2 3.4Å; L125-V127 PolarHBondContact O-N 2.98Å
126	P	81.9	Confident	69.8	Low	45 Å²	45	72.5 Å²	72.5	29%	0.292	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-59.2	134.4	174.5	-23.8	35	0	0	0	111.8	F76 E104 V105 Q106	F76-P126 HydrophobicContact CB-CB 4.39Å; F76-P126 HydrophobicContact CD1-CB 3.91Å; F76-P126 HydrophobicContact CD1-CG 3.95Å; F76-P126 HydrophobicContact CD2-CB 4.18Å; F76-P126 HydrophobicContact CD2-CG 3.68Å; F76-P126 HydrophobicContact CE1-CB 4.25Å; F76-P126 HydrophobicContact CE1-CG 3.87Å; F76-P126 HydrophobicContact CE2-CG 3.61Å; F76-P126 HydrophobicContact CG-CB 3.88Å; F76-P126 HydrophobicContact CG-CG 3.86Å; F76-P126 HydrophobicContact CZ-CG 3.71Å; E104-P126 HydrophobicContact CG-CB 3.8Å; V105-P126 CarbonylContact O-C 3.47Å; V105-P126 WeakPolarHBondContact O-CA 3.46Å; Q106-P126 HydrophobicContact CG-CB 4.39Å; Q106-P126 HydrophobicContact CG-CG 4.18Å
127	V	81.3	Confident	68.1	Low	13 Å²	13	76.2 Å²	76.2	8%	0.079	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	113.2	-171	-166.2	0	0	0	0	108.9	V43 V51 E104 V105 F107 L125	V43-V127 HydrophobicContact CG1-CG1 4.27Å; V43-V127 HydrophobicContact CG2-CB 4.3Å; V43-V127 HydrophobicContact CG2-CG1 3.83Å; V43-V127 HydrophobicContact CG2-CG2 3.45Å; V43-V127 VanDerWaalsContact CG2-CG2 3.45Å; V51-V127 HydrophobicContact CG1-CG1 4.16Å; V51-V127 HydrophobicContact CG2-CG1 4.07Å; E104-V127 WeakPolarHBondContact CA-O 3.42Å; V105-V127 HydrophobicContact CG2-CB 4.11Å; V105-V127 PolarHBondContact N-O 2.74Å; V105-V127 PolarHBondContact O-N 2.75Å; F107-V127 HydrophobicContact CD2-CG2 4.15Å; F107-V127 HydrophobicContact CE2-CG2 4.06Å; L125-V127 WeakPolarHBondContact O-CG2 3.4Å; L125-V127 PolarHBondContact O-N 2.98Å
128	K	77.9	Confident	66.2	Low	126 Å²	126	77 Å²	77	55%	0.548	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	123.7	176.1	-69.1	-175.1	176.1	-175.2	0	110.6	H103 E104	H103-K128 WeakPolarHBondContact O-CA 3.11Å; E104-K128 HydrophobicContact CB-CG 4.37Å; E104-K128 HydrophobicContact CG-CG 3.93Å; E104-K128 WeakPolarHBondContact OE1-CE 3.27Å; E104-K128 IonicContact OE1-NZ 3.6Å; E104-K128 WeakPolarHBondContact OE2-CE 3.35Å; E104-K128 IonicContact OE2-NZ 3.95Å
129	I	74.1	Confident	64.7	Low	8 Å²	8	81 Å²	81	4%	0.041	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-94.5	124.8	-178	-65.7	148.3	0	0	0	108.7	V51 L100 S102 H103 V105 I131	V51-I129 HydrophobicContact CG2-CG1 4.01Å; L100-I129 HydrophobicContact CB-CD1 3.68Å; L100-I129 HydrophobicContact CD1-CD1 3.8Å; L100-I129 HydrophobicContact CD1-CG1 4.13Å; L100-I129 HydrophobicContact CG-CD1 4.36Å; S102-I129 WeakPolarHBondContact O-CD1 3.36Å; H103-I129 PolarHBondContact O-N 3.14Å; V105-I129 HydrophobicContact CB-CD1 4.45Å; V105-I129 HydrophobicContact CG1-CD1 3.87Å; V105-I129 HydrophobicContact CG2-CD1 3.73Å; V105-I129 HydrophobicContact CG2-CG1 4.49Å; I129-I131 PolarHBondContact O-N 3Å
130	P	55.7	Low	63.2	Low	62 Å²	62	81.8 Å²	81.8	40%	0.403	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-61.8	126.2	174.4	-22.2	33.5	0	0	0	111.3	I48	I48-P130 WeakPolarHBondContact CA-O 3.35Å; I48-P130 HydrophobicContact CG1-CB 4.16Å
131	I	54.7	Low	61.7	Low	117 Å²	117	81.1 Å²	81.1	60%	0.6	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-98.7	144.1	172	-38.8	178.1	0	0	0	108.4	H103 I129 E133	H103-I131 HydrophobicContact CB-CD1 4.46Å; I129-I131 PolarHBondContact O-N 3Å; I131-E133 PolarHBondContact O-N 2.98Å
132	S	43.4	Very low	60.5	Low	38 Å²	38	82 Å²	82	27%	0.266	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-72.4	123.5	176.9	-169.5	0	0	0	0	111.2	T134 D135	S132-T134 PolarHBondContact O-N 2.79Å; S132-T134 PolarHBondContact OG-OG1 2.98Å; S132-D135 PolarHBondContact O-N 2.78Å
133	E	40.8	Very low	59.8	Low	178 Å²	178	76.3 Å²	76.3	83%	0.832	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-64.1	-10.1	177.3	-64.1	-173.8	133.1	0	0	113.4	I131 D135	I131-E133 PolarHBondContact O-N 2.98Å; E133-D135 VanDerWaalsContact C-N 3.33Å; E133-D135 PolarHBondContact O-N 2.92Å
134	T	41.7	Very low	59.1	Low	109 Å²	109	77.9 Å²	77.9	67%	0.669	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-70.3	-23	-178.6	-22.3	0	0	0	0	113.9	S132	S132-T134 PolarHBondContact O-N 2.79Å; S132-T134 PolarHBondContact OG-OG1 2.98Å
135	D	41.3	Very low	58.4	Low	118 Å²	118	79.7 Å²	79.7	63%	0.631	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-85.9	-8	-174.2	-69.6	-48.3	0	0	0	114.3	S132 E133 A137	S132-D135 PolarHBondContact O-N 2.78Å; E133-D135 VanDerWaalsContact C-N 3.33Å; E133-D135 PolarHBondContact O-N 2.92Å; D135-A137 PolarHBondContact O-N 2.68Å
136	L	39	Very low	58.4	Low	148 Å²	148	73 Å²	73	78%	0.775	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-71.9	3.2	-177.6	-84.1	166.1	0	0	0	115.2
137	A	36.8	Very low	58.1	Low	92 Å²	92	71.6 Å²	71.6	76%	0.76	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-105.1	-2.1	-169.7	0	0	0	0	0	115.8	D135	D135-A137 PolarHBondContact O-N 2.68Å
138	T	40	Very low	58	Low	104 Å²	104	78 Å²	78	64%	0.638	46%	0.458	S	S	*	.	S	Bend	trans	-123	-6.3	-164	-37.8	0	0	0	0	115.1	A140	T138-A140 PolarHBondContact O-N 2.89Å
139	S	45.5	Very low	58.3	Low	90 Å²	90	72.1 Å²	72.1	63%	0.629	43%	0.433	S	S	*	.			trans	-102.8	62	-171.6	67.1	0	0	0	0	114.4
140	A	51.4	Low	58.7	Low	101 Å²	101	75.4 Å²	75.4	84%	0.835	45%	0.453	S	S	*	.	S	Bend	trans	-136	59.6	173.2	0	0	0	0	0	112	T138	T138-A140 PolarHBondContact O-N 2.89Å
141	G	56	Low	60	Low	18 Å²	18	75.1 Å²	75.1	19%	0.186	45%	0.45	C	S	.	.	S	Bend	trans	148	-28.6	174.6	0	0	0	0	0	114.6	N222	G141-N222 PolarHBondContact O-ND2 3.15Å
142	A	63.1	Low	61.2	Low	24 Å²	24	73.8 Å²	73.8	20%	0.198	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-61.6	154.1	-178.9	0	0	0	0	0	113.1
143	P	72.1	Confident	62.3	Low	4 Å²	4	74.3 Å²	74.3	3%	0.026	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-67.9	150.7	-175	-20.1	34.7	0	0	0	112.9	P175 N222 G227	P143-P175 HydrophobicContact CB-CB 4.3Å; P143-P175 HydrophobicContact CG-CB 4.11Å; P143-N222 VanDerWaalsContact CD-CG 3.49Å; P143-N222 WeakPolarHBondContact CD-ND2 3.43Å; P143-N222 HydrophobicContact CG-CB 3.81Å; P143-G227 WeakPolarHBondContact O-CA 3.22Å
144	L	72.9	Confident	63.6	Low	86 Å²	86	68.7 Å²	68.7	45%	0.45	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-63.8	158.4	165.4	-66	173.7	0	0	0	110.9	P166	L144-P166 HydrophobicContact CB-CB 4.01Å; L144-P166 WeakPolarHBondContact O-CB 3.43Å
145	A	73.3	Confident	64.4	Low	43 Å²	43	67.5 Å²	67.5	36%	0.355	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-60.3	133.1	179.2	0	0	0	0	0	111.2	H228	A145-H228 WeakPolarHBondContact CA-O 3.4Å; A145-H228 HydrophobicContact CB-CB 4.4Å
146	P	83.4	Confident	65.2	Low	9 Å²	9	62.5 Å²	62.5	6%	0.058	39%	0.393	C	S	.	.			trans	-62.4	174.5	171.9	-21.4	33.4	0	0	0	112.8	Y178 V218 S230	P146-Y178 HydrophobicContact CB-CE1 4.32Å; P146-Y178 HydrophobicContact CG-CD1 3.9Å; P146-Y178 HydrophobicContact CG-CE1 3.91Å; P146-V218 HydrophobicContact CB-CB 4.45Å; P146-V218 WeakPolarHBondContact CD-O 3.45Å; P146-V218 HydrophobicContact CG-CB 4.37Å; P146-V218 HydrophobicContact CG-CG1 4.23Å; P146-S230 WeakPolarHBondContact O-CB 3.18Å
147	G	74.9	Confident	65.8	Low	15 Å²	15	61.7 Å²	61.7	16%	0.155	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-60.1	157.9	166.9	0	0	0	0	0	112.9	T164 S230	G147-T164 WeakPolarHBondContact CA-OG1 2.93Å; G147-T164 PolarHBondContact N-O 2.69Å; G147-S230 WeakPolarHBondContact O-CB 3.16Å; G147-S230 PolarHBondContact O-OG 2.9Å
148	R	80.8	Confident	67.3	Low	148 Å²	148	57.4 Å²	57.4	56%	0.558	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-57.6	127.4	167.5	178.7	176.3	-178.5	-175.3	-3.5	108.9	M231 S232 S233	R148-M231 HydrophobicContact CB-CB 4.47Å; R148-S232 WeakPolarHBondContact CD-O 3.2Å; R148-S232 WeakPolarHBondContact CG-O 3.29Å; R148-S232 PolarHBondContact NE-O 2.93Å; R148-S233 PolarHBondContact NH2-O 2.85Å
149	P	84.3	Confident	69.1	Low	3 Å²	3	52.4 Å²	52.4	2%	0.019	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-69.3	134.3	178.3	27.8	-32.2	0	0	0	110.8	E162 W163 F216 V218 M231	P149-E162 CarbonylContact C-O 3.52Å; P149-E162 WeakPolarHBondContact CA-O 3.45Å; P149-W163 HydrophobicContact CB-CB 4.4Å; P149-F216 HydrophobicContact CG-CB 4.29Å; P149-F216 WeakPolarHBondContact CG-O 3.37Å; P149-V218 HydrophobicContact CB-CG2 3.96Å; P149-V218 HydrophobicContact CG-CG2 4.1Å; P149-M231 WeakPolarHBondContact CD-O 3.34Å
150	T	81.4	Confident	70.9	Confident	76 Å²	76	50.6 Å²	50.6	47%	0.466	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	140.1	175	55.3	0	0	0	0	110.2	L161 E162	T150-L161 WeakPolarHBondContact O-CA 3.33Å; T150-E162 PolarHBondContact N-O 2.76Å; T150-E162 PolarHBondContact O-N 2.79Å; T150-E162 PolarHBondContact OG1-O 2.84Å
151	V	82.6	Confident	72.6	Confident	56 Å²	56	45.8 Å²	45.8	34%	0.339	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	122	176.5	176.3	0	0	0	0	109.4	V154 V159 L161 V236	V151-V154 HydrophobicContact CG1-CG2 3.54Å; V151-V159 HydrophobicContact CG1-CG1 3.93Å; V151-V159 HydrophobicContact CG2-CG1 4Å; V151-L161 HydrophobicContact CG2-CD2 3.91Å; V151-V236 HydrophobicContact CG1-CG1 4.47Å; V151-V236 HydrophobicContact CG2-CB 4.42Å; V151-V236 HydrophobicContact CG2-CG1 3.92Å; V151-V236 HydrophobicContact CG2-CG2 3.57Å
152	I	80.2	Confident	74.1	Confident	90 Å²	90	49.6 Å²	49.6	46%	0.462	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-39.5	178.7	-56.3	-54.3	0	0	0	110.9	L160 E162	I152-L160 HydrophobicContact CB-CD2 4.07Å; I152-L160 HydrophobicContact CB-CG 4.14Å; I152-L160 HydrophobicContact CG2-CD2 3.95Å; I152-L160 PolarHBondContact N-O 3.37Å; I152-E162 HydrophobicContact CD1-CB 3.93Å; I152-E162 HydrophobicContact CG1-CB 3.64Å
153	A	66.4	Low	75.4	Confident	48 Å²	48	48.8 Å²	48.8	40%	0.397	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	155.4	174.9	0	0	0	0	0	111.3	L160	A153-L160 HydrophobicContact CB-CB 4.04Å; A153-L160 HydrophobicContact CB-CD2 4.33Å; A153-L160 PolarHBondContact N-O 3.13Å; A153-L160 PolarHBondContact O-N 3.36Å
154	V	68.5	Low	76	Confident	61 Å²	61	53 Å²	53	37%	0.37	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	126.4	171	-176.6	0	0	0	0	106.9	V151 V159 V236 I238	V151-V154 HydrophobicContact CG1-CG2 3.54Å; V154-V159 HydrophobicContact CG1-CG2 4.21Å; V154-V159 HydrophobicContact CG2-CG1 4.49Å; V154-V159 HydrophobicContact CG2-CG2 4.22Å; V154-V236 HydrophobicContact CG2-CG1 4.09Å; V154-I238 HydrophobicContact CG1-CD1 4.19Å
155	D	58.3	Low	76.4	Confident	83 Å²	83	52.3 Å²	52.3	44%	0.444	29%	0.294	S	S	.	.			trans	-107.6	-173.1	167.8	70.3	61	0	0	0	110.3	Q157 G158	D155-Q157 PolarHBondContact O-N 2.97Å; D155-Q157 PolarHBondContact OD1-N 2.95Å; D155-G158 PolarHBondContact N-O 2.97Å; D155-G158 PolarHBondContact OD1-N 2.66Å
156	G	57.2	Low	76.4	Confident	13 Å²	13	51.3 Å²	51.3	13%	0.134	28%	0.284	C	S	.	.	S	Bend	trans	-67.9	-14.4	-175.4	0	0	0	0	0	115.2
157	Q	52.5	Low	75.4	Confident	132 Å²	132	57.3 Å²	57.3	62%	0.617	32%	0.32	S	S	*	.	S	Bend	trans	-140.7	-1.8	-174.1	-63.7	-175.7	-15.9	0	0	113.8	D155 E206 S207 L208	D155-Q157 PolarHBondContact O-N 2.97Å; D155-Q157 PolarHBondContact OD1-N 2.95Å; Q157-E206 CarbonylContact O-C 3.5Å; Q157-S207 PolarHBondContact O-N 2.98Å; Q157-L208 PolarHBondContact O-N 2.82Å
158	G	67.4	Low	74.5	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.01	34%	0.339	C	S	.	.			trans	-151.8	168	-179.7	0	0	0	0	0	116.2	D155 V205	D155-G158 PolarHBondContact N-O 2.97Å; D155-G158 PolarHBondContact OD1-N 2.66Å; G158-V205 CarbonylContact C-O 3.42Å; G158-V205 WeakPolarHBondContact CA-O 3.15Å
159	V	78.2	Confident	73.3	Confident	0 Å²	0	57 Å²	57	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	123.8	-179.7	178	0	0	0	0	110.5	V151 V154 L161 T204 V205 L208 F216 V236 I238	V151-V159 HydrophobicContact CG1-CG1 3.93Å; V151-V159 HydrophobicContact CG2-CG1 4Å; V154-V159 HydrophobicContact CG1-CG2 4.21Å; V154-V159 HydrophobicContact CG2-CG1 4.49Å; V154-V159 HydrophobicContact CG2-CG2 4.22Å; V159-L161 HydrophobicContact CG1-CD2 3.64Å; V159-L161 HydrophobicContact CG1-CG 4.09Å; V159-T204 CarbonylContact O-C 3.6Å; V159-T204 WeakPolarHBondContact O-CA 3.4Å; V159-V205 PolarHBondContact N-O 2.97Å; V159-V205 PolarHBondContact O-N 3.11Å; V159-L208 HydrophobicContact CB-CD1 4.18Å; V159-L208 HydrophobicContact CG2-CD1 3.73Å; V159-F216 HydrophobicContact CB-CE2 4.17Å; V159-F216 HydrophobicContact CB-CZ 3.91Å; V159-F216 HydrophobicContact CG1-CE2 3.93Å; V159-F216 HydrophobicContact CG1-CZ 4.16Å; V159-F216 HydrophobicContact CG2-CE2 4.05Å; V159-F216 HydrophobicContact CG2-CZ 3.8Å; V159-V236 HydrophobicContact CG2-CG1 4.27Å; V159-I238 HydrophobicContact CG2-CD1 3.26Å
160	L	83.5	Confident	71.7	Confident	51 Å²	51	63.4 Å²	63.4	27%	0.267	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	121	171.1	-177.6	66.3	0	0	0	110	I152 A153 V202 T204	I152-L160 HydrophobicContact CB-CD2 4.07Å; I152-L160 HydrophobicContact CB-CG 4.14Å; I152-L160 HydrophobicContact CG2-CD2 3.95Å; I152-L160 PolarHBondContact N-O 3.37Å; A153-L160 HydrophobicContact CB-CB 4.04Å; A153-L160 HydrophobicContact CB-CD2 4.33Å; A153-L160 PolarHBondContact N-O 3.13Å; A153-L160 PolarHBondContact O-N 3.36Å; L160-V202 HydrophobicContact CD1-CG2 3.74Å; L160-V202 HydrophobicContact CG-CG2 4.35Å; L160-T204 WeakPolarHBondContact CD1-OG1 3.14Å
161	L	87.5	Confident	70.4	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	143.7	-178.7	-59.3	172.7	0	0	0	111.3	T150 V151 V159 W163 V180 V202 F203 V205 F216	T150-L161 WeakPolarHBondContact O-CA 3.33Å; V151-L161 HydrophobicContact CG2-CD2 3.91Å; V159-L161 HydrophobicContact CG1-CD2 3.64Å; V159-L161 HydrophobicContact CG1-CG 4.09Å; L161-W163 HydrophobicContact CB-CE3 4.45Å; L161-W163 HydrophobicContact CB-CZ3 4.35Å; L161-V180 HydrophobicContact CD1-CG1 3.93Å; L161-V202 CarbonylContact O-C 3.45Å; L161-V202 VanDerWaalsContact O-CA 3.23Å; L161-V202 WeakPolarHBondContact O-CA 3.41Å; L161-V202 VanDerWaalsContact O-CG2 3.28Å; L161-V202 WeakPolarHBondContact O-CG2 3.08Å; L161-F203 PolarHBondContact N-O 2.82Å; L161-F203 PolarHBondContact O-N 2.76Å; L161-V205 HydrophobicContact CD1-CG2 3.77Å; L161-F216 HydrophobicContact CD1-CB 3.6Å; L161-F216 HydrophobicContact CD1-CD1 3.74Å; L161-F216 HydrophobicContact CD1-CD2 4.35Å; L161-F216 HydrophobicContact CD1-CG 3.63Å; L161-F216 HydrophobicContact CD2-CB 4.17Å; L161-F216 HydrophobicContact CD2-CD2 3.88Å; L161-F216 HydrophobicContact CD2-CE2 4.49Å; L161-F216 HydrophobicContact CD2-CG 3.99Å; L161-F216 HydrophobicContact CG-CG 4.4Å
162	E	88.3	Confident	69.2	Low	99 Å²	99	66 Å²	66	46%	0.463	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	144.2	168.7	-174.9	177.6	-157.7	0	0	109.6	P149 T150 I152 N201	P149-E162 CarbonylContact C-O 3.52Å; P149-E162 WeakPolarHBondContact CA-O 3.45Å; T150-E162 PolarHBondContact N-O 2.76Å; T150-E162 PolarHBondContact O-N 2.79Å; T150-E162 PolarHBondContact OG1-O 2.84Å; I152-E162 HydrophobicContact CD1-CB 3.93Å; I152-E162 HydrophobicContact CG1-CB 3.64Å; E162-N201 WeakPolarHBondContact CA-O 3.46Å
163	W	89.7	Confident	68.3	Low	7 Å²	7	64 Å²	64	3%	0.027	37%	0.374	C	S	.	.			trans	-143.5	149.7	177.8	59.2	90.1	0	0	0	111.4	P149 L161 Y178 V180 V198 E200 N201 F203 V218	P149-W163 HydrophobicContact CB-CB 4.4Å; L161-W163 HydrophobicContact CB-CE3 4.45Å; L161-W163 HydrophobicContact CB-CZ3 4.35Å; W163-Y178 AromaticContact CE2-CD2 3.88Å; W163-Y178 AromaticContact CE2-CG 3.9Å; W163-Y178 AromaticContact CZ2-CD2 3.7Å; W163-Y178 HydrophobicContact CZ2-CD2 3.7Å; W163-Y178 AromaticContact CZ2-CG 3.82Å; W163-Y178 HydrophobicContact CZ2-CG 3.82Å; W163-Y178 AromaticContact NE1-CD1 3.55Å; W163-Y178 AromaticContact NE1-CD2 3.43Å; W163-Y178 AromaticContact NE1-CE1 3.69Å; W163-Y178 AromaticContact NE1-CE2 3.57Å; W163-Y178 AromaticContact NE1-CG 3.43Å; W163-Y178 AromaticContact NE1-CZ 3.71Å; W163-V180 HydrophobicContact CH2-CG2 3.58Å; W163-V180 HydrophobicContact CZ2-CG2 4.3Å; W163-V180 HydrophobicContact CZ3-CG2 3.85Å; W163-V198 HydrophobicContact CH2-CB 4.36Å; W163-V198 HydrophobicContact CH2-CG1 4.21Å; W163-V198 HydrophobicContact CH2-CG2 4.47Å; W163-V198 HydrophobicContact CZ2-CB 4.38Å; W163-V198 HydrophobicContact CZ2-CG1 4.4Å; W163-E200 WeakPolarHBondContact CZ2-O 3.34Å; W163-N201 VanDerWaalsContact CD1-ND2 3.29Å; W163-N201 PolarHBondContact N-O 2.93Å; W163-N201 PolarHBondContact NE1-ND2 3.4Å; W163-N201 WeakPolarHBondContact O-CB 3.31Å; W163-N201 PolarHBondContact O-ND2 2.74Å; W163-F203 HydrophobicContact CH2-CB 3.66Å; W163-F203 HydrophobicContact CZ3-CB 3.81Å; W163-V218 HydrophobicContact CB-CG2 4.44Å; W163-V218 HydrophobicContact CD2-CB 4.38Å; W163-V218 HydrophobicContact CD2-CG1 4.02Å; W163-V218 HydrophobicContact CD2-CG2 3.8Å; W163-V218 HydrophobicContact CE3-CG2 3.82Å; W163-V218 HydrophobicContact CG-CB 4.4Å; W163-V218 HydrophobicContact CG-CG1 4.29Å; W163-V218 HydrophobicContact CG-CG2 4.07Å; W163-V218 HydrophobicContact CZ2-CG1 4.12Å; W163-V218 HydrophobicContact CZ3-CG2 4.38Å
164	T	85.4	Confident	68.5	Low	92 Å²	92	66.4 Å²	66.4	56%	0.564	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-75.9	145.7	173.4	52.3	0	0	0	0	111.8	G147	G147-T164 WeakPolarHBondContact CA-OG1 2.93Å; G147-T164 PolarHBondContact N-O 2.69Å
165	P	79.9	Confident	69	Low	71 Å²	71	65 Å²	65	46%	0.461	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-66.6	153	172.3	29.8	-35.7	0	0	0	110.8	Y178	P165-Y178 WeakPolarHBondContact CA-OH 3.09Å; P165-Y178 WeakPolarHBondContact CB-OH 3.38Å
166	P	74.5	Confident	70.2	Confident	23 Å²	23	66.6 Å²	66.6	15%	0.149	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-61.8	137.2	174.5	25.3	-33.2	0	0	0	111.3	L144 A168 P175	L144-P166 HydrophobicContact CB-CB 4.01Å; L144-P166 WeakPolarHBondContact O-CB 3.43Å; P166-A168 PolarHBondContact O-N 2.77Å; P166-P175 HydrophobicContact CG-CG 3.99Å
167	V	62.7	Low	71.4	Confident	135 Å²	135	66 Å²	66	82%	0.818	38%	0.377	S	S	*	.			trans	-74.5	114.9	174	-177.2	0	0	0	0	108.4	D169	V167-D169 PolarHBondContact O-N 3.5Å
168	A	55.4	Low	73	Confident	68 Å²	68	60.2 Å²	60.2	56%	0.562	35%	0.349	S	S	*	.			trans	-72.1	126.9	-175.9	0	0	0	0	0	112.2	P166	P166-A168 PolarHBondContact O-N 2.77Å
169	D	54.7	Low	74	Confident	89 Å²	89	61.6 Å²	61.6	48%	0.476	36%	0.355	S	S	.	.			trans	-79	159.4	156.3	177.8	49	0	0	0	109.9	V167 H171 S172	V167-D169 PolarHBondContact O-N 3.5Å; D169-H171 PolarHBondContact O-N 2.91Å; D169-H171 IonicContact OD2-CG 2.89Å; D169-H171 PolarHBondContact OD2-N 2.92Å; D169-H171 IonicContact OD2-ND1 3.27Å; D169-H171 PolarHBondContact OD2-ND1 2.79Å; D169-S172 PolarHBondContact N-OG 2.86Å; D169-S172 VanDerWaalsContact N-OG 3.15Å; D169-S172 PolarHBondContact O-N 2.94Å; D169-S172 PolarHBondContact O-OG 3.33Å; D169-S172 VanDerWaalsContact O-OG 3.07Å
170	V	52.3	Low	74.4	Confident	136 Å²	136	61.6 Å²	61.6	82%	0.824	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-20.1	178.2	-174.1	0	0	0	0	113.1
171	H	52.8	Low	74.2	Confident	161 Å²	161	59.5 Å²	59.5	75%	0.745	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	0.9	-178.8	-53.3	89.2	0	0	0	115.1	D169	D169-H171 PolarHBondContact O-N 2.91Å; D169-H171 IonicContact OD2-CG 2.89Å; D169-H171 PolarHBondContact OD2-N 2.92Å; D169-H171 IonicContact OD2-ND1 3.27Å; D169-H171 PolarHBondContact OD2-ND1 2.79Å
172	S	58.5	Low	73.9	Confident	27 Å²	27	61.7 Å²	61.7	19%	0.189	35%	0.352	C	S	.	.			trans	-112.7	125.5	-176	61.5	0	0	0	0	113.3	D169	D169-S172 PolarHBondContact N-OG 2.86Å; D169-S172 VanDerWaalsContact N-OG 3.15Å; D169-S172 PolarHBondContact O-N 2.94Å; D169-S172 PolarHBondContact O-OG 3.33Å; D169-S172 VanDerWaalsContact O-OG 3.07Å
173	S	61.2	Low	73.1	Confident	48 Å²	48	58.3 Å²	58.3	34%	0.336	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-75.2	132	175.6	-65.5	0	0	0	0	111.1	N222	S173-N222 WeakPolarHBondContact CB-ND2 3.25Å; S173-N222 PolarHBondContact O-ND2 3.4Å
174	P	69.3	Low	71.6	Confident	97 Å²	97	61.6 Å²	61.6	63%	0.63	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-63.3	155.8	-177.8	26.7	-35.2	0	0	0	112.7	N222	P174-N222 WeakPolarHBondContact O-CB 3.35Å
175	P	80.3	Confident	70.2	Confident	31 Å²	31	62.5 Å²	62.5	20%	0.201	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-64.7	140.2	175.6	27.9	-34	0	0	0	111.4	P143 P166 G177 Y178 K221	P143-P175 HydrophobicContact CB-CB 4.3Å; P143-P175 HydrophobicContact CG-CB 4.11Å; P166-P175 HydrophobicContact CG-CG 3.99Å; P175-G177 VanDerWaalsContact C-N 3.32Å; P175-Y178 HydrophobicContact CB-CE1 4.16Å; P175-Y178 HydrophobicContact CG-CE1 3.82Å; P175-K221 CarbonylContact C-O 3.6Å; P175-K221 WeakPolarHBondContact CA-O 3.47Å
176	Q	83.4	Confident	68.6	Low	117 Å²	117	62.2 Å²	62.2	55%	0.547	36%	0.361	S	S	.	.	S	Bend	trans	-84.4	-13	168.6	-67	172.6	-17.4	0	0	111.8	K221 N222	Q176-K221 PolarHBondContact N-O 3.45Å; Q176-N222 HydrophobicContact CG-CB 4.33Å
177	G	82.1	Confident	67.4	Low	2 Å²	2	63.4 Å²	63.4	2%	0.021	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.2	179.9	172.3	0	0	0	0	0	111	P175 V198 K221	P175-G177 VanDerWaalsContact C-N 3.32Å; G177-V198 CarbonylContact C-O 3.59Å; G177-V198 WeakPolarHBondContact CA-O 3.22Å; G177-K221 PolarHBondContact N-O 3.34Å; G177-K221 PolarHBondContact O-N 3.05Å
178	Y	86.8	Confident	66.6	Low	9 Å²	9	64.7 Å²	64.7	4%	0.035	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	146.8	-173	-57.4	-78.1	0	0	0	112.7	P146 W163 P165 P175 N194 L197 V198 E200 V218 R219	P146-Y178 HydrophobicContact CB-CE1 4.32Å; P146-Y178 HydrophobicContact CG-CD1 3.9Å; P146-Y178 HydrophobicContact CG-CE1 3.91Å; W163-Y178 AromaticContact CE2-CD2 3.88Å; W163-Y178 AromaticContact CE2-CG 3.9Å; W163-Y178 AromaticContact CZ2-CD2 3.7Å; W163-Y178 HydrophobicContact CZ2-CD2 3.7Å; W163-Y178 AromaticContact CZ2-CG 3.82Å; W163-Y178 HydrophobicContact CZ2-CG 3.82Å; W163-Y178 AromaticContact NE1-CD1 3.55Å; W163-Y178 AromaticContact NE1-CD2 3.43Å; W163-Y178 AromaticContact NE1-CE1 3.69Å; W163-Y178 AromaticContact NE1-CE2 3.57Å; W163-Y178 AromaticContact NE1-CG 3.43Å; W163-Y178 AromaticContact NE1-CZ 3.71Å; P165-Y178 WeakPolarHBondContact CA-OH 3.09Å; P165-Y178 WeakPolarHBondContact CB-OH 3.38Å; P175-Y178 HydrophobicContact CB-CE1 4.16Å; P175-Y178 HydrophobicContact CG-CE1 3.82Å; Y178-N194 PolarHBondContact O-ND2 3.45Å; Y178-L197 WeakPolarHBondContact O-CA 3.35Å; Y178-V198 WeakPolarHBondContact CD2-O 3.19Å; Y178-V198 PolarHBondContact N-O 2.94Å; Y178-V198 PolarHBondContact O-N 3.11Å; Y178-E200 WeakPolarHBondContact CD2-O 3.34Å; Y178-V218 HydrophobicContact CD1-CG1 3.99Å; Y178-V218 HydrophobicContact CG-CG1 4.12Å; Y178-R219 CarbonylContact C-O 3.57Å; Y178-R219 WeakPolarHBondContact CA-O 3.32Å
179	Q	87.1	Confident	66.4	Low	31 Å²	31	67.3 Å²	67.3	15%	0.145	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	114.2	167.8	-173.2	174	-60.7	0	0	107.4	E181 V192 L197 V218 R219 L226	Q179-E181 HydrophobicContact CG-CG 4.46Å; Q179-E181 PolarHBondContact NE2-OE1 2.93Å; Q179-V192 HydrophobicContact CG-CG1 3.74Å; Q179-V192 HydrophobicContact CG-CG2 4.19Å; Q179-L197 HydrophobicContact CB-CD2 4.39Å; Q179-V218 WeakPolarHBondContact O-CA 3.4Å; Q179-R219 HydrophobicContact CB-CB 4.37Å; Q179-R219 PolarHBondContact N-O 3.27Å; Q179-R219 PolarHBondContact O-N 2.99Å; Q179-L226 HydrophobicContact CB-CD1 4Å
180	V	86	Confident	67	Low	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	133.1	175.5	-178.6	0	0	0	0	107.4	L161 W163 A193 N194 V198 F203 V205 V218	L161-V180 HydrophobicContact CD1-CG1 3.93Å; W163-V180 HydrophobicContact CH2-CG2 3.58Å; W163-V180 HydrophobicContact CZ2-CG2 4.3Å; W163-V180 HydrophobicContact CZ3-CG2 3.85Å; V180-A193 HydrophobicContact CB-CB 4.18Å; V180-A193 HydrophobicContact CG1-CB 4.07Å; V180-A193 PolarHBondContact O-N 3.47Å; V180-N194 PolarHBondContact N-OD1 3.1Å; V180-N194 PolarHBondContact O-OD1 3.01Å; V180-V198 HydrophobicContact CG2-CG2 4.2Å; V180-F203 HydrophobicContact CB-CD1 4.15Å; V180-F203 HydrophobicContact CG1-CD1 4.22Å; V180-F203 HydrophobicContact CG2-CB 4.17Å; V180-F203 HydrophobicContact CG2-CD1 4.02Å; V180-F203 HydrophobicContact CG2-CG 4.26Å; V180-V205 HydrophobicContact CG1-CG2 3.97Å; V180-V218 HydrophobicContact CG2-CG1 4.34Å; V180-V218 HydrophobicContact CG2-CG2 4.37Å
181	E	80.3	Confident	67.5	Low	7 Å²	7	63.2 Å²	63.2	3%	0.033	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	143	-179.3	-73.8	169.9	-167.6	0	0	109.6	Q179 W190 I191 V192 F216 R217 R219	Q179-E181 HydrophobicContact CG-CG 4.46Å; Q179-E181 PolarHBondContact NE2-OE1 2.93Å; E181-W190 HydrophobicContact CB-CB 4.37Å; E181-W190 HydrophobicContact CB-CE3 4.09Å; E181-I191 CarbonylContact C-O 3.48Å; E181-I191 VanDerWaalsContact CA-O 3.22Å; E181-I191 WeakPolarHBondContact CA-O 3.12Å; E181-V192 HydrophobicContact CG-CG2 4.04Å; E181-F216 CarbonylContact O-C 3.57Å; E181-F216 WeakPolarHBondContact O-CA 3.42Å; E181-R217 HydrophobicContact CB-CG 3.89Å; E181-R217 PolarHBondContact N-O 3.38Å; E181-R217 PolarHBondContact O-N 2.78Å; E181-R217 IonicContact OE2-CZ 3.76Å; E181-R217 IonicContact OE2-NE 3.92Å; E181-R217 PolarHBondContact OE2-NE 2.93Å; E181-R217 IonicContact OE2-NH2 2.99Å; E181-R217 PolarHBondContact OE2-NH2 2.83Å; E181-R219 WeakPolarHBondContact OE1-CD 3.47Å; E181-R219 IonicContact OE1-NH1 3.17Å
182	Y	80.9	Confident	68.7	Low	45 Å²	45	58.6 Å²	58.6	18%	0.176	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	157.4	179.7	78.8	-77	0	0	0	112	I191 A193 V205 L208 Y214 E215 F216	Y182-I191 HydrophobicContact CD1-CB 4.03Å; Y182-I191 HydrophobicContact CD1-CG2 4.29Å; Y182-I191 WeakPolarHBondContact CD1-O 3.29Å; Y182-I191 HydrophobicContact CE1-CB 3.75Å; Y182-I191 HydrophobicContact CE1-CG2 3.57Å; Y182-I191 HydrophobicContact CE2-CD1 4.39Å; Y182-I191 PolarHBondContact N-O 3.34Å; Y182-I191 PolarHBondContact O-N 2.87Å; Y182-A193 HydrophobicContact CD1-CB 3.9Å; Y182-A193 HydrophobicContact CE1-CB 4.37Å; Y182-V205 HydrophobicContact CD1-CG1 4.14Å; Y182-V205 HydrophobicContact CE1-CG1 4.45Å; Y182-V205 HydrophobicContact CG-CG1 4.26Å; Y182-L208 HydrophobicContact CD2-CD2 3.56Å; Y182-L208 HydrophobicContact CE2-CD2 3.4Å; Y182-L208 VanDerWaalsContact CE2-CD2 3.4Å; Y182-L208 HydrophobicContact CG-CD2 4.42Å; Y182-Y214 AromaticContact CD2-CD1 3.78Å; Y182-Y214 HydrophobicContact CD2-CD1 3.78Å; Y182-Y214 HydrophobicContact CD2-CE1 4.06Å; Y182-Y214 HydrophobicContact CE2-CD1 4.2Å; Y182-Y214 AromaticContact CE2-CE1 3.99Å; Y182-Y214 HydrophobicContact CE2-CE1 3.99Å; Y182-E215 CarbonylContact C-O 3.59Å; Y182-E215 WeakPolarHBondContact CA-O 3.22Å; Y182-F216 VanDerWaalsContact CB-CD1 3.42Å; Y182-F216 HydrophobicContact CG-CE1 4.36Å
183	R	71	Confident	69.4	Low	28 Å²	28	58.7 Å²	58.7	11%	0.106	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	156.3	171.9	66.3	172.1	-179	-170	-2.4	111.4	S187 D189 W190 Y214 E215	R183-S187 VanDerWaalsContact CD-O 3.26Å; R183-S187 WeakPolarHBondContact CD-O 3.38Å; R183-S187 VanDerWaalsContact CZ-O 3.28Å; R183-S187 PolarHBondContact NE-O 3.07Å; R183-S187 PolarHBondContact NH1-O 2.95Å; R183-D189 WeakPolarHBondContact CB-O 3.39Å; R183-W190 HydrophobicContact CB-CD2 4.28Å; R183-W190 HydrophobicContact CB-CE3 4.21Å; R183-W190 VanDerWaalsContact CD-CE2 3.47Å; R183-W190 HydrophobicContact CG-CD2 3.99Å; R183-W190 HydrophobicContact CG-CE3 3.96Å; R183-W190 HydrophobicContact CG-CH2 3.97Å; R183-W190 HydrophobicContact CG-CZ2 3.99Å; R183-W190 HydrophobicContact CG-CZ3 3.94Å; R183-W190 VanDerWaalsContact CZ-CZ2 3.47Å; R183-Y214 CarbonylContact O-C 3.56Å; R183-Y214 WeakPolarHBondContact O-CA 3.25Å; R183-Y214 WeakPolarHBondContact O-CD1 3.25Å; R183-E215 HydrophobicContact CG-CB 4.07Å; R183-E215 IonicContact CZ-OE2 3.72Å; R183-E215 PolarHBondContact N-O 3.12Å; R183-E215 IonicContact NE-OE2 3.43Å; R183-E215 PolarHBondContact NE-OE2 2.74Å; R183-E215 IonicContact NH2-OE2 3.85Å; R183-E215 PolarHBondContact NH2-OE2 3.24Å; R183-E215 PolarHBondContact O-N 2.77Å
184	V	59.5	Low	70.2	Confident	77 Å²	77	57.1 Å²	57.1	47%	0.467	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	139.1	164.7	180	0	0	0	0	108.5	G186 S187 Y214	V184-G186 PolarHBondContact O-N 3.5Å; V184-S187 WeakPolarHBondContact O-CB 3.46Å; V184-S187 PolarHBondContact O-N 2.89Å; V184-Y214 HydrophobicContact CG2-CD1 4.14Å; V184-Y214 HydrophobicContact CG2-CE1 3.66Å
185	Y	55.9	Low	70.3	Confident	110 Å²	110	62.2 Å²	62.2	43%	0.431	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	126.3	-178	-167.8	-98.9	0	0	0	111	S187 V213 E215	Y185-S187 VanDerWaalsContact C-N 3.32Å; Y185-V213 WeakPolarHBondContact CB-O 3.13Å; Y185-V213 HydrophobicContact CD2-CG1 4.42Å; Y185-V213 HydrophobicContact CG-CG1 4.07Å; Y185-V213 PolarHBondContact N-O 3.45Å; Y185-E215 HydrophobicContact CD2-CG 3.49Å; Y185-E215 VanDerWaalsContact CD2-CG 3.49Å; Y185-E215 HydrophobicContact CE2-CG 4.01Å
186	G	46.9	Very low	70.3	Confident	66 Å²	66	68.7 Å²	68.7	68%	0.68	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	-6.6	-174.2	0	0	0	0	0	115.8	V184	V184-G186 PolarHBondContact O-N 3.5Å
187	S	48.6	Very low	70.3	Confident	47 Å²	47	66.2 Å²	66.2	33%	0.329	34%	0.339	S	S	.	.			trans	-67.6	157.9	170.5	-171	0	0	0	0	111.6	R183 V184 Y185	R183-S187 VanDerWaalsContact CD-O 3.26Å; R183-S187 WeakPolarHBondContact CD-O 3.38Å; R183-S187 VanDerWaalsContact CZ-O 3.28Å; R183-S187 PolarHBondContact NE-O 3.07Å; R183-S187 PolarHBondContact NH1-O 2.95Å; V184-S187 WeakPolarHBondContact O-CB 3.46Å; V184-S187 PolarHBondContact O-N 2.89Å; Y185-S187 VanDerWaalsContact C-N 3.32Å
188	R	45.8	Very low	70.6	Confident	162 Å²	162	67 Å²	67	61%	0.611	34%	0.343	S	S	*	.	S	Bend	trans	-86	-43.6	175.2	-68.6	-177	172.2	-153.3	-9.4	111.6
189	D	51.8	Low	70.5	Confident	123 Å²	123	74.4 Å²	74.4	66%	0.658	38%	0.378	S	S	*	.			trans	-85.8	142.2	-168.8	-52.1	-67.6	0	0	0	112.7	R183	R183-D189 WeakPolarHBondContact CB-O 3.39Å
190	W	67	Low	70.3	Confident	51 Å²	51	79.5 Å²	79.5	19%	0.193	40%	0.402	C	S	.	.			trans	-110.7	120.9	-178.4	-73.8	85.9	0	0	0	110.1	E181 R183 E215 R217	E181-W190 HydrophobicContact CB-CB 4.37Å; E181-W190 HydrophobicContact CB-CE3 4.09Å; R183-W190 HydrophobicContact CB-CD2 4.28Å; R183-W190 HydrophobicContact CB-CE3 4.21Å; R183-W190 VanDerWaalsContact CD-CE2 3.47Å; R183-W190 HydrophobicContact CG-CD2 3.99Å; R183-W190 HydrophobicContact CG-CE3 3.96Å; R183-W190 HydrophobicContact CG-CH2 3.97Å; R183-W190 HydrophobicContact CG-CZ2 3.99Å; R183-W190 HydrophobicContact CG-CZ3 3.94Å; R183-W190 VanDerWaalsContact CZ-CZ2 3.47Å; W190-E215 HydrophobicContact CH2-CB 3.74Å; W190-E215 HydrophobicContact CZ3-CB 4.22Å; W190-R217 HydrophobicContact CD2-CG 4.18Å; W190-R217 HydrophobicContact CE3-CB 4.47Å; W190-R217 HydrophobicContact CE3-CG 3.65Å; W190-R217 VanDerWaalsContact CG-CZ 3.41Å; W190-R217 HydrophobicContact CH2-CB 4.02Å; W190-R217 HydrophobicContact CH2-CG 4Å; W190-R217 HydrophobicContact CZ2-CG 4.48Å; W190-R217 HydrophobicContact CZ3-CB 3.88Å; W190-R217 HydrophobicContact CZ3-CG 3.57Å
191	I	63.3	Low	70.4	Confident	88 Å²	88	81.8 Å²	81.8	45%	0.451	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	132.5	-177.3	-53.6	173.6	0	0	0	108.3	E181 Y182	E181-I191 CarbonylContact C-O 3.48Å; E181-I191 VanDerWaalsContact CA-O 3.22Å; E181-I191 WeakPolarHBondContact CA-O 3.12Å; Y182-I191 HydrophobicContact CD1-CB 4.03Å; Y182-I191 HydrophobicContact CD1-CG2 4.29Å; Y182-I191 WeakPolarHBondContact CD1-O 3.29Å; Y182-I191 HydrophobicContact CE1-CB 3.75Å; Y182-I191 HydrophobicContact CE1-CG2 3.57Å; Y182-I191 HydrophobicContact CE2-CD1 4.39Å; Y182-I191 PolarHBondContact N-O 3.34Å; Y182-I191 PolarHBondContact O-N 2.87Å
192	V	76.9	Confident	70.6	Confident	65 Å²	65	83.9 Å²	83.9	39%	0.394	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	130.3	174.7	-179.9	0	0	0	0	109.6	Q179 E181 N194	Q179-V192 HydrophobicContact CG-CG1 3.74Å; Q179-V192 HydrophobicContact CG-CG2 4.19Å; E181-V192 HydrophobicContact CG-CG2 4.04Å; V192-N194 WeakPolarHBondContact CG1-O 3.37Å
193	A	72.3	Confident	70.9	Confident	29 Å²	29	84.3 Å²	84.3	24%	0.24	43%	0.43	C	S	.	.			trans	-88.3	-19.4	-177.2	0	0	0	0	0	113.9	V180 Y182 F203 V205	V180-A193 HydrophobicContact CB-CB 4.18Å; V180-A193 HydrophobicContact CG1-CB 4.07Å; V180-A193 PolarHBondContact O-N 3.47Å; Y182-A193 HydrophobicContact CD1-CB 3.9Å; Y182-A193 HydrophobicContact CE1-CB 4.37Å; A193-F203 HydrophobicContact CB-CE1 3.91Å; A193-V205 HydrophobicContact CB-CB 4.43Å; A193-V205 HydrophobicContact CB-CG1 3.89Å; A193-V205 HydrophobicContact CB-CG2 3.83Å
194	N	79.3	Confident	71.5	Confident	14 Å²	14	85.3 Å²	85.3	8%	0.075	44%	0.44	C	S	.	.			trans	-129.9	125.5	-171.6	64	-61.7	0	0	0	112.8	Y178 V180 V192 Q196 V198 F203	Y178-N194 PolarHBondContact O-ND2 3.45Å; V180-N194 PolarHBondContact N-OD1 3.1Å; V180-N194 PolarHBondContact O-OD1 3.01Å; V192-N194 WeakPolarHBondContact CG1-O 3.37Å; N194-Q196 PolarHBondContact ND2-O 3.46Å; N194-V198 HydrophobicContact CB-CG2 4.25Å; N194-F203 HydrophobicContact CB-CE1 4.06Å; N194-F203 HydrophobicContact CB-CE2 3.92Å; N194-F203 HydrophobicContact CB-CZ 3.58Å
195	E	71.5	Confident	72.4	Confident	204 Å²	204	81.7 Å²	81.7	95%	0.953	42%	0.418	S	S	*	.	S	Bend	trans	-69.3	-34.5	177.3	-61.5	-172.1	162.1	0	0	113
196	Q	80.6	Confident	73.4	Confident	167 Å²	167	83 Å²	83	78%	0.78	43%	0.428	S	S	*	.	S	Bend	trans	-115.9	144.8	177.3	-60.9	-171.6	18.3	0	0	110.2	N194 V198	N194-Q196 PolarHBondContact ND2-O 3.46Å; Q196-V198 PolarHBondContact O-N 3.32Å
197	L	82.9	Confident	74.3	Confident	65 Å²	65	85.1 Å²	85.1	34%	0.34	43%	0.432	S	S	.	.			trans	-60.9	126.7	-177.7	-60.9	170.7	0	0	0	111.3	Y178 Q179 Q199 K221	Y178-L197 WeakPolarHBondContact O-CA 3.35Å; Q179-L197 HydrophobicContact CB-CD2 4.39Å; L197-Q199 PolarHBondContact O-N 3.37Å; L197-K221 HydrophobicContact CD1-CB 4.23Å; L197-K221 HydrophobicContact CD1-CD 3.89Å; L197-K221 HydrophobicContact CD1-CG 4.41Å; L197-K221 HydrophobicContact CD2-CB 4.05Å; L197-K221 HydrophobicContact CD2-CD 3.72Å; L197-K221 HydrophobicContact CG-CD 4.39Å
198	V	88.1	Confident	75	Confident	19 Å²	19	83.1 Å²	83.1	12%	0.115	42%	0.418	C	S	.	.	B	Isolated β-bridge	trans	-69.6	117.8	175.7	-163.9	0	0	0	0	108.1	W163 G177 Y178 V180 N194 Q196 E200 V202 F203	W163-V198 HydrophobicContact CH2-CB 4.36Å; W163-V198 HydrophobicContact CH2-CG1 4.21Å; W163-V198 HydrophobicContact CH2-CG2 4.47Å; W163-V198 HydrophobicContact CZ2-CB 4.38Å; W163-V198 HydrophobicContact CZ2-CG1 4.4Å; G177-V198 CarbonylContact C-O 3.59Å; G177-V198 WeakPolarHBondContact CA-O 3.22Å; Y178-V198 WeakPolarHBondContact CD2-O 3.19Å; Y178-V198 PolarHBondContact N-O 2.94Å; Y178-V198 PolarHBondContact O-N 3.11Å; V180-V198 HydrophobicContact CG2-CG2 4.2Å; N194-V198 HydrophobicContact CB-CG2 4.25Å; Q196-V198 PolarHBondContact O-N 3.32Å; V198-E200 HydrophobicContact CG1-CB 4.47Å; V198-E200 WeakPolarHBondContact CG1-O 3.33Å; V198-V202 WeakPolarHBondContact CG1-O 3.47Å; V198-F203 HydrophobicContact CG1-CB 4.27Å; V198-F203 HydrophobicContact CG1-CD2 4.3Å; V198-F203 HydrophobicContact CG2-CB 4.13Å; V198-F203 HydrophobicContact CG2-CD2 3.59Å; V198-F203 HydrophobicContact CG2-CE2 4.18Å; V198-F203 HydrophobicContact CG2-CG 3.9Å
199	Q	84.3	Confident	75.3	Confident	164 Å²	164	81.9 Å²	81.9	77%	0.766	41%	0.413	S	S	*	.			trans	-83.7	-21.5	175.9	-64.6	-166.6	3.9	0	0	112.5	L197	L197-Q199 PolarHBondContact O-N 3.37Å
200	E	82.6	Confident	75.2	Confident	138 Å²	138	79.2 Å²	79.2	65%	0.645	40%	0.402	S	S	*	.	S	Bend	trans	-85.9	167.7	173.1	-59.5	-173.4	-176.3	0	0	111.4	W163 Y178 V198 V202	W163-E200 WeakPolarHBondContact CZ2-O 3.34Å; Y178-E200 WeakPolarHBondContact CD2-O 3.34Å; V198-E200 HydrophobicContact CG1-CB 4.47Å; V198-E200 WeakPolarHBondContact CG1-O 3.33Å; E200-V202 VanDerWaalsContact C-N 3.3Å; E200-V202 HydrophobicContact CB-CG1 4.28Å
201	N	88.3	Confident	74.6	Confident	49 Å²	49	82.6 Å²	82.6	26%	0.262	43%	0.425	S	S	.	.	S	Bend	trans	-93.8	16.9	-179.3	-89.6	92	0	0	0	113.3	E162 W163	E162-N201 WeakPolarHBondContact CA-O 3.46Å; W163-N201 VanDerWaalsContact CD1-ND2 3.29Å; W163-N201 PolarHBondContact N-O 2.93Å; W163-N201 PolarHBondContact NE1-ND2 3.4Å; W163-N201 WeakPolarHBondContact O-CB 3.31Å; W163-N201 PolarHBondContact O-ND2 2.74Å
202	V	85.5	Confident	74.1	Confident	51 Å²	51	79.3 Å²	79.3	31%	0.309	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	143.1	-176.8	65.4	0	0	0	0	110	L160 L161 V198 E200	L160-V202 HydrophobicContact CD1-CG2 3.74Å; L160-V202 HydrophobicContact CG-CG2 4.35Å; L161-V202 CarbonylContact O-C 3.45Å; L161-V202 VanDerWaalsContact O-CA 3.23Å; L161-V202 WeakPolarHBondContact O-CA 3.41Å; L161-V202 VanDerWaalsContact O-CG2 3.28Å; L161-V202 WeakPolarHBondContact O-CG2 3.08Å; V198-V202 WeakPolarHBondContact CG1-O 3.47Å; E200-V202 VanDerWaalsContact C-N 3.3Å; E200-V202 HydrophobicContact CB-CG1 4.28Å
203	F	86.4	Confident	73.6	Confident	53 Å²	53	79 Å²	79	23%	0.232	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	144.1	178.1	-176.9	-105.4	0	0	0	112.6	L161 W163 V180 A193 N194 V198 V205	L161-F203 PolarHBondContact N-O 2.82Å; L161-F203 PolarHBondContact O-N 2.76Å; W163-F203 HydrophobicContact CH2-CB 3.66Å; W163-F203 HydrophobicContact CZ3-CB 3.81Å; V180-F203 HydrophobicContact CB-CD1 4.15Å; V180-F203 HydrophobicContact CG1-CD1 4.22Å; V180-F203 HydrophobicContact CG2-CB 4.17Å; V180-F203 HydrophobicContact CG2-CD1 4.02Å; V180-F203 HydrophobicContact CG2-CG 4.26Å; A193-F203 HydrophobicContact CB-CE1 3.91Å; N194-F203 HydrophobicContact CB-CE1 4.06Å; N194-F203 HydrophobicContact CB-CE2 3.92Å; N194-F203 HydrophobicContact CB-CZ 3.58Å; V198-F203 HydrophobicContact CG1-CB 4.27Å; V198-F203 HydrophobicContact CG1-CD2 4.3Å; V198-F203 HydrophobicContact CG2-CB 4.13Å; V198-F203 HydrophobicContact CG2-CD2 3.59Å; V198-F203 HydrophobicContact CG2-CE2 4.18Å; V198-F203 HydrophobicContact CG2-CG 3.9Å; F203-V205 HydrophobicContact CD1-CG2 3.94Å; F203-V205 HydrophobicContact CE1-CG2 4.05Å
204	T	84.9	Confident	73.7	Confident	49 Å²	49	78.2 Å²	78.2	30%	0.301	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	119.6	172.1	-47.6	0	0	0	0	110.1	V159 L160 E206	V159-T204 CarbonylContact O-C 3.6Å; V159-T204 WeakPolarHBondContact O-CA 3.4Å; L160-T204 WeakPolarHBondContact CD1-OG1 3.14Å; T204-E206 HydrophobicContact CG2-CG 3.78Å
205	V	77.3	Confident	73.6	Confident	2 Å²	2	78.2 Å²	78.2	1%	0.012	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	110.6	168.2	-173.7	0	0	0	0	108.4	G158 V159 L161 V180 Y182 A193 F203 L208 F216	G158-V205 CarbonylContact C-O 3.42Å; G158-V205 WeakPolarHBondContact CA-O 3.15Å; V159-V205 PolarHBondContact N-O 2.97Å; V159-V205 PolarHBondContact O-N 3.11Å; L161-V205 HydrophobicContact CD1-CG2 3.77Å; V180-V205 HydrophobicContact CG1-CG2 3.97Å; Y182-V205 HydrophobicContact CD1-CG1 4.14Å; Y182-V205 HydrophobicContact CE1-CG1 4.45Å; Y182-V205 HydrophobicContact CG-CG1 4.26Å; A193-V205 HydrophobicContact CB-CB 4.43Å; A193-V205 HydrophobicContact CB-CG1 3.89Å; A193-V205 HydrophobicContact CB-CG2 3.83Å; F203-V205 HydrophobicContact CD1-CG2 3.94Å; F203-V205 HydrophobicContact CE1-CG2 4.05Å; V205-L208 HydrophobicContact CB-CD1 4.25Å; V205-L208 HydrophobicContact CG1-CD1 4.04Å; V205-L208 HydrophobicContact CG1-CD2 3.95Å; V205-L208 HydrophobicContact CG1-CG 4.12Å; V205-F216 HydrophobicContact CB-CD1 4.46Å; V205-F216 HydrophobicContact CB-CE1 3.93Å; V205-F216 HydrophobicContact CG1-CE1 3.97Å; V205-F216 HydrophobicContact CG2-CD1 3.96Å; V205-F216 HydrophobicContact CG2-CE1 3.94Å
206	E	77.9	Confident	74.2	Confident	138 Å²	138	68.5 Å²	68.5	65%	0.645	36%	0.355	S	S	*	.			trans	-100.2	173.5	-175.8	-61.2	-178.6	175.8	0	0	112.4	Q157 T204 L208	Q157-E206 CarbonylContact O-C 3.5Å; T204-E206 HydrophobicContact CG2-CG 3.78Å; E206-L208 VanDerWaalsContact C-N 3.29Å; E206-L208 PolarHBondContact O-N 3.06Å
207	S	65.4	Low	74.5	Confident	110 Å²	110	62.9 Å²	62.9	77%	0.769	33%	0.327	S	S	*	.	S	Bend	trans	60.9	26.9	178.4	-57.5	0	0	0	0	115.9	Q157	Q157-S207 PolarHBondContact O-N 2.98Å
208	L	63.4	Low	74.7	Confident	4 Å²	4	59.8 Å²	59.8	2%	0.021	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-78.1	147.4	175.7	-61.1	173.4	0	0	0	111.4	Q157 V159 Y182 V205 E206 Y214 F216 I238	Q157-L208 PolarHBondContact O-N 2.82Å; V159-L208 HydrophobicContact CB-CD1 4.18Å; V159-L208 HydrophobicContact CG2-CD1 3.73Å; Y182-L208 HydrophobicContact CD2-CD2 3.56Å; Y182-L208 HydrophobicContact CE2-CD2 3.4Å; Y182-L208 VanDerWaalsContact CE2-CD2 3.4Å; Y182-L208 HydrophobicContact CG-CD2 4.42Å; V205-L208 HydrophobicContact CB-CD1 4.25Å; V205-L208 HydrophobicContact CG1-CD1 4.04Å; V205-L208 HydrophobicContact CG1-CD2 3.95Å; V205-L208 HydrophobicContact CG1-CG 4.12Å; E206-L208 VanDerWaalsContact C-N 3.29Å; E206-L208 PolarHBondContact O-N 3.06Å; L208-Y214 HydrophobicContact CB-CE2 4.11Å; L208-Y214 HydrophobicContact CD2-CD1 4.13Å; L208-Y214 HydrophobicContact CD2-CD2 4.49Å; L208-Y214 HydrophobicContact CD2-CE1 3.99Å; L208-Y214 HydrophobicContact CD2-CE2 4.36Å; L208-Y214 HydrophobicContact CD2-CG 4.36Å; L208-F216 HydrophobicContact CD1-CE1 3.98Å; L208-F216 HydrophobicContact CD1-CZ 3.69Å; L208-I238 HydrophobicContact CB-CD1 4.15Å; L208-I238 HydrophobicContact CB-CG1 4.03Å; L208-I238 HydrophobicContact CD1-CD1 3.78Å; L208-I238 HydrophobicContact CD1-CG1 4.49Å
209	R	51.1	Low	74.5	Confident	137 Å²	137	61.6 Å²	61.6	52%	0.517	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-73.4	127.7	-175.9	-65.2	-175.4	176.3	179.8	0.1	111.1	G212 Y214 D420	R209-G212 PolarHBondContact O-N 3.22Å; R209-Y214 WeakPolarHBondContact CB-OH 3.38Å; R209-Y214 WeakPolarHBondContact CG-OH 3.12Å; R209-Y214 PolarHBondContact N-OH 3.37Å; R209-D420 IonicContact CZ-OD1 3.75Å; R209-D420 IonicContact CZ-OD2 3.85Å; R209-D420 VanDerWaalsContact CZ-OD2 3.25Å; R209-D420 IonicContact NH1-OD2 2.86Å; R209-D420 PolarHBondContact NH1-OD2 2.79Å; R209-D420 IonicContact NH2-OD1 3.79Å; R209-D420 PolarHBondContact NH2-OD1 3.15Å; R209-D420 IonicContact NH2-OD2 3.7Å; R209-D420 PolarHBondContact NH2-OD2 2.6Å
210	P	49.8	Very low	74.4	Confident	66 Å²	66	53.8 Å²	53.8	43%	0.429	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	140.2	171.7	-21.3	30.3	0	0	0	111.6	G212 P240	P210-G212 PolarHBondContact O-N 3.18Å; P210-P240 HydrophobicContact CB-CG 4.26Å
211	N	54.4	Low	74.4	Confident	123 Å²	123	51 Å²	51	66%	0.658	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	1.1	-171.4	-51	-59.5	0	0	0	115.9	I238 P240	N211-I238 WeakPolarHBondContact CA-O 3.48Å; N211-I238 PolarHBondContact N-O 2.88Å; N211-P240 VanDerWaalsContact OD1-CD 3.27Å; N211-P240 WeakPolarHBondContact OD1-CD 3.47Å
212	G	53.7	Low	74.1	Confident	19 Å²	19	49 Å²	49	20%	0.196	25%	0.254	C	S	.	.			trans	-72	148.3	171	0	0	0	0	0	112.3	R209 P210 I238	R209-G212 PolarHBondContact O-N 3.22Å; P210-G212 PolarHBondContact O-N 3.18Å; G212-I238 PolarHBondContact O-N 3.19Å
213	V	66.9	Low	73.5	Confident	57 Å²	57	53.2 Å²	53.2	35%	0.345	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	129.2	169.4	-169.3	0	0	0	0	108.4	Y185 V236 A237	Y185-V213 WeakPolarHBondContact CB-O 3.13Å; Y185-V213 HydrophobicContact CD2-CG1 4.42Å; Y185-V213 HydrophobicContact CG-CG1 4.07Å; Y185-V213 PolarHBondContact N-O 3.45Å; V213-V236 CarbonylContact C-O 3.55Å; V213-V236 WeakPolarHBondContact CA-O 3.32Å; V213-A237 HydrophobicContact CG2-CB 4.16Å
214	Y	73.3	Confident	72.7	Confident	13 Å²	13	54.3 Å²	54.3	5%	0.051	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	152.3	-174.7	-68	-91.2	0	0	0	112.3	Y182 R183 V184 L208 R209 G235 V236 I238	Y182-Y214 AromaticContact CD2-CD1 3.78Å; Y182-Y214 HydrophobicContact CD2-CD1 3.78Å; Y182-Y214 HydrophobicContact CD2-CE1 4.06Å; Y182-Y214 HydrophobicContact CE2-CD1 4.2Å; Y182-Y214 AromaticContact CE2-CE1 3.99Å; Y182-Y214 HydrophobicContact CE2-CE1 3.99Å; R183-Y214 CarbonylContact O-C 3.56Å; R183-Y214 WeakPolarHBondContact O-CA 3.25Å; R183-Y214 WeakPolarHBondContact O-CD1 3.25Å; V184-Y214 HydrophobicContact CG2-CD1 4.14Å; V184-Y214 HydrophobicContact CG2-CE1 3.66Å; L208-Y214 HydrophobicContact CB-CE2 4.11Å; L208-Y214 HydrophobicContact CD2-CD1 4.13Å; L208-Y214 HydrophobicContact CD2-CD2 4.49Å; L208-Y214 HydrophobicContact CD2-CE1 3.99Å; L208-Y214 HydrophobicContact CD2-CE2 4.36Å; L208-Y214 HydrophobicContact CD2-CG 4.36Å; R209-Y214 WeakPolarHBondContact CB-OH 3.38Å; R209-Y214 WeakPolarHBondContact CG-OH 3.12Å; R209-Y214 PolarHBondContact N-OH 3.37Å; Y214-G235 CarbonylContact O-C 3.48Å; Y214-V236 PolarHBondContact N-O 3.24Å; Y214-V236 PolarHBondContact O-N 3.23Å; Y214-I238 HydrophobicContact CD2-CD1 4.25Å; Y214-I238 HydrophobicContact CD2-CG1 3.67Å; Y214-I238 HydrophobicContact CE2-CG1 3.83Å
215	E	76.7	Confident	71.8	Confident	14 Å²	14	53 Å²	53	7%	0.065	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	149	164.4	-60.5	-164.9	97.3	0	0	110.6	Y182 R183 Y185 W190 S232	Y182-E215 CarbonylContact C-O 3.59Å; Y182-E215 WeakPolarHBondContact CA-O 3.22Å; R183-E215 HydrophobicContact CG-CB 4.07Å; R183-E215 IonicContact CZ-OE2 3.72Å; R183-E215 PolarHBondContact N-O 3.12Å; R183-E215 IonicContact NE-OE2 3.43Å; R183-E215 PolarHBondContact NE-OE2 2.74Å; R183-E215 IonicContact NH2-OE2 3.85Å; R183-E215 PolarHBondContact NH2-OE2 3.24Å; R183-E215 PolarHBondContact O-N 2.77Å; Y185-E215 HydrophobicContact CD2-CG 3.49Å; Y185-E215 VanDerWaalsContact CD2-CG 3.49Å; Y185-E215 HydrophobicContact CE2-CG 4.01Å; W190-E215 HydrophobicContact CH2-CB 3.74Å; W190-E215 HydrophobicContact CZ3-CB 4.22Å; E215-S232 WeakPolarHBondContact OE1-CB 3.24Å; E215-S232 PolarHBondContact OE1-OG 2.83Å
216	F	85.4	Confident	71.6	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	144.8	177.1	-53.9	-81	0	0	0	110.7	P149 V159 L161 E181 Y182 V205 L208 S232 S233 V236	P149-F216 HydrophobicContact CG-CB 4.29Å; P149-F216 WeakPolarHBondContact CG-O 3.37Å; V159-F216 HydrophobicContact CB-CE2 4.17Å; V159-F216 HydrophobicContact CB-CZ 3.91Å; V159-F216 HydrophobicContact CG1-CE2 3.93Å; V159-F216 HydrophobicContact CG1-CZ 4.16Å; V159-F216 HydrophobicContact CG2-CE2 4.05Å; V159-F216 HydrophobicContact CG2-CZ 3.8Å; L161-F216 HydrophobicContact CD1-CB 3.6Å; L161-F216 HydrophobicContact CD1-CD1 3.74Å; L161-F216 HydrophobicContact CD1-CD2 4.35Å; L161-F216 HydrophobicContact CD1-CG 3.63Å; L161-F216 HydrophobicContact CD2-CB 4.17Å; L161-F216 HydrophobicContact CD2-CD2 3.88Å; L161-F216 HydrophobicContact CD2-CE2 4.49Å; L161-F216 HydrophobicContact CD2-CG 3.99Å; L161-F216 HydrophobicContact CG-CG 4.4Å; E181-F216 CarbonylContact O-C 3.57Å; E181-F216 WeakPolarHBondContact O-CA 3.42Å; Y182-F216 VanDerWaalsContact CB-CD1 3.42Å; Y182-F216 HydrophobicContact CG-CE1 4.36Å; V205-F216 HydrophobicContact CB-CD1 4.46Å; V205-F216 HydrophobicContact CB-CE1 3.93Å; V205-F216 HydrophobicContact CG1-CE1 3.97Å; V205-F216 HydrophobicContact CG2-CD1 3.96Å; V205-F216 HydrophobicContact CG2-CE1 3.94Å; L208-F216 HydrophobicContact CD1-CE1 3.98Å; L208-F216 HydrophobicContact CD1-CZ 3.69Å; F216-S232 CarbonylContact O-C 3.59Å; F216-S232 VanDerWaalsContact O-CA 3.23Å; F216-S232 WeakPolarHBondContact O-CA 3.48Å; F216-S233 PolarHBondContact N-OG 2.86Å; F216-S233 PolarHBondContact O-N 2.84Å; F216-V236 HydrophobicContact CD2-CB 4.45Å; F216-V236 HydrophobicContact CD2-CG2 3.94Å; F216-V236 HydrophobicContact CE2-CB 3.86Å; F216-V236 HydrophobicContact CE2-CG1 4.25Å; F216-V236 HydrophobicContact CE2-CG2 3.84Å
217	R	86.5	Confident	71.4	Confident	49 Å²	49	48.9 Å²	48.9	19%	0.185	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	164.5	171.9	74.3	-174.3	-170.4	-177.3	-3.4	110.2	E181 W190 P229	E181-R217 HydrophobicContact CB-CG 3.89Å; E181-R217 PolarHBondContact N-O 3.38Å; E181-R217 PolarHBondContact O-N 2.78Å; E181-R217 IonicContact OE2-CZ 3.76Å; E181-R217 IonicContact OE2-NE 3.92Å; E181-R217 PolarHBondContact OE2-NE 2.93Å; E181-R217 IonicContact OE2-NH2 2.99Å; E181-R217 PolarHBondContact OE2-NH2 2.83Å; W190-R217 HydrophobicContact CD2-CG 4.18Å; W190-R217 HydrophobicContact CE3-CB 4.47Å; W190-R217 HydrophobicContact CE3-CG 3.65Å; W190-R217 VanDerWaalsContact CG-CZ 3.41Å; W190-R217 HydrophobicContact CH2-CB 4.02Å; W190-R217 HydrophobicContact CH2-CG 4Å; W190-R217 HydrophobicContact CZ2-CG 4.48Å; W190-R217 HydrophobicContact CZ3-CB 3.88Å; W190-R217 HydrophobicContact CZ3-CG 3.57Å; R217-P229 HydrophobicContact CG-CB 4.34Å
218	V	86.2	Confident	71.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	143.1	-176.9	-167.8	0	0	0	0	110.9	P146 P149 W163 Y178 Q179 V180 S230	P146-V218 HydrophobicContact CB-CB 4.45Å; P146-V218 WeakPolarHBondContact CD-O 3.45Å; P146-V218 HydrophobicContact CG-CB 4.37Å; P146-V218 HydrophobicContact CG-CG1 4.23Å; P149-V218 HydrophobicContact CB-CG2 3.96Å; P149-V218 HydrophobicContact CG-CG2 4.1Å; W163-V218 HydrophobicContact CB-CG2 4.44Å; W163-V218 HydrophobicContact CD2-CB 4.38Å; W163-V218 HydrophobicContact CD2-CG1 4.02Å; W163-V218 HydrophobicContact CD2-CG2 3.8Å; W163-V218 HydrophobicContact CE3-CG2 3.82Å; W163-V218 HydrophobicContact CG-CB 4.4Å; W163-V218 HydrophobicContact CG-CG1 4.29Å; W163-V218 HydrophobicContact CG-CG2 4.07Å; W163-V218 HydrophobicContact CZ2-CG1 4.12Å; W163-V218 HydrophobicContact CZ3-CG2 4.38Å; Y178-V218 HydrophobicContact CD1-CG1 3.99Å; Y178-V218 HydrophobicContact CG-CG1 4.12Å; Q179-V218 WeakPolarHBondContact O-CA 3.4Å; V180-V218 HydrophobicContact CG2-CG1 4.34Å; V180-V218 HydrophobicContact CG2-CG2 4.37Å; V218-S230 PolarHBondContact N-OG 3.06Å; V218-S230 PolarHBondContact O-N 3.14Å; V218-S230 PolarHBondContact O-OG 3.03Å
219	R	84.8	Confident	72.1	Confident	57 Å²	57	51.7 Å²	51.7	22%	0.215	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	129.8	178.1	-51	-171.3	64.3	176.9	-4.4	109.6	Y178 Q179 E181 L226 G227 P229	Y178-R219 CarbonylContact C-O 3.57Å; Y178-R219 WeakPolarHBondContact CA-O 3.32Å; Q179-R219 HydrophobicContact CB-CB 4.37Å; Q179-R219 PolarHBondContact N-O 3.27Å; Q179-R219 PolarHBondContact O-N 2.99Å; E181-R219 WeakPolarHBondContact OE1-CD 3.47Å; E181-R219 IonicContact OE1-NH1 3.17Å; R219-L226 HydrophobicContact CB-CD1 3.67Å; R219-L226 HydrophobicContact CB-CG 4.15Å; R219-L226 VanDerWaalsContact CZ-CD2 3.45Å; R219-L226 PolarHBondContact NH2-O 2.95Å; R219-G227 PolarHBondContact NE-O 2.95Å; R219-G227 PolarHBondContact NH2-O 2.95Å; R219-P229 HydrophobicContact CG-CB 3.95Å
220	G	82.4	Confident	73.6	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	137.9	170.5	0	0	0	0	0	110.8	G227	G220-G227 PolarHBondContact O-N 2.93Å
221	K	82.8	Confident	74.5	Confident	79 Å²	79	49.2 Å²	49.2	34%	0.343	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	137.5	174.6	-162.7	175.4	-179.8	177.6	0	110.6	P175 Q176 G177 L197 G225 L226	P175-K221 CarbonylContact C-O 3.6Å; P175-K221 WeakPolarHBondContact CA-O 3.47Å; Q176-K221 PolarHBondContact N-O 3.45Å; G177-K221 PolarHBondContact N-O 3.34Å; G177-K221 PolarHBondContact O-N 3.05Å; L197-K221 HydrophobicContact CD1-CB 4.23Å; L197-K221 HydrophobicContact CD1-CD 3.89Å; L197-K221 HydrophobicContact CD1-CG 4.41Å; L197-K221 HydrophobicContact CD2-CB 4.05Å; L197-K221 HydrophobicContact CD2-CD 3.72Å; L197-K221 HydrophobicContact CG-CD 4.39Å; K221-G225 WeakPolarHBondContact CA-O 3.22Å; K221-G225 WeakPolarHBondContact CG-O 3.36Å; K221-L226 HydrophobicContact CB-CD1 3.76Å; K221-L226 HydrophobicContact CD-CD1 4.15Å; K221-L226 HydrophobicContact CG-CB 4.27Å; K221-L226 HydrophobicContact CG-CD1 4.02Å
222	N	81.6	Confident	75.5	Confident	8 Å²	8	44.9 Å²	44.9	4%	0.043	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	-169.7	170.6	71.1	12.7	0	0	0	110.2	G141 P143 S173 P174 Q176 D224 G225	G141-N222 PolarHBondContact O-ND2 3.15Å; P143-N222 VanDerWaalsContact CD-CG 3.49Å; P143-N222 WeakPolarHBondContact CD-ND2 3.43Å; P143-N222 HydrophobicContact CG-CB 3.81Å; S173-N222 WeakPolarHBondContact CB-ND2 3.25Å; S173-N222 PolarHBondContact O-ND2 3.4Å; P174-N222 WeakPolarHBondContact O-CB 3.35Å; Q176-N222 HydrophobicContact CG-CB 4.33Å; N222-D224 PolarHBondContact O-N 2.78Å; N222-D224 WeakPolarHBondContact OD1-CA 3.41Å; N222-D224 WeakPolarHBondContact OD1-CB 2.98Å; N222-D224 PolarHBondContact OD1-N 2.8Å; N222-G225 PolarHBondContact N-O 2.84Å; N222-G225 PolarHBondContact O-N 2.74Å; N222-G225 PolarHBondContact OD1-N 2.82Å
223	Q	73.3	Confident	76.2	Confident	140 Å²	140	44.8 Å²	44.8	65%	0.654	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-29.7	178.4	73.2	-167.9	8.4	0	0	113.9
224	D	69.1	Low	76.3	Confident	75 Å²	75	42.9 Å²	42.9	40%	0.401	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-10.1	-172.9	-55.8	-61.9	0	0	0	111.8	N222	N222-D224 PolarHBondContact O-N 2.78Å; N222-D224 WeakPolarHBondContact OD1-CA 3.41Å; N222-D224 WeakPolarHBondContact OD1-CB 2.98Å; N222-D224 PolarHBondContact OD1-N 2.8Å
225	G	66.7	Low	75.8	Confident	23 Å²	23	44.4 Å²	44.4	24%	0.237	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	144	-166.1	170.5	0	0	0	0	0	115.2	K221 N222	K221-G225 WeakPolarHBondContact CA-O 3.22Å; K221-G225 WeakPolarHBondContact CG-O 3.36Å; N222-G225 PolarHBondContact N-O 2.84Å; N222-G225 PolarHBondContact O-N 2.74Å; N222-G225 PolarHBondContact OD1-N 2.82Å
226	L	72.4	Confident	75.4	Confident	49 Å²	49	44.5 Å²	44.5	26%	0.257	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	112.7	177.9	-176.4	68	0	0	0	109.3	Q179 R219 K221	Q179-L226 HydrophobicContact CB-CD1 4Å; R219-L226 HydrophobicContact CB-CD1 3.67Å; R219-L226 HydrophobicContact CB-CG 4.15Å; R219-L226 VanDerWaalsContact CZ-CD2 3.45Å; R219-L226 PolarHBondContact NH2-O 2.95Å; K221-L226 HydrophobicContact CB-CD1 3.76Å; K221-L226 HydrophobicContact CD-CD1 4.15Å; K221-L226 HydrophobicContact CG-CB 4.27Å; K221-L226 HydrophobicContact CG-CD1 4.02Å
227	G	72.9	Confident	74.5	Confident	4 Å²	4	46.7 Å²	46.7	4%	0.041	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	178.6	-176.7	0	0	0	0	0	114.5	P143 R219 G220	P143-G227 WeakPolarHBondContact O-CA 3.22Å; R219-G227 PolarHBondContact NE-O 2.95Å; R219-G227 PolarHBondContact NH2-O 2.95Å; G220-G227 PolarHBondContact O-N 2.93Å
228	H	68.3	Low	73.5	Confident	129 Å²	129	44.4 Å²	44.4	60%	0.597	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.7	146.7	174.9	-67.1	-80.4	0	0	0	111	A145	A145-H228 WeakPolarHBondContact CA-O 3.4Å; A145-H228 HydrophobicContact CB-CB 4.4Å
229	P	76	Confident	71.8	Confident	44 Å²	44	53.6 Å²	53.6	29%	0.286	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	149.8	175	29.8	-34.3	0	0	0	112.4	R217 R219	R217-P229 HydrophobicContact CG-CB 4.34Å; R219-P229 HydrophobicContact CG-CB 3.95Å
230	S	81.8	Confident	69.9	Low	8 Å²	8	54.3 Å²	54.3	6%	0.056	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-69.9	161.7	164.6	66.6	0	0	0	0	111.8	P146 G147 V218	P146-S230 WeakPolarHBondContact O-CB 3.18Å; G147-S230 WeakPolarHBondContact O-CB 3.16Å; G147-S230 PolarHBondContact O-OG 2.9Å; V218-S230 PolarHBondContact N-OG 3.06Å; V218-S230 PolarHBondContact O-N 3.14Å; V218-S230 PolarHBondContact O-OG 3.03Å
231	M	69.1	Low	67.8	Low	143 Å²	143	57.4 Å²	57.4	70%	0.704	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-58.8	145.8	170.4	-63.6	-60.2	-76.2	0	0	110.2	R148 P149	R148-M231 HydrophobicContact CB-CB 4.47Å; P149-M231 WeakPolarHBondContact CD-O 3.34Å
232	S	74.9	Confident	65.4	Low	32 Å²	32	58 Å²	58	22%	0.224	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-66.3	156.9	-177.4	70.5	0	0	0	0	112.6	R148 E215 F216 G234	R148-S232 WeakPolarHBondContact CD-O 3.2Å; R148-S232 WeakPolarHBondContact CG-O 3.29Å; R148-S232 PolarHBondContact NE-O 2.93Å; E215-S232 WeakPolarHBondContact OE1-CB 3.24Å; E215-S232 PolarHBondContact OE1-OG 2.83Å; F216-S232 CarbonylContact O-C 3.59Å; F216-S232 VanDerWaalsContact O-CA 3.23Å; F216-S232 WeakPolarHBondContact O-CA 3.48Å; S232-G234 PolarHBondContact O-N 2.99Å; S232-G234 VanDerWaalsContact O-N 3.1Å; S232-G234 PolarHBondContact OG-N 2.88Å
233	S	70.1	Confident	62.9	Low	17 Å²	17	62 Å²	62	12%	0.119	37%	0.37	C	S	.	.			trans	-55.8	-21.9	168.8	57.2	0	0	0	0	113.1	R148 F216	R148-S233 PolarHBondContact NH2-O 2.85Å; F216-S233 PolarHBondContact N-OG 2.86Å; F216-S233 PolarHBondContact O-N 2.84Å
234	G	68.8	Low	60.9	Low	17 Å²	17	64 Å²	64	18%	0.175	38%	0.38	C	S	.	.			trans	75.4	-179.5	-155.8	0	0	0	0	0	111.2	S232 V236	S232-G234 PolarHBondContact O-N 2.99Å; S232-G234 VanDerWaalsContact O-N 3.1Å; S232-G234 PolarHBondContact OG-N 2.88Å; G234-V236 PolarHBondContact O-N 3.43Å
235	G	62.7	Low	59.1	Low	45 Å²	45	68.6 Å²	68.6	46%	0.464	39%	0.392	S	S	.	.			trans	-71.5	120.8	-174.6	0	0	0	0	0	114	Y214	Y214-G235 CarbonylContact O-C 3.48Å
236	V	67.3	Low	57.4	Low	16 Å²	16	76.6 Å²	76.6	10%	0.097	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	113.7	178.7	-174.2	0	0	0	0	108.5	V151 V154 V159 V213 Y214 F216 G234	V151-V236 HydrophobicContact CG1-CG1 4.47Å; V151-V236 HydrophobicContact CG2-CB 4.42Å; V151-V236 HydrophobicContact CG2-CG1 3.92Å; V151-V236 HydrophobicContact CG2-CG2 3.57Å; V154-V236 HydrophobicContact CG2-CG1 4.09Å; V159-V236 HydrophobicContact CG2-CG1 4.27Å; V213-V236 CarbonylContact C-O 3.55Å; V213-V236 WeakPolarHBondContact CA-O 3.32Å; Y214-V236 PolarHBondContact N-O 3.24Å; Y214-V236 PolarHBondContact O-N 3.23Å; F216-V236 HydrophobicContact CD2-CB 4.45Å; F216-V236 HydrophobicContact CD2-CG2 3.94Å; F216-V236 HydrophobicContact CE2-CB 3.86Å; F216-V236 HydrophobicContact CE2-CG1 4.25Å; F216-V236 HydrophobicContact CE2-CG2 3.84Å; G234-V236 PolarHBondContact O-N 3.43Å
237	A	67.4	Low	55.4	Low	46 Å²	46	77.3 Å²	77.3	38%	0.38	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	118.2	178.8	0	0	0	0	0	111.3	V213 R239	V213-A237 HydrophobicContact CG2-CB 4.16Å; A237-R239 PolarHBondContact O-N 3.43Å
238	I	64.5	Low	53.5	Low	1 Å²	1	82 Å²	82	1%	0.005	46%	0.459	C	S	.	.			trans	-71.7	106.3	172.4	-48.7	-56.4	0	0	0	108	V154 V159 L208 N211 G212 Y214	V154-I238 HydrophobicContact CG1-CD1 4.19Å; V159-I238 HydrophobicContact CG2-CD1 3.26Å; L208-I238 HydrophobicContact CB-CD1 4.15Å; L208-I238 HydrophobicContact CB-CG1 4.03Å; L208-I238 HydrophobicContact CD1-CD1 3.78Å; L208-I238 HydrophobicContact CD1-CG1 4.49Å; N211-I238 WeakPolarHBondContact CA-O 3.48Å; N211-I238 PolarHBondContact N-O 2.88Å; G212-I238 PolarHBondContact O-N 3.19Å; Y214-I238 HydrophobicContact CD2-CD1 4.25Å; Y214-I238 HydrophobicContact CD2-CG1 3.67Å; Y214-I238 HydrophobicContact CE2-CG1 3.83Å
239	R	51.3	Low	51.8	Low	192 Å²	192	81.1 Å²	81.1	73%	0.725	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-94.7	133.1	175.9	-66.2	-179.5	-179.2	171.6	1	108.5	A237 A241	A237-R239 PolarHBondContact O-N 3.43Å; R239-A241 PolarHBondContact O-N 2.67Å
240	P	44.9	Very low	50.7	Low	73 Å²	73	83.8 Å²	83.8	47%	0.474	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-50.9	126	172.7	-25.4	32.9	0	0	0	110.2	P210 N211 A242	P210-P240 HydrophobicContact CB-CG 4.26Å; N211-P240 VanDerWaalsContact OD1-CD 3.27Å; N211-P240 WeakPolarHBondContact OD1-CD 3.47Å; P240-A242 PolarHBondContact O-N 3.03Å
241	A	37.8	Very low	49.1	Very low	64 Å²	64	92 Å²	92	53%	0.529	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-58.6	129.6	173.4	0	0	0	0	0	108.7	R239 P243	R239-A241 PolarHBondContact O-N 2.67Å; A241-P243 WeakPolarHBondContact O-CD 3.27Å
242	A	32.1	Very low	48.5	Very low	92 Å²	92	88.6 Å²	88.6	76%	0.76	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-61	120.8	-178.4	0	0	0	0	0	109.6	P240	P240-A242 PolarHBondContact O-N 3.03Å
243	P	30.8	Very low	47.9	Very low	91 Å²	91	89 Å²	89	59%	0.591	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-62.4	142.7	-179.1	24.7	-33.1	0	0	0	110.3	A241 R245	A241-P243 WeakPolarHBondContact O-CD 3.27Å; P243-R245 PolarHBondContact O-N 2.83Å
244	Q	29.2	Very low	47.3	Very low	182 Å²	182	96.2 Å²	96.2	85%	0.85	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-64.1	126.6	174.6	-68.4	-168.9	2.6	0	0	109.2	H246	Q244-H246 PolarHBondContact O-N 3.46Å
245	R	31.8	Very low	47.1	Very low	173 Å²	173	99.9 Å²	99.9	65%	0.653	56%	0.557	S	S	*	*			trans	-64	108.8	-173.5	-64.5	-179.6	-179	176.7	-1.1	110.9	P243 V247	P243-R245 PolarHBondContact O-N 2.83Å; R245-V247 HydrophobicContact CB-CG2 4.49Å; R245-V247 PolarHBondContact O-N 3.03Å
246	H	31.7	Very low	47.6	Very low	191 Å²	191	98.6 Å²	98.6	88%	0.884	54%	0.54	S	S	*	.			trans	-74.7	62.7	167.9	-92	-101.4	0	0	0	111.5	Q244	Q244-H246 PolarHBondContact O-N 3.46Å
247	V	30.2	Very low	48.2	Very low	64 Å²	64	104.2 Å²	104.2	39%	0.388	57%	0.565	S	S	.	*	S	Bend	trans	-121.5	133.6	171.6	-179.5	0	0	0	0	107.1	R245 A249	R245-V247 HydrophobicContact CB-CG2 4.49Å; R245-V247 PolarHBondContact O-N 3.03Å; V247-A249 PolarHBondContact O-N 3.46Å
248	P	33.6	Very low	49.1	Very low	103 Å²	103	104.9 Å²	104.9	67%	0.669	57%	0.566	S	S	*	*			trans	-53.7	129.6	-180	21.3	-34	0	0	0	110.7	R250	P248-R250 VanDerWaalsContact C-N 3.34Å; P248-R250 PolarHBondContact O-N 2.84Å
249	A	32.9	Very low	50.2	Low	109 Å²	109	105.1 Å²	105.1	90%	0.901	57%	0.567	S	S	*	*			trans	-59.4	81.9	-159	0	0	0	0	0	115.3	V247	V247-A249 PolarHBondContact O-N 3.46Å
250	R	52.6	Low	51.7	Low	100 Å²	100	97.3 Å²	97.3	38%	0.377	55%	0.546	S	S	.	.			trans	-81.7	135.1	168.2	-67.6	177	-174.4	-179.6	4.6	108.8	P248 V252	P248-R250 VanDerWaalsContact C-N 3.34Å; P248-R250 PolarHBondContact O-N 2.84Å; R250-V252 PolarHBondContact O-N 2.78Å
251	K	47.9	Very low	53.8	Low	180 Å²	180	97 Å²	97	78%	0.783	54%	0.538	S	S	*	.			trans	-68.1	102.2	169.8	-79.6	-173.7	173	-177.3	0	109	A333	K251-A333 PolarHBondContact O-N 3.02Å
252	V	56.8	Low	56.2	Low	72 Å²	72	94 Å²	94	44%	0.436	51%	0.513	S	S	.	.	B	Isolated β-bridge	trans	-66.8	136.3	163.1	-179.5	0	0	0	0	107.8	R250 A333 Q335	R250-V252 PolarHBondContact O-N 2.78Å; V252-A333 WeakPolarHBondContact CA-O 3.48Å; V252-Q335 HydrophobicContact CG1-CG 4.33Å
253	S	61.3	Low	58.6	Low	41 Å²	41	95.6 Å²	95.6	29%	0.287	51%	0.506	S	S	.	.			trans	-137.5	135.1	175.5	-167.6	0	0	0	0	111.2	S255 V256 I332 A333	S253-S255 PolarHBondContact O-N 3.3Å; S253-S255 VanDerWaalsContact O-N 3.09Å; S253-S255 PolarHBondContact OG-N 3.08Å; S253-S255 PolarHBondContact OG-OG 3.02Å; S253-V256 PolarHBondContact O-N 3.07Å; S253-I332 VanDerWaalsContact CB-CG2 3.47Å; S253-A333 PolarHBondContact N-O 2.87Å
254	E	57.3	Low	60.8	Low	169 Å²	169	96.5 Å²	96.5	79%	0.79	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-9	174.8	-56.4	179.2	152.6	0	0	112.8	V256	E254-V256 VanDerWaalsContact C-N 3.35Å
255	S	64.6	Low	63.3	Low	93 Å²	93	91.3 Å²	91.3	65%	0.65	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-13.9	175.9	62.3	0	0	0	0	114.6	S253	S253-S255 PolarHBondContact O-N 3.3Å; S253-S255 VanDerWaalsContact O-N 3.09Å; S253-S255 PolarHBondContact OG-N 3.08Å; S253-S255 PolarHBondContact OG-OG 3.02Å
256	V	74.2	Confident	65.3	Low	19 Å²	19	88.8 Å²	88.8	12%	0.115	48%	0.479	C	S	.	.	S	Bend	trans	-107.3	118.1	178.4	-171.1	0	0	0	0	109.1	S253 E254 V329 I332 S334	S253-V256 PolarHBondContact O-N 3.07Å; E254-V256 VanDerWaalsContact C-N 3.35Å; V256-V329 HydrophobicContact CG1-CB 4.43Å; V256-V329 HydrophobicContact CG1-CG2 3.95Å; V256-I332 HydrophobicContact CG2-CB 4.23Å; V256-I332 HydrophobicContact CG2-CG2 3.73Å; V256-S334 WeakPolarHBondContact O-CA 3.02Å; V256-S334 WeakPolarHBondContact O-CB 3.45Å
257	Q	80.5	Confident	67	Low	134 Å²	134	81.8 Å²	81.8	63%	0.626	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-71.2	137.8	-178.3	-69.6	-172.8	-34.8	0	0	111.7	S279 S327	Q257-S279 WeakPolarHBondContact O-CB 3.34Å; Q257-S279 PolarHBondContact O-OG 3.15Å; Q257-S327 PolarHBondContact O-OG 2.81Å
258	P	85.5	Confident	68.5	Low	60 Å²	60	79.9 Å²	79.9	39%	0.39	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-65.4	156.1	172.6	29.7	-35.4	0	0	0	111.4	S279	P258-S279 WeakPolarHBondContact O-CB 3.4Å
259	P	87.6	Confident	69.4	Low	6 Å²	6	77.4 Å²	77.4	4%	0.039	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-68.8	167.9	167.5	32	-33.1	0	0	0	110.9	A277 Y285 V325 S337	P259-A277 WeakPolarHBondContact CB-O 3.34Å; P259-Y285 HydrophobicContact CB-CD1 4.31Å; P259-Y285 HydrophobicContact CB-CE1 3.96Å; P259-Y285 HydrophobicContact CG-CD1 4.28Å; P259-Y285 HydrophobicContact CG-CE1 4.36Å; P259-V325 WeakPolarHBondContact CD-O 3.14Å; P259-V325 HydrophobicContact CG-CB 3.66Å; P259-V325 HydrophobicContact CG-CG1 3.74Å; P259-V325 WeakPolarHBondContact CG-O 3.49Å; P259-S337 WeakPolarHBondContact O-CB 3.42Å
260	G	83.6	Confident	70.8	Confident	27 Å²	27	74.8 Å²	74.8	28%	0.278	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-64.2	161.8	172.6	0	0	0	0	0	112.5	A277	G260-A277 PolarHBondContact N-O 3.49Å
261	Q	87.5	Confident	71.6	Confident	66 Å²	66	71.6 Å²	71.6	31%	0.308	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-49.2	128.9	175.1	-165.5	-165.7	19.5	0	0	111	Q263 E338 T339	Q261-Q263 PolarHBondContact O-N 3.3Å; Q261-E338 HydrophobicContact CB-CB 4.49Å; Q261-E338 HydrophobicContact CG-CB 4.32Å; Q261-T339 WeakPolarHBondContact CG-O 3.3Å; Q261-T339 PolarHBondContact NE2-O 3.05Å
262	P	88.4	Confident	73.1	Confident	1 Å²	1	63 Å²	63	1%	0.006	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-70.8	127.8	177.5	26.9	-31.7	0	0	0	110.8	W276 F323 V325 S337 E338 S340	P262-W276 HydrophobicContact CB-CE3 4.46Å; P262-F323 HydrophobicContact CG-CB 4.32Å; P262-F323 VanDerWaalsContact CG-O 3.3Å; P262-F323 WeakPolarHBondContact CG-O 3.39Å; P262-V325 HydrophobicContact CB-CG2 3.8Å; P262-V325 HydrophobicContact CG-CG2 3.94Å; P262-S337 WeakPolarHBondContact CD-OG 3.34Å; P262-E338 WeakPolarHBondContact CD-O 3.44Å; P262-S340 WeakPolarHBondContact O-CA 3.3Å; P262-S340 VanDerWaalsContact O-CB 3.29Å; P262-S340 WeakPolarHBondContact O-CB 3.27Å
263	Q	82.9	Confident	74.4	Confident	127 Å²	127	62.8 Å²	62.8	59%	0.593	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.7	139.3	-179.1	-62.5	-160.3	-31.6	0	0	111.7	Q261 V265 L274 E275	Q261-Q263 PolarHBondContact O-N 3.3Å; Q263-V265 PolarHBondContact O-N 3.29Å; Q263-L274 WeakPolarHBondContact O-CA 3.48Å; Q263-E275 PolarHBondContact N-O 3.17Å; Q263-E275 PolarHBondContact O-N 3.05Å; Q263-E275 VanDerWaalsContact O-N 3.08Å
264	M	77.1	Confident	75.8	Confident	110 Å²	110	60.8 Å²	60.8	54%	0.542	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	116.1	177.6	-175.7	-163.9	79.5	0	0	110.7	V267 I343	M264-V267 HydrophobicContact CE-CG2 4.49Å; M264-V267 HydrophobicContact CG-CG2 3.48Å; M264-V267 VanDerWaalsContact CG-CG2 3.48Å; M264-V267 HydrophobicContact SD-CG2 3.4Å; M264-V267 WeakPolarHBondContact SD-CG2 3.47Å; M264-I343 HydrophobicContact CB-CD1 3.7Å; M264-I343 HydrophobicContact CB-CG1 4.13Å; M264-I343 HydrophobicContact CG-CD1 3.89Å; M264-I343 HydrophobicContact CG-CG1 4.18Å; M264-I343 HydrophobicContact CG-CG2 4.24Å; M264-I343 HydrophobicContact SD-CG1 4.22Å; M264-I343 HydrophobicContact SD-CG2 3.95Å
265	V	81.4	Confident	77.4	Confident	72 Å²	72	57.7 Å²	57.7	44%	0.436	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-41.9	177	-179.2	0	0	0	0	111.3	Q263 K273 E275	Q263-V265 PolarHBondContact O-N 3.29Å; V265-K273 HydrophobicContact CB-CG 4.48Å; V265-K273 PolarHBondContact N-O 3.29Å; V265-E275 HydrophobicContact CG2-CB 3.82Å; V265-E275 HydrophobicContact CG2-CG 3.79Å
266	E	73.7	Confident	78.7	Confident	121 Å²	121	54.1 Å²	54.1	57%	0.565	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-153.9	145.7	-174.9	-165.6	169.3	-171.5	0	0	110.2	K273	E266-K273 HydrophobicContact CB-CB 3.98Å; E266-K273 HydrophobicContact CB-CD 4.23Å; E266-K273 PolarHBondContact N-O 3.1Å; E266-K273 PolarHBondContact O-N 2.75Å; E266-K273 IonicContact OE2-NZ 2.64Å
267	V	67.8	Low	79.4	Confident	44 Å²	44	56 Å²	56	27%	0.267	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	124.7	-178.8	179.3	0	0	0	0	109.2	M264 V272 I343 L345	M264-V267 HydrophobicContact CE-CG2 4.49Å; M264-V267 HydrophobicContact CG-CG2 3.48Å; M264-V267 VanDerWaalsContact CG-CG2 3.48Å; M264-V267 HydrophobicContact SD-CG2 3.4Å; M264-V267 WeakPolarHBondContact SD-CG2 3.47Å; V267-V272 HydrophobicContact CG1-CG2 4.45Å; V267-V272 HydrophobicContact CG2-CG2 4.41Å; V267-I343 HydrophobicContact CG1-CG2 4.48Å; V267-I343 HydrophobicContact CG2-CG2 3.67Å; V267-L345 HydrophobicContact CG1-CD2 4.03Å; V267-L345 HydrophobicContact CG1-CG 4.45Å
268	G	60.9	Low	79.7	Confident	24 Å²	24	53.1 Å²	53.1	25%	0.247	30%	0.297	C	S	.	.			trans	-102.7	-160.3	169	0	0	0	0	0	111.8	V271 L345	G268-V271 PolarHBondContact N-O 2.84Å; G268-L345 WeakPolarHBondContact O-CD2 3.3Å
269	D	53.4	Low	79.2	Confident	50 Å²	50	51.5 Å²	51.5	27%	0.267	29%	0.287	S	S	.	.	S	Bend	trans	-74.3	-35.1	-178.6	-75.3	8	0	0	0	112.7	R317 P347	D269-R317 WeakPolarHBondContact O-CA 3.28Å; D269-R317 WeakPolarHBondContact O-CG 3.45Å; D269-P347 WeakPolarHBondContact OD1-CA 3.41Å
270	D	61.4	Low	78.7	Confident	54 Å²	54	54 Å²	54	29%	0.289	30%	0.302	S	S	.	.	S	Bend	trans	-137.1	19.2	-178.2	45.3	17.9	0	0	0	113.5	G314 L315 R317	D270-G314 PolarHBondContact O-N 3.48Å; D270-L315 WeakPolarHBondContact CA-O 3.24Å; D270-L315 VanDerWaalsContact CB-O 3.27Å; D270-L315 WeakPolarHBondContact CB-O 3.36Å; D270-L315 PolarHBondContact O-N 2.86Å; D270-R317 HydrophobicContact CB-CG 3.92Å; D270-R317 IonicContact OD2-CZ 3.52Å; D270-R317 IonicContact OD2-NE 2.78Å; D270-R317 PolarHBondContact OD2-NE 3.3Å; D270-R317 IonicContact OD2-NH2 3.89Å; D270-R317 PolarHBondContact OD2-NH2 3.13Å
271	V	70.2	Confident	77.9	Confident	34 Å²	34	61.1 Å²	61.1	21%	0.206	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	138.1	-176.4	57.3	0	0	0	0	111.6	G268 Q311 V312 E313	G268-V271 PolarHBondContact N-O 2.84Å; V271-Q311 HydrophobicContact CG2-CG 3.42Å; V271-Q311 VanDerWaalsContact CG2-CG 3.42Å; V271-V312 VanDerWaalsContact CA-O 3.3Å; V271-V312 WeakPolarHBondContact CA-O 3.28Å; V271-V312 WeakPolarHBondContact CG2-O 3.49Å; V271-E313 HydrophobicContact CB-CG 4.36Å; V271-E313 HydrophobicContact CG2-CG 3.8Å
272	V	78.8	Confident	77.4	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	134.9	173.7	176.8	0	0	0	0	109.6	V267 L274 V312 L315 F323 I343 L345	V267-V272 HydrophobicContact CG1-CG2 4.45Å; V267-V272 HydrophobicContact CG2-CG2 4.41Å; V272-L274 HydrophobicContact CG1-CD2 3.83Å; V272-L274 HydrophobicContact CG1-CG 4.05Å; V272-V312 PolarHBondContact N-O 3.25Å; V272-V312 PolarHBondContact O-N 3.36Å; V272-L315 HydrophobicContact CB-CD1 3.9Å; V272-L315 HydrophobicContact CG2-CD1 3.6Å; V272-F323 HydrophobicContact CB-CE2 4.38Å; V272-F323 HydrophobicContact CB-CZ 3.99Å; V272-F323 HydrophobicContact CG1-CE2 4.06Å; V272-F323 HydrophobicContact CG1-CZ 4.09Å; V272-F323 HydrophobicContact CG2-CE2 4.36Å; V272-F323 HydrophobicContact CG2-CZ 4.12Å; V272-I343 HydrophobicContact CG1-CD1 3.67Å; V272-I343 HydrophobicContact CG1-CG2 4.03Å; V272-I343 HydrophobicContact CG2-CG2 3.74Å; V272-L345 HydrophobicContact CG2-CD2 3.82Å; V272-L345 HydrophobicContact CG2-CG 4.16Å
273	K	83.6	Confident	77.1	Confident	66 Å²	66	65.8 Å²	65.8	29%	0.287	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	130.2	175.5	-172.1	179.8	171.6	-172.4	0	110.7	V265 E266 I310	V265-K273 HydrophobicContact CB-CG 4.48Å; V265-K273 PolarHBondContact N-O 3.29Å; E266-K273 HydrophobicContact CB-CB 3.98Å; E266-K273 HydrophobicContact CB-CD 4.23Å; E266-K273 PolarHBondContact N-O 3.1Å; E266-K273 PolarHBondContact O-N 2.75Å; E266-K273 IonicContact OE2-NZ 2.64Å; K273-I310 WeakPolarHBondContact CA-O 3.3Å
274	L	91.3	Very high	77.3	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.7	-171.4	-60.1	169	0	0	0	111	Q263 V272 W276 V287 G309 I310 V312 F323 I343	Q263-L274 WeakPolarHBondContact O-CA 3.48Å; V272-L274 HydrophobicContact CG1-CD2 3.83Å; V272-L274 HydrophobicContact CG1-CG 4.05Å; L274-W276 HydrophobicContact CB-CE3 4.48Å; L274-W276 HydrophobicContact CB-CZ3 4.27Å; L274-V287 HydrophobicContact CD1-CG1 4.09Å; L274-G309 CarbonylContact O-C 3.59Å; L274-G309 WeakPolarHBondContact O-CA 3.5Å; L274-I310 PolarHBondContact N-O 3.41Å; L274-I310 PolarHBondContact O-N 3.5Å; L274-V312 HydrophobicContact CD1-CG2 4.44Å; L274-F323 HydrophobicContact CD1-CB 3.74Å; L274-F323 HydrophobicContact CD1-CD1 3.44Å; L274-F323 VanDerWaalsContact CD1-CD1 3.44Å; L274-F323 HydrophobicContact CD1-CD2 4.21Å; L274-F323 HydrophobicContact CD1-CE1 4.06Å; L274-F323 HydrophobicContact CD1-CG 3.54Å; L274-F323 HydrophobicContact CD2-CD2 4.44Å; L274-F323 HydrophobicContact CD2-CG 4.48Å; L274-I343 HydrophobicContact CD2-CD1 3.65Å
275	E	90.8	Very high	77.8	Confident	104 Å²	104	58.8 Å²	58.8	49%	0.486	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	152	167.7	-72.1	176.7	-158.4	0	0	110	Q263 V265 N308	Q263-E275 PolarHBondContact N-O 3.17Å; Q263-E275 PolarHBondContact O-N 3.05Å; Q263-E275 VanDerWaalsContact O-N 3.08Å; V265-E275 HydrophobicContact CG2-CB 3.82Å; V265-E275 HydrophobicContact CG2-CG 3.79Å; E275-N308 CarbonylContact C-O 3.55Å; E275-N308 WeakPolarHBondContact CA-O 3.28Å
276	W	92.6	Very high	77.9	Confident	17 Å²	17	55.8 Å²	55.8	6%	0.064	30%	0.3	C	S	.	.			trans	-143.6	161.1	-177.8	53.4	88.8	0	0	0	112.9	P262 L274 Y285 V287 I305 Q307 N308 G309 I310 V325	P262-W276 HydrophobicContact CB-CE3 4.46Å; L274-W276 HydrophobicContact CB-CE3 4.48Å; L274-W276 HydrophobicContact CB-CZ3 4.27Å; W276-Y285 HydrophobicContact CZ2-CD2 4.09Å; W276-Y285 AromaticContact CZ2-CG 3.91Å; W276-Y285 HydrophobicContact CZ2-CG 3.91Å; W276-Y285 AromaticContact NE1-CD1 3.6Å; W276-Y285 AromaticContact NE1-CD2 3.65Å; W276-Y285 AromaticContact NE1-CE1 3.82Å; W276-Y285 AromaticContact NE1-CE2 3.86Å; W276-Y285 AromaticContact NE1-CG 3.52Å; W276-Y285 AromaticContact NE1-CZ 3.93Å; W276-V287 HydrophobicContact CH2-CG2 3.36Å; W276-V287 HydrophobicContact CZ2-CG2 4.21Å; W276-V287 HydrophobicContact CZ3-CG2 3.59Å; W276-I305 HydrophobicContact CH2-CD1 4.05Å; W276-I305 HydrophobicContact CZ2-CD1 4.2Å; W276-Q307 WeakPolarHBondContact CZ2-O 3.29Å; W276-N308 VanDerWaalsContact CE2-C 3.43Å; W276-N308 PolarHBondContact N-O 2.88Å; W276-G309 VanDerWaalsContact CZ3-CA 3.46Å; W276-I310 HydrophobicContact CH2-CB 4.2Å; W276-I310 HydrophobicContact CH2-CG2 4.24Å; W276-I310 HydrophobicContact CZ3-CB 4.46Å; W276-I310 HydrophobicContact CZ3-CG2 4.14Å; W276-V325 HydrophobicContact CD2-CG1 4.15Å; W276-V325 HydrophobicContact CD2-CG2 4.01Å; W276-V325 HydrophobicContact CE3-CG2 3.87Å; W276-V325 HydrophobicContact CG-CG2 4.47Å; W276-V325 HydrophobicContact CH2-CG1 4.46Å; W276-V325 HydrophobicContact CZ2-CG1 3.99Å; W276-V325 HydrophobicContact CZ3-CG2 4.22Å
277	A	89.3	Confident	78.6	Confident	59 Å²	59	50 Å²	50	49%	0.488	27%	0.273	S	S	.	.			trans	-73.2	129.6	170.6	0	0	0	0	0	110.6	P259 G260	P259-A277 WeakPolarHBondContact CB-O 3.34Å; G260-A277 PolarHBondContact N-O 3.49Å
278	P	85.2	Confident	79.5	Confident	74 Å²	74	48.9 Å²	48.9	48%	0.481	27%	0.265	S	S	.	.			trans	-67.2	144.1	177.6	26.9	-33.9	0	0	0	111.9	Y285	P278-Y285 VanDerWaalsContact CA-OH 3.3Å; P278-Y285 WeakPolarHBondContact CA-OH 3.09Å; P278-Y285 VanDerWaalsContact CB-OH 3.3Å; P278-Y285 WeakPolarHBondContact CB-OH 3.4Å
279	S	75.6	Confident	80.5	Confident	25 Å²	25	50 Å²	50	18%	0.175	26%	0.262	C	S	.	.			trans	-81	-58.2	178.5	56.7	0	0	0	0	112.8	Q257 P258 Y285 S327	Q257-S279 WeakPolarHBondContact O-CB 3.34Å; Q257-S279 PolarHBondContact O-OG 3.15Å; P258-S279 WeakPolarHBondContact O-CB 3.4Å; S279-Y285 PolarHBondContact N-OH 3.42Å; S279-S327 WeakPolarHBondContact OG-CB 3.08Å; S279-S327 PolarHBondContact OG-OG 3.19Å
280	V	76.6	Confident	81.3	Confident	60 Å²	60	50.6 Å²	50.6	36%	0.364	26%	0.26	S	S	.	.	S	Bend	trans	-143.1	160.6	-177.2	-62	0	0	0	0	112.3	A283 V329	V280-A283 HydrophobicContact CG2-CB 4Å; V280-A283 WeakPolarHBondContact O-CB 3.21Å; V280-A283 PolarHBondContact O-N 3.2Å; V280-V329 HydrophobicContact CG2-CG2 3.59Å
281	Q	68	Low	81.2	Confident	176 Å²	176	50.7 Å²	50.7	82%	0.822	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	141.5	175.1	-67.5	-176.9	-9.8	0	0	111	A283	Q281-A283 PolarHBondContact O-N 3.44Å
282	N	76	Confident	80.3	Confident	157 Å²	157	51.8 Å²	51.8	84%	0.84	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	10.9	-176.4	-50.1	-35.5	0	0	0	116.2
283	A	82.4	Confident	78.5	Confident	8 Å²	8	55.4 Å²	55.4	7%	0.066	30%	0.303	C	S	.	.			trans	-64.4	146.4	169.7	0	0	0	0	0	112.3	V280 Q281 Y285 V329	V280-A283 HydrophobicContact CG2-CB 4Å; V280-A283 WeakPolarHBondContact O-CB 3.21Å; V280-A283 PolarHBondContact O-N 3.2Å; Q281-A283 PolarHBondContact O-N 3.44Å; A283-Y285 HydrophobicContact CB-CE1 4.16Å; A283-V329 HydrophobicContact CB-CG2 4.11Å
284	R	86.8	Confident	76.6	Confident	86 Å²	86	54.7 Å²	54.7	33%	0.325	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	155	163.6	-65.7	-178	-68.3	153.7	-2.2	110	P304 I305 V306 S327 I328 N331	R284-P304 HydrophobicContact CB-CB 3.64Å; R284-I305 CarbonylContact C-O 3.56Å; R284-I305 WeakPolarHBondContact CA-O 3.49Å; R284-I305 WeakPolarHBondContact CB-O 3.37Å; R284-V306 HydrophobicContact CG-CG1 3.87Å; R284-S327 CarbonylContact O-C 3.54Å; R284-S327 WeakPolarHBondContact O-CA 3.42Å; R284-I328 PolarHBondContact N-O 3.17Å; R284-I328 PolarHBondContact O-N 3.33Å; R284-N331 PolarHBondContact NH2-OD1 3.32Å
285	Y	87	Confident	74.4	Confident	4 Å²	4	59 Å²	59	2%	0.016	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	143.3	-172.4	-53.7	-75.6	0	0	0	113	P259 W276 P278 S279 A283 N301 P304 I305 Q307 N308 V325 I326	P259-Y285 HydrophobicContact CB-CD1 4.31Å; P259-Y285 HydrophobicContact CB-CE1 3.96Å; P259-Y285 HydrophobicContact CG-CD1 4.28Å; P259-Y285 HydrophobicContact CG-CE1 4.36Å; W276-Y285 HydrophobicContact CZ2-CD2 4.09Å; W276-Y285 AromaticContact CZ2-CG 3.91Å; W276-Y285 HydrophobicContact CZ2-CG 3.91Å; W276-Y285 AromaticContact NE1-CD1 3.6Å; W276-Y285 AromaticContact NE1-CD2 3.65Å; W276-Y285 AromaticContact NE1-CE1 3.82Å; W276-Y285 AromaticContact NE1-CE2 3.86Å; W276-Y285 AromaticContact NE1-CG 3.52Å; W276-Y285 AromaticContact NE1-CZ 3.93Å; P278-Y285 VanDerWaalsContact CA-OH 3.3Å; P278-Y285 WeakPolarHBondContact CA-OH 3.09Å; P278-Y285 VanDerWaalsContact CB-OH 3.3Å; P278-Y285 WeakPolarHBondContact CB-OH 3.4Å; S279-Y285 PolarHBondContact N-OH 3.42Å; A283-Y285 HydrophobicContact CB-CE1 4.16Å; Y285-N301 PolarHBondContact O-ND2 3.26Å; Y285-P304 CarbonylContact O-C 3.44Å; Y285-P304 VanDerWaalsContact O-CA 3.31Å; Y285-P304 WeakPolarHBondContact O-CA 3.49Å; Y285-I305 PolarHBondContact N-O 3.1Å; Y285-I305 PolarHBondContact O-N 2.81Å; Y285-Q307 WeakPolarHBondContact CD2-O 3.49Å; Y285-N308 WeakPolarHBondContact CE2-OD1 3.2Å; Y285-V325 HydrophobicContact CD1-CG1 4.05Å; Y285-V325 HydrophobicContact CG-CG1 4.3Å; Y285-I326 WeakPolarHBondContact CA-O 3.46Å
286	I	84.8	Confident	72.5	Confident	8 Å²	8	60.3 Å²	60.3	4%	0.041	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	134.9	159.6	-72.7	-166.6	0	0	0	108	E288 T299 N301 P304 V325 I326 I328	I286-E288 HydrophobicContact CG2-CG 4.16Å; I286-T299 HydrophobicContact CG2-CG2 3.5Å; I286-T299 VanDerWaalsContact CG2-CG2 3.5Å; I286-N301 WeakPolarHBondContact CD1-O 3.44Å; I286-N301 WeakPolarHBondContact CG1-O 3.43Å; I286-P304 HydrophobicContact CD1-CG 4.12Å; I286-P304 HydrophobicContact CG1-CB 4.25Å; I286-P304 HydrophobicContact CG1-CG 4.06Å; I286-V325 WeakPolarHBondContact O-CA 3.5Å; I286-V325 WeakPolarHBondContact O-CG1 3.26Å; I286-I326 PolarHBondContact N-O 3.4Å; I286-I326 PolarHBondContact O-N 2.94Å; I286-I328 HydrophobicContact CD1-CD1 4.21Å; I286-I328 HydrophobicContact CG1-CD1 3.9Å
287	V	88.6	Confident	71.5	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	132.5	170.7	-176	0	0	0	0	108.9	L274 W276 A300 N301 I310 F323 C324 V325	L274-V287 HydrophobicContact CD1-CG1 4.09Å; W276-V287 HydrophobicContact CH2-CG2 3.36Å; W276-V287 HydrophobicContact CZ2-CG2 4.21Å; W276-V287 HydrophobicContact CZ3-CG2 3.59Å; V287-A300 HydrophobicContact CB-CB 4.23Å; V287-A300 HydrophobicContact CG1-CB 4.43Å; V287-A300 WeakPolarHBondContact O-CB 3.28Å; V287-A300 PolarHBondContact O-N 3.06Å; V287-N301 PolarHBondContact N-OD1 2.88Å; V287-I310 HydrophobicContact CB-CG2 4.24Å; V287-I310 HydrophobicContact CG1-CG2 4.42Å; V287-I310 HydrophobicContact CG2-CB 4.48Å; V287-I310 HydrophobicContact CG2-CG2 3.72Å; V287-F323 HydrophobicContact CG1-CD1 4.25Å; V287-C324 WeakPolarHBondContact CA-O 3.33Å; V287-V325 HydrophobicContact CG1-CG2 4.46Å; V287-V325 HydrophobicContact CG2-CG1 4.21Å; V287-V325 HydrophobicContact CG2-CG2 4.04Å
288	E	86.8	Confident	70.3	Confident	21 Å²	21	64.3 Å²	64.3	10%	0.098	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	147.2	171.7	-62.8	-177.7	163	0	0	108.9	I286 W297 H298 F323 C324 I326	I286-E288 HydrophobicContact CG2-CG 4.16Å; E288-W297 HydrophobicContact CB-CB 4.43Å; E288-W297 HydrophobicContact CB-CE3 3.98Å; E288-H298 CarbonylContact C-O 3.57Å; E288-H298 VanDerWaalsContact CA-O 3.23Å; E288-H298 WeakPolarHBondContact CA-O 3.38Å; E288-F323 CarbonylContact O-C 3.57Å; E288-F323 WeakPolarHBondContact O-CA 3.32Å; E288-C324 PolarHBondContact N-O 3.31Å; E288-C324 PolarHBondContact O-N 2.8Å; E288-I326 HydrophobicContact CG-CD1 4.41Å
289	Y	81.1	Confident	69.9	Low	46 Å²	46	62.1 Å²	62.1	18%	0.18	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	155	-176.1	73.1	-80.8	0	0	0	111.1	H298 A300 V312 L315 Y321 E322 F323	Y289-H298 HydrophobicContact CD1-CB 3.99Å; Y289-H298 WeakPolarHBondContact CD1-O 3.4Å; Y289-H298 HydrophobicContact CD2-CB 4.41Å; Y289-H298 HydrophobicContact CE1-CB 3.64Å; Y289-H298 HydrophobicContact CE2-CB 4.08Å; Y289-H298 HydrophobicContact CG-CB 4.37Å; Y289-H298 PolarHBondContact N-O 3.37Å; Y289-H298 WeakPolarHBondContact O-CA 3.41Å; Y289-H298 WeakPolarHBondContact O-CB 3.45Å; Y289-H298 PolarHBondContact O-N 2.97Å; Y289-A300 HydrophobicContact CD1-CB 3.86Å; Y289-A300 HydrophobicContact CE1-CB 4.15Å; Y289-V312 HydrophobicContact CD1-CG1 4.4Å; Y289-V312 HydrophobicContact CE1-CG1 4.45Å; Y289-L315 HydrophobicContact CD2-CD2 3.59Å; Y289-L315 HydrophobicContact CE2-CD2 3.4Å; Y289-L315 HydrophobicContact CG-CD2 4.44Å; Y289-Y321 AromaticContact CD2-CD1 3.76Å; Y289-Y321 HydrophobicContact CD2-CD1 3.76Å; Y289-Y321 AromaticContact CD2-CE1 3.88Å; Y289-Y321 HydrophobicContact CD2-CE1 3.88Å; Y289-Y321 HydrophobicContact CE2-CD1 4.4Å; Y289-Y321 HydrophobicContact CE2-CE1 4.07Å; Y289-E322 CarbonylContact C-O 3.56Å; Y289-E322 VanDerWaalsContact CA-O 3.29Å; Y289-E322 WeakPolarHBondContact CA-O 3.44Å; Y289-F323 HydrophobicContact CG-CD1 4.41Å; Y289-F323 HydrophobicContact CG-CE1 4.09Å
290	R	70.9	Confident	69.6	Low	64 Å²	64	62.4 Å²	62.4	24%	0.242	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	150.1	172.7	64	173.4	-177.5	173.2	-1.3	111.2	D294 E296 W297 Y321 E322	R290-D294 WeakPolarHBondContact CD-O 3.48Å; R290-D294 PolarHBondContact NH1-O 3.06Å; R290-E296 WeakPolarHBondContact CB-O 3.18Å; R290-W297 HydrophobicContact CB-CD2 4.29Å; R290-W297 HydrophobicContact CB-CE3 4.21Å; R290-W297 HydrophobicContact CG-CD2 4.09Å; R290-W297 HydrophobicContact CG-CE3 4.03Å; R290-W297 HydrophobicContact CG-CH2 3.89Å; R290-W297 HydrophobicContact CG-CZ2 3.96Å; R290-W297 HydrophobicContact CG-CZ3 3.93Å; R290-W297 VanDerWaalsContact NE-CZ2 3.28Å; R290-Y321 VanDerWaalsContact O-CA 3.26Å; R290-Y321 WeakPolarHBondContact O-CA 3.17Å; R290-Y321 VanDerWaalsContact O-CD1 3.24Å; R290-Y321 WeakPolarHBondContact O-CD1 3.35Å; R290-E322 HydrophobicContact CG-CB 4.24Å; R290-E322 IonicContact CZ-OE2 3.63Å; R290-E322 PolarHBondContact N-O 3.33Å; R290-E322 IonicContact NE-OE2 2.77Å; R290-E322 PolarHBondContact NE-OE2 2.94Å; R290-E322 IonicContact NH2-OE2 3.71Å; R290-E322 PolarHBondContact NH2-OE2 2.84Å; R290-E322 PolarHBondContact O-N 2.76Å
291	E	58.8	Low	69.5	Low	56 Å²	56	60.4 Å²	60.4	26%	0.262	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	140.2	168.7	-156.2	165.2	154.9	0	0	108.6	G293 D294 H316 S319 T320 Y321	E291-G293 PolarHBondContact O-N 3.06Å; E291-G293 VanDerWaalsContact O-N 3.12Å; E291-D294 HydrophobicContact CB-CB 4.33Å; E291-D294 WeakPolarHBondContact O-CB 3.25Å; E291-D294 PolarHBondContact O-N 3.25Å; E291-H316 IonicContact OE2-CE1 3.17Å; E291-H316 IonicContact OE2-CG 2.81Å; E291-H316 IonicContact OE2-ND1 2.69Å; E291-H316 PolarHBondContact OE2-ND1 2.95Å; E291-S319 VanDerWaalsContact CD-CB 3.46Å; E291-S319 VanDerWaalsContact CD-OG 3.3Å; E291-S319 WeakPolarHBondContact OE1-CB 3.44Å; E291-S319 PolarHBondContact OE1-OG 3.03Å; E291-T320 CarbonylContact C-O 3.52Å; E291-T320 WeakPolarHBondContact CA-O 3.45Å; E291-T320 WeakPolarHBondContact CG-O 3.46Å; E291-Y321 HydrophobicContact CB-CD1 4.21Å; E291-Y321 HydrophobicContact CB-CE1 3.78Å; E291-Y321 HydrophobicContact CG-CE1 4.16Å; E291-Y321 PolarHBondContact OE2-OH 3.45Å
292	V	50.3	Low	69.5	Low	56 Å²	56	60.6 Å²	60.6	34%	0.339	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	116.7	-173.7	176.2	0	0	0	0	110.2	T320 E322 I342	V292-T320 PolarHBondContact N-O 3.3Å; V292-E322 HydrophobicContact CG2-CG 3.93Å; V292-I342 HydrophobicContact CG1-CD1 4.19Å; V292-I342 HydrophobicContact CG2-CB 4.46Å; V292-I342 HydrophobicContact CG2-CD1 4.17Å; V292-I342 HydrophobicContact CG2-CG1 3.95Å; V292-I342 HydrophobicContact CG2-CG2 3.82Å
293	G	41.6	Very low	69.4	Low	77 Å²	77	59.7 Å²	59.7	79%	0.794	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.8	-11.7	-172	0	0	0	0	0	113.9	E291	E291-G293 PolarHBondContact O-N 3.06Å; E291-G293 VanDerWaalsContact O-N 3.12Å
294	D	43.5	Very low	69.4	Low	51 Å²	51	60.5 Å²	60.5	27%	0.273	31%	0.313	S	S	.	.			trans	-74.9	128.7	168.7	-163.8	-24.4	0	0	0	110.1	R290 E291 E296 H298	R290-D294 WeakPolarHBondContact CD-O 3.48Å; R290-D294 PolarHBondContact NH1-O 3.06Å; E291-D294 HydrophobicContact CB-CB 4.33Å; E291-D294 WeakPolarHBondContact O-CB 3.25Å; E291-D294 PolarHBondContact O-N 3.25Å; D294-E296 VanDerWaalsContact C-N 3.3Å; D294-E296 PolarHBondContact OD1-N 2.92Å; D294-H298 IonicContact OD2-CE1 3.39Å
295	P	45.5	Very low	69.3	Low	90 Å²	90	58.3 Å²	58.3	58%	0.584	31%	0.307	S	S	*	.	S	Bend	trans	-70.9	-20.5	171.1	29	-35.3	0	0	0	113.7
296	E	51.4	Low	69.1	Low	132 Å²	132	63.4 Å²	63.4	62%	0.617	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-96.9	125.4	-171.7	-61.3	-162.3	162.6	0	0	113.7	R290 D294 H298	R290-E296 WeakPolarHBondContact CB-O 3.18Å; D294-E296 VanDerWaalsContact C-N 3.3Å; D294-E296 PolarHBondContact OD1-N 2.92Å; E296-H298 PolarHBondContact O-ND1 3.18Å
297	W	70.9	Confident	69.1	Low	83 Å²	83	69.6 Å²	69.6	31%	0.314	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-85.3	119.2	172.5	-75.5	91.5	0	0	0	110.4	E288 R290 E322 C324 T339	E288-W297 HydrophobicContact CB-CB 4.43Å; E288-W297 HydrophobicContact CB-CE3 3.98Å; R290-W297 HydrophobicContact CB-CD2 4.29Å; R290-W297 HydrophobicContact CB-CE3 4.21Å; R290-W297 HydrophobicContact CG-CD2 4.09Å; R290-W297 HydrophobicContact CG-CE3 4.03Å; R290-W297 HydrophobicContact CG-CH2 3.89Å; R290-W297 HydrophobicContact CG-CZ2 3.96Å; R290-W297 HydrophobicContact CG-CZ3 3.93Å; R290-W297 VanDerWaalsContact NE-CZ2 3.28Å; W297-E322 HydrophobicContact CH2-CB 4.03Å; W297-E322 WeakPolarHBondContact CZ3-O 3.27Å; W297-C324 HydrophobicContact CH2-CB 4.2Å; W297-C324 HydrophobicContact CZ3-CB 4.2Å; W297-C324 VanDerWaalsContact CZ3-SG 3.55Å; W297-T339 HydrophobicContact CH2-CG2 3.64Å; W297-T339 HydrophobicContact CZ2-CG2 3.83Å
298	H	63.4	Low	69.1	Low	76 Å²	76	72.8 Å²	72.8	35%	0.352	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	137.2	179.6	-65	67.4	0	0	0	110	E288 Y289 D294 E296	E288-H298 CarbonylContact C-O 3.57Å; E288-H298 VanDerWaalsContact CA-O 3.23Å; E288-H298 WeakPolarHBondContact CA-O 3.38Å; Y289-H298 HydrophobicContact CD1-CB 3.99Å; Y289-H298 WeakPolarHBondContact CD1-O 3.4Å; Y289-H298 HydrophobicContact CD2-CB 4.41Å; Y289-H298 HydrophobicContact CE1-CB 3.64Å; Y289-H298 HydrophobicContact CE2-CB 4.08Å; Y289-H298 HydrophobicContact CG-CB 4.37Å; Y289-H298 PolarHBondContact N-O 3.37Å; Y289-H298 WeakPolarHBondContact O-CA 3.41Å; Y289-H298 WeakPolarHBondContact O-CB 3.45Å; Y289-H298 PolarHBondContact O-N 2.97Å; D294-H298 IonicContact OD2-CE1 3.39Å; E296-H298 PolarHBondContact O-ND1 3.18Å
299	T	76.9	Confident	69.1	Low	28 Å²	28	72.5 Å²	72.5	17%	0.172	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	120.3	-179.5	-48.9	0	0	0	0	111.5	I286 N301 Y302	I286-T299 HydrophobicContact CG2-CG2 3.5Å; I286-T299 VanDerWaalsContact CG2-CG2 3.5Å; T299-N301 WeakPolarHBondContact CG2-O 3.49Å; T299-Y302 HydrophobicContact CG2-CD1 4.09Å; T299-Y302 HydrophobicContact CG2-CE1 4.28Å
300	A	70.9	Confident	69.4	Low	32 Å²	32	71.8 Å²	71.8	26%	0.264	39%	0.386	S	S	.	.	S	Bend	trans	-75.7	-32.4	177.5	0	0	0	0	0	113.1	V287 Y289 V312	V287-A300 HydrophobicContact CB-CB 4.23Å; V287-A300 HydrophobicContact CG1-CB 4.43Å; V287-A300 WeakPolarHBondContact O-CB 3.28Å; V287-A300 PolarHBondContact O-N 3.06Å; Y289-A300 HydrophobicContact CD1-CB 3.86Å; Y289-A300 HydrophobicContact CE1-CB 4.15Å; A300-V312 HydrophobicContact CB-CB 4.46Å; A300-V312 HydrophobicContact CB-CG1 3.84Å; A300-V312 HydrophobicContact CB-CG2 3.79Å
301	N	74.3	Confident	70.2	Confident	17 Å²	17	73.6 Å²	73.6	9%	0.091	40%	0.397	C	S	.	.			trans	-136.4	111	175.5	68	-70.2	0	0	0	112.4	Y285 I286 V287 T299 D303 I310	Y285-N301 PolarHBondContact O-ND2 3.26Å; I286-N301 WeakPolarHBondContact CD1-O 3.44Å; I286-N301 WeakPolarHBondContact CG1-O 3.43Å; V287-N301 PolarHBondContact N-OD1 2.88Å; T299-N301 WeakPolarHBondContact CG2-O 3.49Å; N301-D303 PolarHBondContact ND2-O 2.89Å; N301-I310 HydrophobicContact CB-CD1 3.69Å
302	Y	68.3	Low	71.1	Confident	180 Å²	180	71.2 Å²	71.2	71%	0.706	39%	0.386	S	S	*	.	S	Bend	trans	-69.7	-33.9	178.5	-61.6	-74.5	0	0	0	112.8	T299	T299-Y302 HydrophobicContact CG2-CD1 4.09Å; T299-Y302 HydrophobicContact CG2-CE1 4.28Å
303	D	73	Confident	72.5	Confident	138 Å²	138	74.9 Å²	74.9	74%	0.738	40%	0.4	S	S	*	.	S	Bend	trans	-86.5	122.6	171.7	-80.9	-49.7	0	0	0	111.1	N301 I305	N301-D303 PolarHBondContact ND2-O 2.89Å; D303-I305 PolarHBondContact O-N 3.44Å
304	P	81.6	Confident	73.2	Confident	25 Å²	25	74.2 Å²	74.2	16%	0.162	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-66.3	121.3	-178.8	-23.3	33.9	0	0	0	114	R284 Y285 I286 I328	R284-P304 HydrophobicContact CB-CB 3.64Å; Y285-P304 CarbonylContact O-C 3.44Å; Y285-P304 VanDerWaalsContact O-CA 3.31Å; Y285-P304 WeakPolarHBondContact O-CA 3.49Å; I286-P304 HydrophobicContact CD1-CG 4.12Å; I286-P304 HydrophobicContact CG1-CB 4.25Å; I286-P304 HydrophobicContact CG1-CG 4.06Å; P304-I328 HydrophobicContact CB-CD1 3.85Å; P304-I328 HydrophobicContact CG-CD1 3.69Å
305	I	84.7	Confident	74.4	Confident	41 Å²	41	72 Å²	72	21%	0.21	38%	0.381	C	S	.	.	B	Isolated β-bridge	trans	-84.4	152.7	-178.8	60.5	168.7	0	0	0	112.6	W276 R284 Y285 D303 Q307 G309 I310	W276-I305 HydrophobicContact CH2-CD1 4.05Å; W276-I305 HydrophobicContact CZ2-CD1 4.2Å; R284-I305 CarbonylContact C-O 3.56Å; R284-I305 WeakPolarHBondContact CA-O 3.49Å; R284-I305 WeakPolarHBondContact CB-O 3.37Å; Y285-I305 PolarHBondContact N-O 3.1Å; Y285-I305 PolarHBondContact O-N 2.81Å; D303-I305 PolarHBondContact O-N 3.44Å; I305-Q307 HydrophobicContact CD1-CB 4.46Å; I305-G309 WeakPolarHBondContact CD1-O 3.45Å; I305-I310 HydrophobicContact CD1-CB 4.11Å; I305-I310 HydrophobicContact CD1-CD1 4.18Å; I305-I310 HydrophobicContact CD1-CG1 4.28Å
306	V	84.6	Confident	74.9	Confident	110 Å²	110	73.1 Å²	73.1	67%	0.667	38%	0.378	S	S	*	.	S	Bend	trans	-92.5	1.8	173.9	-66.9	0	0	0	0	113.6	R284	R284-V306 HydrophobicContact CG-CG1 3.87Å
307	Q	84.2	Confident	74.9	Confident	138 Å²	138	72.6 Å²	72.6	65%	0.645	37%	0.37	S	S	*	.	S	Bend	trans	-99.5	146.9	-175.2	-57.3	-179.1	31.2	0	0	109.9	W276 Y285 I305 G309	W276-Q307 WeakPolarHBondContact CZ2-O 3.29Å; Y285-Q307 WeakPolarHBondContact CD2-O 3.49Å; I305-Q307 HydrophobicContact CD1-CB 4.46Å; Q307-G309 PolarHBondContact O-N 2.89Å
308	N	88.8	Confident	73.7	Confident	68 Å²	68	73.9 Å²	73.9	36%	0.364	38%	0.384	S	S	.	.	S	Bend	trans	-87.4	32.8	-178.8	-55.2	-27.3	0	0	0	112.4	E275 W276 Y285	E275-N308 CarbonylContact C-O 3.55Å; E275-N308 WeakPolarHBondContact CA-O 3.28Å; W276-N308 VanDerWaalsContact CE2-C 3.43Å; W276-N308 PolarHBondContact N-O 2.88Å; Y285-N308 WeakPolarHBondContact CE2-OD1 3.2Å
309	G	87.3	Confident	73	Confident	14 Å²	14	71.3 Å²	71.3	14%	0.144	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.3	156.8	-176.1	0	0	0	0	0	111.8	L274 W276 I305 Q307	L274-G309 CarbonylContact O-C 3.59Å; L274-G309 WeakPolarHBondContact O-CA 3.5Å; W276-G309 VanDerWaalsContact CZ3-CA 3.46Å; I305-G309 WeakPolarHBondContact CD1-O 3.45Å; Q307-G309 PolarHBondContact O-N 2.89Å
310	I	86.6	Confident	71.9	Confident	32 Å²	32	71.7 Å²	71.7	16%	0.164	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	158.8	179.6	-157.2	170.6	0	0	0	111.1	K273 L274 W276 V287 N301 I305 V312	K273-I310 WeakPolarHBondContact CA-O 3.3Å; L274-I310 PolarHBondContact N-O 3.41Å; L274-I310 PolarHBondContact O-N 3.5Å; W276-I310 HydrophobicContact CH2-CB 4.2Å; W276-I310 HydrophobicContact CH2-CG2 4.24Å; W276-I310 HydrophobicContact CZ3-CB 4.46Å; W276-I310 HydrophobicContact CZ3-CG2 4.14Å; V287-I310 HydrophobicContact CB-CG2 4.24Å; V287-I310 HydrophobicContact CG1-CG2 4.42Å; V287-I310 HydrophobicContact CG2-CB 4.48Å; V287-I310 HydrophobicContact CG2-CG2 3.72Å; N301-I310 HydrophobicContact CB-CD1 3.69Å; I305-I310 HydrophobicContact CD1-CB 4.11Å; I305-I310 HydrophobicContact CD1-CD1 4.18Å; I305-I310 HydrophobicContact CD1-CG1 4.28Å; I310-V312 HydrophobicContact CG2-CG2 3.77Å
311	Q	88.6	Confident	71.8	Confident	101 Å²	101	70.5 Å²	70.5	47%	0.472	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	121.2	165.1	-174.8	166.7	-63.6	0	0	108.2	V271 E313	V271-Q311 HydrophobicContact CG2-CG 3.42Å; V271-Q311 VanDerWaalsContact CG2-CG 3.42Å; Q311-E313 HydrophobicContact CG-CG 4.17Å; Q311-E313 PolarHBondContact NE2-OE1 3.33Å
312	V	77	Confident	72	Confident	7 Å²	7	71 Å²	71	4%	0.042	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.3	178.7	-170.7	0	0	0	0	108.3	V271 V272 L274 Y289 A300 I310 L315 F323	V271-V312 VanDerWaalsContact CA-O 3.3Å; V271-V312 WeakPolarHBondContact CA-O 3.28Å; V271-V312 WeakPolarHBondContact CG2-O 3.49Å; V272-V312 PolarHBondContact N-O 3.25Å; V272-V312 PolarHBondContact O-N 3.36Å; L274-V312 HydrophobicContact CD1-CG2 4.44Å; Y289-V312 HydrophobicContact CD1-CG1 4.4Å; Y289-V312 HydrophobicContact CE1-CG1 4.45Å; A300-V312 HydrophobicContact CB-CB 4.46Å; A300-V312 HydrophobicContact CB-CG1 3.84Å; A300-V312 HydrophobicContact CB-CG2 3.79Å; I310-V312 HydrophobicContact CG2-CG2 3.77Å; V312-L315 HydrophobicContact CB-CD1 4.3Å; V312-L315 HydrophobicContact CG1-CD1 4.2Å; V312-L315 HydrophobicContact CG1-CD2 4.01Å; V312-L315 HydrophobicContact CG1-CG 4.23Å; V312-F323 HydrophobicContact CB-CE1 4.19Å; V312-F323 HydrophobicContact CG1-CE1 4.26Å; V312-F323 HydrophobicContact CG2-CD1 4.46Å; V312-F323 HydrophobicContact CG2-CE1 4Å
313	E	78.9	Confident	73	Confident	132 Å²	132	62.4 Å²	62.4	62%	0.617	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	157.5	-172.4	-64.5	178.7	-175.6	0	0	111.6	V271 Q311	V271-E313 HydrophobicContact CB-CG 4.36Å; V271-E313 HydrophobicContact CG2-CG 3.8Å; Q311-E313 HydrophobicContact CG-CG 4.17Å; Q311-E313 PolarHBondContact NE2-OE1 3.33Å
314	G	56.3	Low	73.6	Confident	63 Å²	63	56 Å²	56	65%	0.649	30%	0.299	S	S	*	.	S	Bend	trans	82.9	19	177.6	0	0	0	0	0	114.3	D270	D270-G314 PolarHBondContact O-N 3.48Å
315	L	70.2	Confident	74	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.026	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-75	153.3	178.9	-60.4	168.3	0	0	0	111.3	D270 V272 Y289 V312 R317 Y321 F323 L345	D270-L315 WeakPolarHBondContact CA-O 3.24Å; D270-L315 VanDerWaalsContact CB-O 3.27Å; D270-L315 WeakPolarHBondContact CB-O 3.36Å; D270-L315 PolarHBondContact O-N 2.86Å; V272-L315 HydrophobicContact CB-CD1 3.9Å; V272-L315 HydrophobicContact CG2-CD1 3.6Å; Y289-L315 HydrophobicContact CD2-CD2 3.59Å; Y289-L315 HydrophobicContact CE2-CD2 3.4Å; Y289-L315 HydrophobicContact CG-CD2 4.44Å; V312-L315 HydrophobicContact CB-CD1 4.3Å; V312-L315 HydrophobicContact CG1-CD1 4.2Å; V312-L315 HydrophobicContact CG1-CD2 4.01Å; V312-L315 HydrophobicContact CG1-CG 4.23Å; L315-R317 PolarHBondContact O-N 3.35Å; L315-Y321 HydrophobicContact CB-CD2 4.47Å; L315-Y321 HydrophobicContact CB-CE2 3.93Å; L315-Y321 HydrophobicContact CD2-CD1 4.27Å; L315-Y321 HydrophobicContact CD2-CE1 4.08Å; L315-Y321 HydrophobicContact CD2-CE2 4.3Å; L315-F323 HydrophobicContact CD1-CE1 4.5Å; L315-F323 HydrophobicContact CD1-CZ 3.94Å; L315-L345 HydrophobicContact CB-CD1 3.46Å; L315-L345 VanDerWaalsContact CB-CD1 3.46Å; L315-L345 HydrophobicContact CD1-CD1 4.14Å; L315-L345 HydrophobicContact CG-CD1 4.42Å
316	H	55.2	Low	74.2	Confident	113 Å²	113	53.9 Å²	53.9	52%	0.523	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-68.7	126.6	-177.5	-60.2	150.1	0	0	0	112	E291 S319 Y321 L345	E291-H316 IonicContact OE2-CE1 3.17Å; E291-H316 IonicContact OE2-CG 2.81Å; E291-H316 IonicContact OE2-ND1 2.69Å; E291-H316 PolarHBondContact OE2-ND1 2.95Å; H316-S319 WeakPolarHBondContact CB-OG 3.45Å; H316-S319 VanDerWaalsContact O-CB 3.31Å; H316-S319 WeakPolarHBondContact O-CB 3.35Å; H316-S319 PolarHBondContact O-N 3.14Å; H316-S319 VanDerWaalsContact O-N 3.17Å; H316-Y321 HydrophobicContact CB-CE2 4.47Å; H316-Y321 VanDerWaalsContact CB-OH 3.25Å; H316-Y321 WeakPolarHBondContact CB-OH 3.23Å; H316-Y321 PolarHBondContact N-OH 2.86Å; H316-Y321 PolarHBondContact ND1-OH 2.97Å; H316-Y321 VanDerWaalsContact ND1-OH 3.17Å; H316-L345 WeakPolarHBondContact O-CD1 3.47Å
317	R	51.4	Low	74.3	Confident	121 Å²	121	48.7 Å²	48.7	46%	0.457	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	132	-179.7	-52.4	-167.5	174.3	-172.2	1.2	111.1	D269 D270 L315 S319	D269-R317 WeakPolarHBondContact O-CA 3.28Å; D269-R317 WeakPolarHBondContact O-CG 3.45Å; D270-R317 HydrophobicContact CB-CG 3.92Å; D270-R317 IonicContact OD2-CZ 3.52Å; D270-R317 IonicContact OD2-NE 2.78Å; D270-R317 PolarHBondContact OD2-NE 3.3Å; D270-R317 IonicContact OD2-NH2 3.89Å; D270-R317 PolarHBondContact OD2-NH2 3.13Å; L315-R317 PolarHBondContact O-N 3.35Å; R317-S319 VanDerWaalsContact C-N 3.26Å
318	N	45.8	Very low	74.3	Confident	111 Å²	111	42.2 Å²	42.2	59%	0.594	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.7	3	-169.5	-53.7	-84.7	0	0	0	115.6	L345 P347	N318-L345 CarbonylContact C-O 3.58Å; N318-L345 WeakPolarHBondContact CA-O 3.43Å; N318-L345 PolarHBondContact N-O 3.43Å; N318-L345 VanDerWaalsContact N-O 3.13Å; N318-P347 WeakPolarHBondContact OD1-CD 3.26Å
319	S	47.8	Very low	74.1	Confident	21 Å²	21	40.6 Å²	40.6	15%	0.147	22%	0.218	C	C	.	.			trans	-88.9	173.1	174.3	-68.8	0	0	0	0	112.8	E291 H316 R317 L345	E291-S319 VanDerWaalsContact CD-CB 3.46Å; E291-S319 VanDerWaalsContact CD-OG 3.3Å; E291-S319 WeakPolarHBondContact OE1-CB 3.44Å; E291-S319 PolarHBondContact OE1-OG 3.03Å; H316-S319 WeakPolarHBondContact CB-OG 3.45Å; H316-S319 VanDerWaalsContact O-CB 3.31Å; H316-S319 WeakPolarHBondContact O-CB 3.35Å; H316-S319 PolarHBondContact O-N 3.14Å; H316-S319 VanDerWaalsContact O-N 3.17Å; R317-S319 VanDerWaalsContact C-N 3.26Å; S319-L345 PolarHBondContact O-N 3.21Å
320	T	55.8	Low	73.6	Confident	36 Å²	36	47.1 Å²	47.1	22%	0.221	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	128	-173.1	58.2	0	0	0	0	109.9	E291 V292 I343 H344	E291-T320 CarbonylContact C-O 3.52Å; E291-T320 WeakPolarHBondContact CA-O 3.45Å; E291-T320 WeakPolarHBondContact CG-O 3.46Å; V292-T320 PolarHBondContact N-O 3.3Å; T320-I343 CarbonylContact C-O 3.55Å; T320-I343 WeakPolarHBondContact CA-O 3.49Å; T320-H344 HydrophobicContact CG2-CB 4.37Å; T320-H344 WeakPolarHBondContact CG2-ND1 3.45Å
321	Y	68.6	Low	72.7	Confident	8 Å²	8	51.2 Å²	51.2	3%	0.031	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	144.5	-171.1	-71.2	-88.6	0	0	0	113.1	Y289 R290 E291 L315 H316 F323 I343 L345	Y289-Y321 AromaticContact CD2-CD1 3.76Å; Y289-Y321 HydrophobicContact CD2-CD1 3.76Å; Y289-Y321 AromaticContact CD2-CE1 3.88Å; Y289-Y321 HydrophobicContact CD2-CE1 3.88Å; Y289-Y321 HydrophobicContact CE2-CD1 4.4Å; Y289-Y321 HydrophobicContact CE2-CE1 4.07Å; R290-Y321 VanDerWaalsContact O-CA 3.26Å; R290-Y321 WeakPolarHBondContact O-CA 3.17Å; R290-Y321 VanDerWaalsContact O-CD1 3.24Å; R290-Y321 WeakPolarHBondContact O-CD1 3.35Å; E291-Y321 HydrophobicContact CB-CD1 4.21Å; E291-Y321 HydrophobicContact CB-CE1 3.78Å; E291-Y321 HydrophobicContact CG-CE1 4.16Å; E291-Y321 PolarHBondContact OE2-OH 3.45Å; L315-Y321 HydrophobicContact CB-CD2 4.47Å; L315-Y321 HydrophobicContact CB-CE2 3.93Å; L315-Y321 HydrophobicContact CD2-CD1 4.27Å; L315-Y321 HydrophobicContact CD2-CE1 4.08Å; L315-Y321 HydrophobicContact CD2-CE2 4.3Å; H316-Y321 HydrophobicContact CB-CE2 4.47Å; H316-Y321 VanDerWaalsContact CB-OH 3.25Å; H316-Y321 WeakPolarHBondContact CB-OH 3.23Å; H316-Y321 PolarHBondContact N-OH 2.86Å; H316-Y321 PolarHBondContact ND1-OH 2.97Å; H316-Y321 VanDerWaalsContact ND1-OH 3.17Å; Y321-F323 VanDerWaalsContact CB-CE2 3.47Å; Y321-F323 HydrophobicContact CG-CZ 4.44Å; Y321-I343 PolarHBondContact N-O 3.38Å; Y321-I343 PolarHBondContact O-N 3.06Å; Y321-L345 HydrophobicContact CD2-CD1 3.45Å; Y321-L345 VanDerWaalsContact CD2-CD1 3.45Å; Y321-L345 HydrophobicContact CE2-CD1 3.44Å; Y321-L345 VanDerWaalsContact CE2-CD1 3.44Å
322	E	77.9	Confident	72.1	Confident	27 Å²	27	49.7 Å²	49.7	13%	0.126	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	143.8	164.1	-75.9	165.1	-167	0	0	109.2	Y289 R290 V292 W297 I342	Y289-E322 CarbonylContact C-O 3.56Å; Y289-E322 VanDerWaalsContact CA-O 3.29Å; Y289-E322 WeakPolarHBondContact CA-O 3.44Å; R290-E322 HydrophobicContact CG-CB 4.24Å; R290-E322 IonicContact CZ-OE2 3.63Å; R290-E322 PolarHBondContact N-O 3.33Å; R290-E322 IonicContact NE-OE2 2.77Å; R290-E322 PolarHBondContact NE-OE2 2.94Å; R290-E322 IonicContact NH2-OE2 3.71Å; R290-E322 PolarHBondContact NH2-OE2 2.84Å; R290-E322 PolarHBondContact O-N 2.76Å; V292-E322 HydrophobicContact CG2-CG 3.93Å; W297-E322 HydrophobicContact CH2-CB 4.03Å; W297-E322 WeakPolarHBondContact CZ3-O 3.27Å; E322-I342 HydrophobicContact CG-CG1 4.07Å
323	F	88.3	Confident	72.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	143.4	179.4	-61.6	-98.9	0	0	0	110.5	P262 V272 L274 V287 E288 Y289 V312 L315 Y321 T339 S340 I343	P262-F323 HydrophobicContact CG-CB 4.32Å; P262-F323 VanDerWaalsContact CG-O 3.3Å; P262-F323 WeakPolarHBondContact CG-O 3.39Å; V272-F323 HydrophobicContact CB-CE2 4.38Å; V272-F323 HydrophobicContact CB-CZ 3.99Å; V272-F323 HydrophobicContact CG1-CE2 4.06Å; V272-F323 HydrophobicContact CG1-CZ 4.09Å; V272-F323 HydrophobicContact CG2-CE2 4.36Å; V272-F323 HydrophobicContact CG2-CZ 4.12Å; L274-F323 HydrophobicContact CD1-CB 3.74Å; L274-F323 HydrophobicContact CD1-CD1 3.44Å; L274-F323 VanDerWaalsContact CD1-CD1 3.44Å; L274-F323 HydrophobicContact CD1-CD2 4.21Å; L274-F323 HydrophobicContact CD1-CE1 4.06Å; L274-F323 HydrophobicContact CD1-CG 3.54Å; L274-F323 HydrophobicContact CD2-CD2 4.44Å; L274-F323 HydrophobicContact CD2-CG 4.48Å; V287-F323 HydrophobicContact CG1-CD1 4.25Å; E288-F323 CarbonylContact O-C 3.57Å; E288-F323 WeakPolarHBondContact O-CA 3.32Å; Y289-F323 HydrophobicContact CG-CD1 4.41Å; Y289-F323 HydrophobicContact CG-CE1 4.09Å; V312-F323 HydrophobicContact CB-CE1 4.19Å; V312-F323 HydrophobicContact CG1-CE1 4.26Å; V312-F323 HydrophobicContact CG2-CD1 4.46Å; V312-F323 HydrophobicContact CG2-CE1 4Å; L315-F323 HydrophobicContact CD1-CE1 4.5Å; L315-F323 HydrophobicContact CD1-CZ 3.94Å; Y321-F323 VanDerWaalsContact CB-CE2 3.47Å; Y321-F323 HydrophobicContact CG-CZ 4.44Å; F323-T339 CarbonylContact O-C 3.57Å; F323-T339 VanDerWaalsContact O-CA 3.27Å; F323-T339 WeakPolarHBondContact O-CA 3.43Å; F323-S340 PolarHBondContact N-OG 2.66Å; F323-S340 PolarHBondContact O-N 3.08Å; F323-I343 HydrophobicContact CD2-CD1 3.78Å; F323-I343 HydrophobicContact CD2-CG1 4.5Å; F323-I343 HydrophobicContact CE2-CB 4.26Å; F323-I343 HydrophobicContact CE2-CD1 3.84Å; F323-I343 HydrophobicContact CE2-CG1 4.45Å
324	C	86.8	Confident	72.6	Confident	4 Å²	4	43.4 Å²	43.4	3%	0.027	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	160.8	168.9	66.7	0	0	0	0	110.6	V287 E288 W297 P336 T339	V287-C324 WeakPolarHBondContact CA-O 3.33Å; E288-C324 PolarHBondContact N-O 3.31Å; E288-C324 PolarHBondContact O-N 2.8Å; W297-C324 HydrophobicContact CH2-CB 4.2Å; W297-C324 HydrophobicContact CZ3-CB 4.2Å; W297-C324 VanDerWaalsContact CZ3-SG 3.55Å; C324-P336 HydrophobicContact CB-CB 4.3Å; C324-T339 HydrophobicContact CB-CG2 4.42Å
325	V	89.8	Confident	73.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	132.2	-173.8	-168.8	0	0	0	0	110.7	P259 P262 W276 Y285 I286 V287 S337	P259-V325 WeakPolarHBondContact CD-O 3.14Å; P259-V325 HydrophobicContact CG-CB 3.66Å; P259-V325 HydrophobicContact CG-CG1 3.74Å; P259-V325 WeakPolarHBondContact CG-O 3.49Å; P262-V325 HydrophobicContact CB-CG2 3.8Å; P262-V325 HydrophobicContact CG-CG2 3.94Å; W276-V325 HydrophobicContact CD2-CG1 4.15Å; W276-V325 HydrophobicContact CD2-CG2 4.01Å; W276-V325 HydrophobicContact CE3-CG2 3.87Å; W276-V325 HydrophobicContact CG-CG2 4.47Å; W276-V325 HydrophobicContact CH2-CG1 4.46Å; W276-V325 HydrophobicContact CZ2-CG1 3.99Å; W276-V325 HydrophobicContact CZ3-CG2 4.22Å; Y285-V325 HydrophobicContact CD1-CG1 4.05Å; Y285-V325 HydrophobicContact CG-CG1 4.3Å; I286-V325 WeakPolarHBondContact O-CA 3.5Å; I286-V325 WeakPolarHBondContact O-CG1 3.26Å; V287-V325 HydrophobicContact CG1-CG2 4.46Å; V287-V325 HydrophobicContact CG2-CG1 4.21Å; V287-V325 HydrophobicContact CG2-CG2 4.04Å; V325-S337 PolarHBondContact N-OG 2.75Å; V325-S337 PolarHBondContact O-N 2.88Å
326	I	88.9	Confident	74.5	Confident	21 Å²	21	46.8 Å²	46.8	11%	0.108	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	128	177.9	-61.2	167.5	0	0	0	108.2	Y285 I286 E288 A333 P336	Y285-I326 WeakPolarHBondContact CA-O 3.46Å; I286-I326 PolarHBondContact N-O 3.4Å; I286-I326 PolarHBondContact O-N 2.94Å; E288-I326 HydrophobicContact CG-CD1 4.41Å; I326-A333 HydrophobicContact CG2-CB 4.02Å; I326-P336 HydrophobicContact CD1-CG 4.28Å; I326-P336 HydrophobicContact CG1-CB 4.07Å; I326-P336 HydrophobicContact CG1-CG 4.06Å
327	S	86.4	Confident	76.1	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	149.3	172.7	74.1	0	0	0	0	111.7	Q257 S279 R284 A333 S334	Q257-S327 PolarHBondContact O-OG 2.81Å; S279-S327 WeakPolarHBondContact OG-CB 3.08Å; S279-S327 PolarHBondContact OG-OG 3.19Å; R284-S327 CarbonylContact O-C 3.54Å; R284-S327 WeakPolarHBondContact O-CA 3.42Å; S327-A333 WeakPolarHBondContact O-CA 3.23Å; S327-S334 PolarHBondContact N-OG 2.98Å; S327-S334 PolarHBondContact O-N 3.02Å; S327-S334 PolarHBondContact O-OG 3.38Å; S327-S334 WeakPolarHBondContact OG-CB 3.31Å; S327-S334 PolarHBondContact OG-OG 3.06Å; S327-S334 VanDerWaalsContact OG-OG 3.06Å
328	I	84.4	Confident	77.6	Confident	3 Å²	3	43.4 Å²	43.4	2%	0.015	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	120.6	-173.1	-60.3	154.8	0	0	0	108.7	R284 I286 P304 I332 A333	R284-I328 PolarHBondContact N-O 3.17Å; R284-I328 PolarHBondContact O-N 3.33Å; I286-I328 HydrophobicContact CD1-CD1 4.21Å; I286-I328 HydrophobicContact CG1-CD1 3.9Å; P304-I328 HydrophobicContact CB-CD1 3.85Å; P304-I328 HydrophobicContact CG-CD1 3.69Å; I328-I332 VanDerWaalsContact CA-O 3.31Å; I328-I332 WeakPolarHBondContact CA-O 3.2Å; I328-A333 HydrophobicContact CG1-CB 4.47Å
329	V	83.8	Confident	79.2	Confident	34 Å²	34	40.7 Å²	40.7	21%	0.206	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	127.4	177.9	-175.7	0	0	0	0	107.7	V256 V280 A283 N331 I332	V256-V329 HydrophobicContact CG1-CB 4.43Å; V256-V329 HydrophobicContact CG1-CG2 3.95Å; V280-V329 HydrophobicContact CG2-CG2 3.59Å; A283-V329 HydrophobicContact CB-CG2 4.11Å; V329-N331 PolarHBondContact O-N 3.43Å; V329-I332 PolarHBondContact N-O 3.35Å; V329-I332 WeakPolarHBondContact O-CB 3.38Å; V329-I332 PolarHBondContact O-N 3.12Å
330	D	76.6	Confident	80.7	Confident	151 Å²	151	40 Å²	40	81%	0.807	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	48	35.1	-178.5	-60	-33.5	0	0	0	114.7	I332	D330-I332 PolarHBondContact O-N 2.86Å
331	N	68.8	Low	81.5	Confident	118 Å²	118	44.1 Å²	44.1	63%	0.631	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.7	11.1	-176	-51.4	-50.2	0	0	0	116.1	R284 V329	R284-N331 PolarHBondContact NH2-OD1 3.32Å; V329-N331 PolarHBondContact O-N 3.43Å
332	I	75.6	Confident	81.1	Confident	69 Å²	69	47.4 Å²	47.4	35%	0.354	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	135.3	165.1	-56.6	178.1	0	0	0	108.2	S253 V256 I328 V329 D330	S253-I332 VanDerWaalsContact CB-CG2 3.47Å; V256-I332 HydrophobicContact CG2-CB 4.23Å; V256-I332 HydrophobicContact CG2-CG2 3.73Å; I328-I332 VanDerWaalsContact CA-O 3.31Å; I328-I332 WeakPolarHBondContact CA-O 3.2Å; V329-I332 PolarHBondContact N-O 3.35Å; V329-I332 WeakPolarHBondContact O-CB 3.38Å; V329-I332 PolarHBondContact O-N 3.12Å; D330-I332 PolarHBondContact O-N 2.86Å
333	A	81.1	Confident	80.4	Confident	5 Å²	5	46.3 Å²	46.3	4%	0.041	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	143.2	178.3	0	0	0	0	0	111.5	K251 V252 S253 I326 S327 I328	K251-A333 PolarHBondContact O-N 3.02Å; V252-A333 WeakPolarHBondContact CA-O 3.48Å; S253-A333 PolarHBondContact N-O 2.87Å; I326-A333 HydrophobicContact CG2-CB 4.02Å; S327-A333 WeakPolarHBondContact O-CA 3.23Å; I328-A333 HydrophobicContact CG1-CB 4.47Å
334	S	84.6	Confident	78.8	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.007	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	174.3	165.6	66.1	0	0	0	0	111.3	V256 S327	V256-S334 WeakPolarHBondContact O-CA 3.02Å; V256-S334 WeakPolarHBondContact O-CB 3.45Å; S327-S334 PolarHBondContact N-OG 2.98Å; S327-S334 PolarHBondContact O-N 3.02Å; S327-S334 PolarHBondContact O-OG 3.38Å; S327-S334 WeakPolarHBondContact OG-CB 3.31Å; S327-S334 PolarHBondContact OG-OG 3.06Å; S327-S334 VanDerWaalsContact OG-OG 3.06Å
335	Q	82.5	Confident	77.2	Confident	102 Å²	102	50.3 Å²	50.3	48%	0.477	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	160.5	154.2	-59.5	-172.1	7.1	0	0	109.6	V252	V252-Q335 HydrophobicContact CG1-CG 4.33Å
336	P	84.6	Confident	75	Confident	37 Å²	37	57.7 Å²	57.7	24%	0.24	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	156.3	169.1	-19.5	32.4	0	0	0	111.7	C324 I326	C324-P336 HydrophobicContact CB-CB 4.3Å; I326-P336 HydrophobicContact CD1-CG 4.28Å; I326-P336 HydrophobicContact CG1-CB 4.07Å; I326-P336 HydrophobicContact CG1-CG 4.06Å
337	S	88.4	Confident	72.7	Confident	12 Å²	12	59.4 Å²	59.4	8%	0.084	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-62.8	169	165.2	69.1	0	0	0	0	111.7	P259 P262 V325	P259-S337 WeakPolarHBondContact O-CB 3.42Å; P262-S337 WeakPolarHBondContact CD-OG 3.34Å; V325-S337 PolarHBondContact N-OG 2.75Å; V325-S337 PolarHBondContact O-N 2.88Å
338	E	83.5	Confident	70.2	Confident	152 Å²	152	65.7 Å²	65.7	71%	0.71	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-54.7	148.7	155	-65.4	179.6	160.8	0	0	109.8	Q261 P262	Q261-E338 HydrophobicContact CB-CB 4.49Å; Q261-E338 HydrophobicContact CG-CB 4.32Å; P262-E338 WeakPolarHBondContact CD-O 3.44Å
339	T	78.4	Confident	67.6	Low	54 Å²	54	70.9 Å²	70.9	33%	0.331	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-72	151.4	179.8	55.6	0	0	0	0	110.9	Q261 W297 F323 C324	Q261-T339 WeakPolarHBondContact CG-O 3.3Å; Q261-T339 PolarHBondContact NE2-O 3.05Å; W297-T339 HydrophobicContact CH2-CG2 3.64Å; W297-T339 HydrophobicContact CZ2-CG2 3.83Å; F323-T339 CarbonylContact O-C 3.57Å; F323-T339 VanDerWaalsContact O-CA 3.27Å; F323-T339 WeakPolarHBondContact O-CA 3.43Å; C324-T339 HydrophobicContact CB-CG2 4.42Å
340	S	80.6	Confident	65.1	Low	5 Å²	5	77.4 Å²	77.4	4%	0.035	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-53.4	162.2	164.7	67.3	0	0	0	0	111.2	P262 F323	P262-S340 WeakPolarHBondContact O-CA 3.3Å; P262-S340 VanDerWaalsContact O-CB 3.29Å; P262-S340 WeakPolarHBondContact O-CB 3.27Å; F323-S340 PolarHBondContact N-OG 2.66Å; F323-S340 PolarHBondContact O-N 3.08Å
341	D	71.3	Confident	63.3	Low	123 Å²	123	76.6 Å²	76.6	66%	0.658	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-54.4	159.7	154.4	-65.2	-48.1	0	0	0	110.3	I343	D341-I343 WeakPolarHBondContact O-CG1 3.34Å; D341-I343 PolarHBondContact O-N 3.22Å
342	I	59.9	Low	61.6	Low	78 Å²	78	76.5 Å²	76.5	40%	0.4	42%	0.421	S	S	.	.			trans	-69.5	114.2	178.6	-66	171.6	0	0	0	109.8	V292 E322	V292-I342 HydrophobicContact CG1-CD1 4.19Å; V292-I342 HydrophobicContact CG2-CB 4.46Å; V292-I342 HydrophobicContact CG2-CD1 4.17Å; V292-I342 HydrophobicContact CG2-CG1 3.95Å; V292-I342 HydrophobicContact CG2-CG2 3.82Å; E322-I342 HydrophobicContact CG-CG1 4.07Å
343	I	65	Low	59.9	Low	4 Å²	4	78 Å²	78	2%	0.021	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	116.5	-178.4	-59.6	178.5	0	0	0	109.3	M264 V267 V272 L274 T320 Y321 F323 D341	M264-I343 HydrophobicContact CB-CD1 3.7Å; M264-I343 HydrophobicContact CB-CG1 4.13Å; M264-I343 HydrophobicContact CG-CD1 3.89Å; M264-I343 HydrophobicContact CG-CG1 4.18Å; M264-I343 HydrophobicContact CG-CG2 4.24Å; M264-I343 HydrophobicContact SD-CG1 4.22Å; M264-I343 HydrophobicContact SD-CG2 3.95Å; V267-I343 HydrophobicContact CG1-CG2 4.48Å; V267-I343 HydrophobicContact CG2-CG2 3.67Å; V272-I343 HydrophobicContact CG1-CD1 3.67Å; V272-I343 HydrophobicContact CG1-CG2 4.03Å; V272-I343 HydrophobicContact CG2-CG2 3.74Å; L274-I343 HydrophobicContact CD2-CD1 3.65Å; T320-I343 CarbonylContact C-O 3.55Å; T320-I343 WeakPolarHBondContact CA-O 3.49Å; Y321-I343 PolarHBondContact N-O 3.38Å; Y321-I343 PolarHBondContact O-N 3.06Å; F323-I343 HydrophobicContact CD2-CD1 3.78Å; F323-I343 HydrophobicContact CD2-CG1 4.5Å; F323-I343 HydrophobicContact CE2-CB 4.26Å; F323-I343 HydrophobicContact CE2-CD1 3.84Å; F323-I343 HydrophobicContact CE2-CG1 4.45Å; D341-I343 WeakPolarHBondContact O-CG1 3.34Å; D341-I343 PolarHBondContact O-N 3.22Å
344	H	53.9	Low	58	Low	87 Å²	87	83 Å²	83	40%	0.403	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	110.8	177.8	-58.3	-93.6	0	0	0	111.1	T320 R346	T320-H344 HydrophobicContact CG2-CB 4.37Å; T320-H344 WeakPolarHBondContact CG2-ND1 3.45Å; H344-R346 HydrophobicContact CB-CG 4.11Å; H344-R346 PolarHBondContact ND1-NH2 3.3Å; H344-R346 PolarHBondContact O-N 2.92Å
345	L	52.6	Low	56.3	Low	0 Å²	0	92.7 Å²	92.7	0%	0	51%	0.505	C	S	.	.			trans	-73.4	111.9	168.8	-70.4	146.8	0	0	0	108.6	V267 G268 V272 L315 H316 N318 S319 Y321	V267-L345 HydrophobicContact CG1-CD2 4.03Å; V267-L345 HydrophobicContact CG1-CG 4.45Å; G268-L345 WeakPolarHBondContact O-CD2 3.3Å; V272-L345 HydrophobicContact CG2-CD2 3.82Å; V272-L345 HydrophobicContact CG2-CG 4.16Å; L315-L345 HydrophobicContact CB-CD1 3.46Å; L315-L345 VanDerWaalsContact CB-CD1 3.46Å; L315-L345 HydrophobicContact CD1-CD1 4.14Å; L315-L345 HydrophobicContact CG-CD1 4.42Å; H316-L345 WeakPolarHBondContact O-CD1 3.47Å; N318-L345 CarbonylContact C-O 3.58Å; N318-L345 WeakPolarHBondContact CA-O 3.43Å; N318-L345 PolarHBondContact N-O 3.43Å; N318-L345 VanDerWaalsContact N-O 3.13Å; S319-L345 PolarHBondContact O-N 3.21Å; Y321-L345 HydrophobicContact CD2-CD1 3.45Å; Y321-L345 VanDerWaalsContact CD2-CD1 3.45Å; Y321-L345 HydrophobicContact CE2-CD1 3.44Å; Y321-L345 VanDerWaalsContact CE2-CD1 3.44Å
346	R	44.7	Very low	54.7	Low	155 Å²	155	92.4 Å²	92.4	59%	0.585	51%	0.512	S	S	*	.			trans	-133.4	134.7	-178.5	-62.5	-173.4	-170.3	173.3	8.3	111.3	H344 T348	H344-R346 HydrophobicContact CB-CG 4.11Å; H344-R346 PolarHBondContact ND1-NH2 3.3Å; H344-R346 PolarHBondContact O-N 2.92Å; R346-T348 PolarHBondContact O-N 2.85Å
347	P	40	Very low	53.3	Low	58 Å²	58	91 Å²	91	38%	0.377	50%	0.504	S	S	.	.			trans	-52.8	128.9	171.6	-26.9	35.1	0	0	0	112.1	D269 N318 C349	D269-P347 WeakPolarHBondContact OD1-CA 3.41Å; N318-P347 WeakPolarHBondContact OD1-CD 3.26Å; P347-C349 PolarHBondContact O-N 3.41Å
348	T	32.9	Very low	51.9	Low	132 Å²	132	92.2 Å²	92.2	81%	0.81	51%	0.512	S	S	*	.			trans	-78.7	88.9	-176.1	43.2	0	0	0	0	112.1	R346	R346-T348 PolarHBondContact O-N 2.85Å
349	C	30.7	Very low	51	Low	112 Å²	112	88.1 Å²	88.1	76%	0.757	50%	0.495	S	S	*	.			trans	-130.1	145.5	172	67	0	0	0	0	113.3	P347	P347-C349 PolarHBondContact O-N 3.41Å
350	N	32.2	Very low	50.6	Low	170 Å²	170	86 Å²	86	91%	0.909	48%	0.481	S	S	*	.			trans	-74.5	141.5	-165.1	-102	-44	0	0	0	114.2	S352	N350-S352 PolarHBondContact O-N 2.69Å
351	T	37.3	Very low	49.9	Very low	134 Å²	134	93 Å²	93	82%	0.822	52%	0.517	S	S	*	.			trans	-85.2	100.8	-175.4	37.3	0	0	0	0	113.6
352	S	34.1	Very low	49.9	Very low	117 Å²	117	92.9 Å²	92.9	82%	0.818	51%	0.513	S	S	*	.			trans	-164.3	146.1	155.9	-88.5	0	0	0	0	113.3	N350	N350-S352 PolarHBondContact O-N 2.69Å
353	A	39.4	Very low	50.9	Low	101 Å²	101	91 Å²	91	84%	0.835	51%	0.509	S	S	*	.			trans	68.3	112.3	-179.9	0	0	0	0	0	116.7
354	L	41	Very low	51.7	Low	110 Å²	110	91 Å²	91	58%	0.576	51%	0.509	S	S	*	.			trans	-123.5	158.6	-179.6	-79.2	174.6	0	0	0	111.6	L385 A436 S437	L354-L385 HydrophobicContact CD2-CD1 3.79Å; L354-A436 HydrophobicContact CD2-CB 4.14Å; L354-S437 WeakPolarHBondContact CB-OG 3.28Å
355	R	48.6	Very low	52.9	Low	203 Å²	203	92.8 Å²	92.8	77%	0.766	52%	0.518	S	S	*	.			trans	-147	140.8	176	-71.7	-167.8	-177.2	-158.1	3.2	111.4	L385 N435 S437	R355-L385 WeakPolarHBondContact O-CD1 3.49Å; R355-N435 PolarHBondContact O-ND2 3.07Å; R355-N435 VanDerWaalsContact O-ND2 3.1Å; R355-S437 VanDerWaalsContact C-CB 3.44Å; R355-S437 VanDerWaalsContact C-OG 3.27Å; R355-S437 PolarHBondContact N-OG 2.81Å; R355-S437 VanDerWaalsContact O-CB 3.32Å; R355-S437 WeakPolarHBondContact O-CB 3.43Å; R355-S437 PolarHBondContact O-OG 2.97Å
356	P	50	Low	54.1	Low	96 Å²	96	95.7 Å²	95.7	62%	0.623	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-58.1	158	-175.7	24.9	-35.5	0	0	0	113.9
357	A	55.4	Low	54.6	Low	8 Å²	8	92.9 Å²	92.9	7%	0.066	53%	0.527	C	S	.	.	P	Polyproline II helix	trans	-63	143.8	-179.3	0	0	0	0	0	112.4	A433 N435	A357-A433 WeakPolarHBondContact CB-O 3.41Å; A357-N435 WeakPolarHBondContact CA-ND2 2.99Å; A357-N435 HydrophobicContact CB-CB 4.09Å; A357-N435 PolarHBondContact N-ND2 2.79Å
358	P	58.7	Low	55.8	Low	38 Å²	38	95.8 Å²	95.8	25%	0.247	54%	0.535	C	S	.	.	P	Polyproline II helix	trans	-73.2	149.2	178.2	33.2	-37.7	0	0	0	111.5	A381 Q382 S383 S440	P358-A381 HydrophobicContact CG-CB 4.13Å; P358-Q382 WeakPolarHBondContact CG-O 3.42Å; P358-S383 WeakPolarHBondContact CD-OG 3.43Å; P358-S440 WeakPolarHBondContact O-CB 3.49Å
359	N	64.8	Low	57.5	Low	65 Å²	65	92.4 Å²	92.4	35%	0.348	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-68.3	143.1	178.4	-68.3	-4.9	0	0	0	112.5	L361 Q441	N359-L361 HydrophobicContact CB-CD2 4.38Å; N359-Q441 PolarHBondContact ND2-OE1 3.43Å; N359-Q441 WeakPolarHBondContact OD1-CB 3.39Å; N359-Q441 PolarHBondContact OD1-N 3.37Å; N359-Q441 VanDerWaalsContact OD1-N 3.07Å
360	I	70.3	Confident	58.9	Low	11 Å²	11	93.2 Å²	93.2	6%	0.056	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-79.3	118.5	167.5	-56.3	175.7	0	0	0	107.7	E362 A381 Y390 V431 A433	I360-E362 WeakPolarHBondContact CG2-O 3.35Å; I360-A381 HydrophobicContact CG1-CB 4.05Å; I360-Y390 HydrophobicContact CD1-CD1 3.84Å; I360-Y390 HydrophobicContact CD1-CE1 3.95Å; I360-V431 HydrophobicContact CD1-CB 3.88Å; I360-V431 HydrophobicContact CD1-CG1 3.74Å; I360-A433 HydrophobicContact CD1-CB 4.21Å; I360-A433 HydrophobicContact CG1-CB 4.25Å
361	L	65	Low	60.7	Low	150 Å²	150	86.7 Å²	86.7	79%	0.785	48%	0.484	S	S	*	.			trans	-91.8	-12.7	-172.2	-60.3	-179.6	0	0	0	114.3	N359	N359-L361 HydrophobicContact CB-CD2 4.38Å
362	E	71.5	Confident	62.2	Low	122 Å²	122	82.7 Å²	82.7	57%	0.57	46%	0.457	S	S	*	.	S	Bend	trans	-116.4	149.8	-178.2	-68.3	175.9	-148.9	0	0	110	I360 L379	I360-E362 WeakPolarHBondContact CG2-O 3.35Å; E362-L379 WeakPolarHBondContact OE2-CD1 3.39Å
363	A	80.4	Confident	63.8	Low	37 Å²	37	81.5 Å²	81.5	31%	0.306	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-77	154.6	177.1	0	0	0	0	0	111.4	P444 P445	A363-P444 WeakPolarHBondContact CA-O 3.43Å; A363-P444 HydrophobicContact CB-CB 4.3Å; A363-P444 WeakPolarHBondContact CB-O 3.49Å; A363-P445 VanDerWaalsContact CB-O 3.31Å; A363-P445 WeakPolarHBondContact CB-O 3.35Å
364	P	82.6	Confident	65.5	Low	6 Å²	6	76.7 Å²	76.7	4%	0.039	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-66.4	138.5	171	26	-31.1	0	0	0	111.7	I376 C377 W378 F429 V431 S446	P364-I376 HydrophobicContact CB-CB 4.42Å; P364-I376 HydrophobicContact CB-CD1 4.26Å; P364-C377 CarbonylContact C-O 3.43Å; P364-C377 VanDerWaalsContact CA-O 3.25Å; P364-C377 WeakPolarHBondContact CA-O 3.35Å; P364-W378 HydrophobicContact CB-CB 4.4Å; P364-F429 HydrophobicContact CG-CB 4.12Å; P364-F429 WeakPolarHBondContact CG-O 3.31Å; P364-V431 HydrophobicContact CB-CG2 4.15Å; P364-V431 HydrophobicContact CG-CG2 4.12Å; P364-S446 WeakPolarHBondContact O-CB 3.33Å
365	E	79.3	Confident	67.1	Low	124 Å²	124	72 Å²	72	58%	0.579	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	145.2	174.6	-69.3	-165.3	159.6	0	0	111.3	I376 C377	E365-I376 CarbonylContact O-C 3.54Å; E365-I376 WeakPolarHBondContact O-CA 3.36Å; E365-C377 PolarHBondContact N-O 3.12Å; E365-C377 PolarHBondContact O-N 2.92Å
366	F	77.7	Confident	68.4	Low	61 Å²	61	62.3 Å²	62.3	27%	0.268	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	124.6	169.3	-56.6	-61.3	0	0	0	111.2	I374 I376 F429 S446 D447 V449	F366-I374 HydrophobicContact CD1-CG2 3.52Å; F366-I374 HydrophobicContact CE1-CG2 3.91Å; F366-I376 HydrophobicContact CD1-CG2 3.72Å; F366-I376 HydrophobicContact CE1-CG2 3.77Å; F366-F429 AromaticContact CE1-CD2 3.53Å; F366-F429 HydrophobicContact CE1-CD2 3.53Å; F366-F429 AromaticContact CE1-CE2 3.78Å; F366-F429 HydrophobicContact CE1-CE2 3.78Å; F366-F429 AromaticContact CZ-CD2 3.97Å; F366-F429 HydrophobicContact CZ-CD2 3.97Å; F366-F429 HydrophobicContact CZ-CE2 4.34Å; F366-S446 WeakPolarHBondContact CZ-OG 3.32Å; F366-D447 VanDerWaalsContact CE2-O 3.24Å; F366-D447 WeakPolarHBondContact CE2-O 3.45Å; F366-D447 VanDerWaalsContact CZ-O 3.29Å; F366-D447 WeakPolarHBondContact CZ-O 3.46Å; F366-V449 HydrophobicContact CD1-CG1 4.17Å; F366-V449 HydrophobicContact CD2-CB 4.28Å; F366-V449 HydrophobicContact CE1-CB 4.18Å; F366-V449 HydrophobicContact CE1-CG1 3.44Å; F366-V449 VanDerWaalsContact CE1-CG1 3.44Å; F366-V449 HydrophobicContact CE2-CB 3.79Å; F366-V449 HydrophobicContact CE2-CG1 3.87Å; F366-V449 HydrophobicContact CZ-CB 3.75Å; F366-V449 HydrophobicContact CZ-CG1 3.25Å
367	L	55.5	Low	69.4	Low	96 Å²	96	59.1 Å²	59.1	50%	0.503	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-51.6	177.5	-175.2	65.3	0	0	0	111.1	T375	L367-T375 HydrophobicContact CB-CG2 4.12Å; L367-T375 WeakPolarHBondContact CB-O 3.1Å; L367-T375 HydrophobicContact CD2-CG2 3.88Å; L367-T375 PolarHBondContact N-O 2.96Å
368	E	64.6	Low	70.6	Confident	119 Å²	119	59.6 Å²	59.6	56%	0.556	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.4	146.6	-176.5	-74.4	155.9	178.6	0	0	109.2	T375	E368-T375 PolarHBondContact N-O 2.65Å; E368-T375 PolarHBondContact O-N 3.41Å
369	V	69.4	Low	71.1	Confident	60 Å²	60	62.3 Å²	62.3	36%	0.364	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	123	173.4	179.9	0	0	0	0	106.1	K373 I374 V449	V369-K373 WeakPolarHBondContact CA-O 3.25Å; V369-I374 HydrophobicContact CG1-CG1 4.16Å; V369-I374 HydrophobicContact CG2-CG1 4.25Å; V369-I374 HydrophobicContact CG2-CG2 4.45Å; V369-V449 HydrophobicContact CG2-CG2 4.02Å
370	D	58.7	Low	71	Confident	130 Å²	130	63.2 Å²	63.2	70%	0.695	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.4	101	-172.2	-172.9	28	0	0	0	109.8	D372 K373	D370-D372 PolarHBondContact O-N 3.03Å; D370-K373 PolarHBondContact N-O 2.92Å; D370-K373 WeakPolarHBondContact O-CB 3.33Å; D370-K373 PolarHBondContact O-N 3.48Å
371	G	70.6	Confident	70.7	Confident	33 Å²	33	63.2 Å²	63.2	34%	0.34	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.8	-126.2	-173.9	0	0	0	0	0	112.5	K373	G371-K373 PolarHBondContact O-N 3.42Å; G371-K373 VanDerWaalsContact O-N 3.14Å
372	D	69	Low	70.3	Confident	50 Å²	50	65.1 Å²	65.1	27%	0.267	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	3.9	176.8	66.3	-67.1	0	0	0	114.5	D370 G419 D420 L421	D370-D372 PolarHBondContact O-N 3.03Å; D372-G419 CarbonylContact O-C 3.48Å; D372-G419 WeakPolarHBondContact O-CA 3.42Å; D372-D420 PolarHBondContact O-N 2.94Å; D372-D420 PolarHBondContact OD2-N 3.45Å; D372-L421 WeakPolarHBondContact O-CB 3.41Å; D372-L421 PolarHBondContact O-N 3.46Å
373	K	68	Low	69.5	Low	92 Å²	92	61.2 Å²	61.2	40%	0.4	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.8	-167.3	-48.3	-168.5	172.8	62.3	0	113.1	V369 D370 G371 T417 V418	V369-K373 WeakPolarHBondContact CA-O 3.25Å; D370-K373 PolarHBondContact N-O 2.92Å; D370-K373 WeakPolarHBondContact O-CB 3.33Å; D370-K373 PolarHBondContact O-N 3.48Å; G371-K373 PolarHBondContact O-N 3.42Å; G371-K373 VanDerWaalsContact O-N 3.14Å; K373-T417 HydrophobicContact CB-CG2 4.37Å; K373-V418 CarbonylContact C-O 3.57Å; K373-V418 VanDerWaalsContact CA-O 3.28Å; K373-V418 WeakPolarHBondContact CA-O 3.37Å
374	I	74.6	Confident	68.1	Low	0 Å²	0	69 Å²	69	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	121.1	178.6	-62.8	-179.9	0	0	0	109.8	F366 V369 I376 T417 V418 L421 F429 V449 I451	F366-I374 HydrophobicContact CD1-CG2 3.52Å; F366-I374 HydrophobicContact CE1-CG2 3.91Å; V369-I374 HydrophobicContact CG1-CG1 4.16Å; V369-I374 HydrophobicContact CG2-CG1 4.25Å; V369-I374 HydrophobicContact CG2-CG2 4.45Å; I374-I376 HydrophobicContact CG2-CG2 4.05Å; I374-T417 WeakPolarHBondContact O-CA 3.35Å; I374-V418 PolarHBondContact N-O 2.6Å; I374-V418 PolarHBondContact O-N 3.08Å; I374-L421 HydrophobicContact CB-CD1 4.03Å; I374-L421 HydrophobicContact CD1-CD1 3.64Å; I374-L421 HydrophobicContact CG1-CD1 3.74Å; I374-F429 HydrophobicContact CD1-CE2 4.24Å; I374-F429 HydrophobicContact CD1-CZ 4.34Å; I374-F429 HydrophobicContact CG2-CE2 4.42Å; I374-V449 HydrophobicContact CD1-CB 4.28Å; I374-V449 HydrophobicContact CD1-CG1 3.43Å; I374-V449 VanDerWaalsContact CD1-CG1 3.43Å; I374-V449 HydrophobicContact CD1-CG2 3.82Å; I374-I451 HydrophobicContact CD1-CD1 3.59Å; I374-I451 HydrophobicContact CG1-CD1 3.96Å
375	T	74.3	Confident	66.4	Low	10 Å²	10	71.3 Å²	71.3	6%	0.061	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	116.3	168.4	-55	0	0	0	0	110	L367 E368 M416 T417	L367-T375 HydrophobicContact CB-CG2 4.12Å; L367-T375 WeakPolarHBondContact CB-O 3.1Å; L367-T375 HydrophobicContact CD2-CG2 3.88Å; L367-T375 PolarHBondContact N-O 2.96Å; E368-T375 PolarHBondContact N-O 2.65Å; E368-T375 PolarHBondContact O-N 3.41Å; T375-M416 CarbonylContact C-O 3.54Å; T375-M416 WeakPolarHBondContact CA-O 3.13Å; T375-T417 WeakPolarHBondContact OG1-CG2 3.23Å; T375-T417 PolarHBondContact OG1-OG1 2.86Å
376	I	75.3	Confident	64.8	Low	0 Å²	0	70.6 Å²	70.6	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	157	170.4	60.9	162.9	0	0	0	111.6	P364 E365 F366 I374 W378 V392 K415 M416 F429	P364-I376 HydrophobicContact CB-CB 4.42Å; P364-I376 HydrophobicContact CB-CD1 4.26Å; E365-I376 CarbonylContact O-C 3.54Å; E365-I376 WeakPolarHBondContact O-CA 3.36Å; F366-I376 HydrophobicContact CD1-CG2 3.72Å; F366-I376 HydrophobicContact CE1-CG2 3.77Å; I374-I376 HydrophobicContact CG2-CG2 4.05Å; I376-W378 HydrophobicContact CD1-CE3 4.23Å; I376-W378 HydrophobicContact CD1-CZ3 3.98Å; I376-W378 HydrophobicContact CG1-CE3 4.4Å; I376-W378 HydrophobicContact CG1-CZ3 4.04Å; I376-V392 HydrophobicContact CD1-CG1 3.61Å; I376-V392 HydrophobicContact CD1-CG2 4.33Å; I376-K415 CarbonylContact O-C 3.5Å; I376-K415 VanDerWaalsContact O-CA 3.24Å; I376-K415 WeakPolarHBondContact O-CA 3.19Å; I376-M416 PolarHBondContact N-O 2.91Å; I376-M416 PolarHBondContact O-N 2.89Å; I376-F429 HydrophobicContact CD1-CB 4.11Å; I376-F429 HydrophobicContact CD1-CD1 4.32Å; I376-F429 HydrophobicContact CD1-CG 4.42Å; I376-F429 HydrophobicContact CG2-CB 4.3Å; I376-F429 HydrophobicContact CG2-CD1 4.39Å; I376-F429 HydrophobicContact CG2-CD2 4.15Å; I376-F429 HydrophobicContact CG2-CG 4.01Å
377	C	72.6	Confident	63.9	Low	30 Å²	30	69.6 Å²	69.6	20%	0.203	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	158	169.2	69.3	0	0	0	0	112.4	P364 E365 C414 K415	P364-C377 CarbonylContact C-O 3.43Å; P364-C377 VanDerWaalsContact CA-O 3.25Å; P364-C377 WeakPolarHBondContact CA-O 3.35Å; E365-C377 PolarHBondContact N-O 3.12Å; E365-C377 PolarHBondContact O-N 2.92Å; C377-C414 WeakPolarHBondContact CA-O 3.3Å; C377-C414 WeakPolarHBondContact CB-O 3.45Å; C377-K415 HydrophobicContact CB-CB 3.9Å
378	W	80.2	Confident	63.7	Low	17 Å²	17	69.9 Å²	69.9	6%	0.064	38%	0.377	C	S	.	.			trans	-144.5	171.2	-176.3	57.5	99.2	0	0	0	111.8	P364 I376 Y390 V392 A413 C414 M416 V431	P364-W378 HydrophobicContact CB-CB 4.4Å; I376-W378 HydrophobicContact CD1-CE3 4.23Å; I376-W378 HydrophobicContact CD1-CZ3 3.98Å; I376-W378 HydrophobicContact CG1-CE3 4.4Å; I376-W378 HydrophobicContact CG1-CZ3 4.04Å; W378-Y390 AromaticContact CE2-CG 3.96Å; W378-Y390 HydrophobicContact CZ2-CD2 4.2Å; W378-Y390 HydrophobicContact CZ2-CG 4.03Å; W378-Y390 AromaticContact NE1-CD1 3.4Å; W378-Y390 AromaticContact NE1-CD2 3.54Å; W378-Y390 AromaticContact NE1-CE1 3.79Å; W378-Y390 AromaticContact NE1-CE2 3.96Å; W378-Y390 AromaticContact NE1-CG 3.29Å; W378-Y390 VanDerWaalsContact NE1-CG 3.29Å; W378-V392 HydrophobicContact CH2-CG2 3.59Å; W378-V392 HydrophobicContact CZ2-CG2 4.26Å; W378-V392 HydrophobicContact CZ3-CG2 3.87Å; W378-A413 VanDerWaalsContact CZ2-O 3.25Å; W378-A413 WeakPolarHBondContact CZ2-O 3.44Å; W378-C414 HydrophobicContact CD2-CB 4.21Å; W378-C414 VanDerWaalsContact CE2-CA 3.47Å; W378-C414 HydrophobicContact CG-CB 4.08Å; W378-C414 PolarHBondContact N-O 3.26Å; W378-C414 VanDerWaalsContact N-O 3.1Å; W378-C414 WeakPolarHBondContact O-CB 3.47Å; W378-M416 HydrophobicContact CH2-CB 3.99Å; W378-M416 HydrophobicContact CZ3-CB 4.05Å; W378-V431 HydrophobicContact CB-CG2 4.42Å; W378-V431 HydrophobicContact CD2-CG1 4.07Å; W378-V431 HydrophobicContact CD2-CG2 3.89Å; W378-V431 HydrophobicContact CE3-CG2 3.97Å; W378-V431 HydrophobicContact CG-CG1 4.27Å; W378-V431 HydrophobicContact CG-CG2 4.11Å; W378-V431 HydrophobicContact CZ2-CG1 4.18Å
379	L	68.3	Low	63.2	Low	96 Å²	96	64.2 Å²	64.2	50%	0.503	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-87.7	146	172	-63.9	-170	0	0	0	111.5	E362	E362-L379 WeakPolarHBondContact OE2-CD1 3.39Å
380	P	63.3	Low	63.3	Low	84 Å²	84	61.9 Å²	61.9	55%	0.545	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-62	140.9	174.2	-19.1	29.7	0	0	0	112.7	Y390	P380-Y390 VanDerWaalsContact CA-OH 3.25Å; P380-Y390 WeakPolarHBondContact CA-OH 3.42Å
381	A	64.3	Low	64.3	Low	10 Å²	10	56.7 Å²	56.7	8%	0.083	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-70.6	129.3	175.4	0	0	0	0	0	111	P358 I360 S383 V387 Y390 A433	P358-A381 HydrophobicContact CG-CB 4.13Å; I360-A381 HydrophobicContact CG1-CB 4.05Å; A381-S383 PolarHBondContact O-N 2.78Å; A381-V387 HydrophobicContact CB-CG2 4.44Å; A381-Y390 HydrophobicContact CB-CE1 4.06Å; A381-Y390 PolarHBondContact N-OH 2.84Å; A381-A433 HydrophobicContact CB-CB 3.6Å
382	Q	56.3	Low	64.9	Low	191 Å²	191	55.1 Å²	55.1	89%	0.893	29%	0.292	S	S	*	.			trans	-80.8	81.2	-171.8	-65.1	-175	7.8	0	0	112.1	P358	P358-Q382 WeakPolarHBondContact CG-O 3.42Å
383	S	55.3	Low	65.8	Low	39 Å²	39	54.4 Å²	54.4	27%	0.273	29%	0.287	S	S	.	.			trans	-105	146.2	-172.6	-170.2	0	0	0	0	113.5	P358 A381 L385	P358-S383 WeakPolarHBondContact CD-OG 3.43Å; A381-S383 PolarHBondContact O-N 2.78Å; S383-L385 WeakPolarHBondContact CB-O 3.29Å; S383-L385 PolarHBondContact OG-N 3.48Å; S383-L385 PolarHBondContact OG-O 2.7Å
384	Q	49.5	Very low	66.7	Low	202 Å²	202	52.1 Å²	52.1	94%	0.944	28%	0.277	S	S	*	.	S	Bend	trans	-89.8	-5.6	168.6	-65.9	-168	-8.3	0	0	113.3
385	L	47.5	Very low	67.3	Low	53 Å²	53	54.4 Å²	54.4	28%	0.277	29%	0.286	S	S	.	.	S	Bend	trans	-113.9	143.5	165.6	-65.7	175	0	0	0	108.8	L354 R355 S383 V387	L354-L385 HydrophobicContact CD2-CD1 3.79Å; R355-L385 WeakPolarHBondContact O-CD1 3.49Å; S383-L385 WeakPolarHBondContact CB-O 3.29Å; S383-L385 PolarHBondContact OG-N 3.48Å; S383-L385 PolarHBondContact OG-O 2.7Å; L385-V387 PolarHBondContact O-N 2.96Å
386	P	46.3	Very low	67.9	Low	109 Å²	109	54.1 Å²	54.1	71%	0.708	28%	0.283	S	S	*	.			trans	-51.1	133.1	-179.8	-28.6	35.8	0	0	0	113	M388 N435	P386-M388 PolarHBondContact O-N 2.74Å; P386-N435 WeakPolarHBondContact O-CB 3.36Å
387	V	59.2	Low	68.1	Low	40 Å²	40	57.5 Å²	57.5	24%	0.242	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	113	176	-177.5	0	0	0	0	108.3	A381 L385 G389 Y390 A433 H434	A381-V387 HydrophobicContact CB-CG2 4.44Å; L385-V387 PolarHBondContact O-N 2.96Å; V387-G389 PolarHBondContact O-N 3.23Å; V387-G389 VanDerWaalsContact O-N 3.11Å; V387-Y390 HydrophobicContact CG1-CE1 4.04Å; V387-Y390 HydrophobicContact CG1-CE2 4.06Å; V387-A433 HydrophobicContact CG1-CB 4.13Å; V387-H434 CarbonylContact C-O 3.56Å; V387-H434 VanDerWaalsContact CA-O 3.25Å; V387-H434 WeakPolarHBondContact CA-O 3.5Å; V387-H434 WeakPolarHBondContact CG1-O 3.23Å
388	M	50.6	Low	68.3	Low	103 Å²	103	60.2 Å²	60.2	51%	0.507	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	39.1	-174.2	-60.4	176.4	65.7	0	0	112	P386 F412 H434 A436	P386-M388 PolarHBondContact O-N 2.74Å; M388-F412 VanDerWaalsContact C-CE1 3.46Å; M388-F412 WeakPolarHBondContact O-CE1 3.26Å; M388-H434 PolarHBondContact N-O 2.68Å; M388-A436 HydrophobicContact SD-CB 3.93Å; M388-A436 PolarHBondContact SD-N 3.47Å; M388-A436 VanDerWaalsContact SD-N 3.41Å
389	G	54.5	Low	67.9	Low	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	96.5	179.4	-177.3	0	0	0	0	0	114.9	V387 H434	V387-G389 PolarHBondContact O-N 3.23Å; V387-G389 VanDerWaalsContact O-N 3.11Å; G389-H434 PolarHBondContact O-N 2.82Å
390	Y	72.2	Confident	67.6	Low	10 Å²	10	63.6 Å²	63.6	4%	0.039	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	138.2	-173.9	-62.2	-88.4	0	0	0	111.2	I360 W378 P380 A381 V387 N407 P410 V411 C414 V431 L432 A433	I360-Y390 HydrophobicContact CD1-CD1 3.84Å; I360-Y390 HydrophobicContact CD1-CE1 3.95Å; W378-Y390 AromaticContact CE2-CG 3.96Å; W378-Y390 HydrophobicContact CZ2-CD2 4.2Å; W378-Y390 HydrophobicContact CZ2-CG 4.03Å; W378-Y390 AromaticContact NE1-CD1 3.4Å; W378-Y390 AromaticContact NE1-CD2 3.54Å; W378-Y390 AromaticContact NE1-CE1 3.79Å; W378-Y390 AromaticContact NE1-CE2 3.96Å; W378-Y390 AromaticContact NE1-CG 3.29Å; W378-Y390 VanDerWaalsContact NE1-CG 3.29Å; P380-Y390 VanDerWaalsContact CA-OH 3.25Å; P380-Y390 WeakPolarHBondContact CA-OH 3.42Å; A381-Y390 HydrophobicContact CB-CE1 4.06Å; A381-Y390 PolarHBondContact N-OH 2.84Å; V387-Y390 HydrophobicContact CG1-CE1 4.04Å; V387-Y390 HydrophobicContact CG1-CE2 4.06Å; Y390-N407 PolarHBondContact O-ND2 2.88Å; Y390-P410 CarbonylContact O-C 3.52Å; Y390-V411 VanDerWaalsContact CD2-O 3.32Å; Y390-V411 WeakPolarHBondContact CD2-O 3.49Å; Y390-V411 PolarHBondContact N-O 2.89Å; Y390-V411 PolarHBondContact O-N 2.85Å; Y390-C414 VanDerWaalsContact CE2-SG 3.55Å; Y390-V431 HydrophobicContact CD1-CG1 3.97Å; Y390-V431 HydrophobicContact CG-CG1 4.24Å; Y390-L432 CarbonylContact C-O 3.56Å; Y390-L432 WeakPolarHBondContact CA-O 3.11Å; Y390-L432 WeakPolarHBondContact CB-O 3.46Å; Y390-L432 WeakPolarHBondContact CD1-O 3.4Å; Y390-A433 HydrophobicContact CD1-CB 3.82Å; Y390-A433 HydrophobicContact CE1-CB 3.65Å
391	D	79.1	Confident	67.9	Low	21 Å²	21	65.4 Å²	65.4	11%	0.112	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	134.2	168.7	-77.3	-20.9	0	0	0	110.2	K405 N407 V431 L432 H434	D391-K405 WeakPolarHBondContact OD1-CE 3.43Å; D391-K405 IonicContact OD1-NZ 2.77Å; D391-K405 PolarHBondContact OD1-NZ 3.25Å; D391-K405 WeakPolarHBondContact OD2-CE 3.33Å; D391-K405 IonicContact OD2-NZ 3.29Å; D391-K405 PolarHBondContact OD2-NZ 2.95Å; D391-N407 WeakPolarHBondContact CA-OD1 3.32Å; D391-N407 PolarHBondContact OD1-ND2 3.39Å; D391-V431 CarbonylContact O-C 3.43Å; D391-V431 WeakPolarHBondContact O-CA 3.33Å; D391-L432 HydrophobicContact CB-CB 4.4Å; D391-L432 PolarHBondContact N-O 2.82Å; D391-L432 PolarHBondContact O-N 2.94Å; D391-H434 WeakPolarHBondContact CB-NE2 3.42Å; D391-H434 VanDerWaalsContact CG-CE1 3.48Å; D391-H434 IonicContact OD1-NE2 3.7Å; D391-H434 IonicContact OD2-CE1 3.14Å; D391-H434 PolarHBondContact OD2-CE1 2.9Å; D391-H434 IonicContact OD2-NE2 3.95Å; D391-H434 PolarHBondContact OD2-NE2 3.12Å; D391-H434 VanDerWaalsContact OD2-NE2 3.14Å
392	V	82.3	Confident	68.2	Low	0 Å²	0	72.7 Å²	72.7	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	137.6	178.6	176.3	0	0	0	0	108.8	I376 W378 V406 N407 M416 V431	I376-V392 HydrophobicContact CD1-CG1 3.61Å; I376-V392 HydrophobicContact CD1-CG2 4.33Å; W378-V392 HydrophobicContact CH2-CG2 3.59Å; W378-V392 HydrophobicContact CZ2-CG2 4.26Å; W378-V392 HydrophobicContact CZ3-CG2 3.87Å; V392-V406 HydrophobicContact CB-CB 4.43Å; V392-V406 HydrophobicContact CG1-CB 4.29Å; V392-V406 HydrophobicContact CG1-CG2 4.06Å; V392-V406 PolarHBondContact O-N 3.37Å; V392-N407 PolarHBondContact N-OD1 3.49Å; V392-N407 PolarHBondContact O-OD1 2.99Å; V392-M416 HydrophobicContact CB-CE 3.76Å; V392-M416 HydrophobicContact CB-SD 4.29Å; V392-M416 HydrophobicContact CG1-CE 3.74Å; V392-M416 HydrophobicContact CG2-CE 4.01Å; V392-M416 HydrophobicContact CG2-SD 4.05Å; V392-V431 HydrophobicContact CG2-CG2 4.43Å
393	E	87.6	Confident	69.3	Low	35 Å²	35	65.5 Å²	65.5	16%	0.164	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	141.9	173.2	-60.4	176.3	136	0	0	110.3	W403 Y404 F429 R430 L432	E393-W403 HydrophobicContact CB-CB 4.34Å; E393-W403 HydrophobicContact CB-CE3 3.96Å; E393-Y404 CarbonylContact C-O 3.51Å; E393-Y404 WeakPolarHBondContact CA-O 3.5Å; E393-F429 CarbonylContact O-C 3.48Å; E393-F429 WeakPolarHBondContact O-CA 3.39Å; E393-R430 HydrophobicContact CB-CG 4.13Å; E393-R430 PolarHBondContact N-O 3Å; E393-R430 PolarHBondContact O-N 2.92Å; E393-R430 IonicContact OE1-NH2 3.85Å; E393-R430 IonicContact OE2-CZ 3.09Å; E393-R430 IonicContact OE2-NE 2.9Å; E393-R430 PolarHBondContact OE2-NE 3.01Å; E393-R430 IonicContact OE2-NH2 2.68Å; E393-R430 PolarHBondContact OE2-NH2 3.05Å; E393-L432 HydrophobicContact CG-CD1 4.09Å
394	F	88.1	Confident	70.1	Confident	45 Å²	45	67.4 Å²	67.4	20%	0.197	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	163.4	167.4	75.1	-116.2	0	0	0	111.7	W403 Y404 V406 V418 L421 Y427 Q428 F429	F394-W403 CarbonylContact O-C 3.46Å; F394-W403 WeakPolarHBondContact O-CA 3.47Å; F394-Y404 HydrophobicContact CE2-CD2 4.3Å; F394-Y404 HydrophobicContact CE2-CG 4.48Å; F394-Y404 PolarHBondContact N-O 3.47Å; F394-Y404 PolarHBondContact O-N 3.32Å; F394-V406 HydrophobicContact CB-CG2 4.27Å; F394-V406 HydrophobicContact CD1-CG2 3.44Å; F394-V406 VanDerWaalsContact CD1-CG2 3.44Å; F394-V406 HydrophobicContact CE1-CG2 4.18Å; F394-V406 HydrophobicContact CG-CG2 4.21Å; F394-V418 HydrophobicContact CD1-CG1 4.18Å; F394-V418 HydrophobicContact CE1-CG1 4.48Å; F394-L421 HydrophobicContact CD1-CD2 4.49Å; F394-L421 HydrophobicContact CE1-CD2 4.38Å; F394-Y427 AromaticContact CD2-CD1 3.97Å; F394-Y427 HydrophobicContact CD2-CD1 3.97Å; F394-Y427 HydrophobicContact CD2-CE1 4.18Å; F394-Y427 HydrophobicContact CE2-CD1 4.37Å; F394-Y427 HydrophobicContact CE2-CE1 4.12Å; F394-Y427 HydrophobicContact CG-CD1 4.49Å; F394-Q428 CarbonylContact C-O 3.5Å; F394-Q428 WeakPolarHBondContact CA-O 3.4Å; F394-F429 HydrophobicContact CB-CD1 3.57Å; F394-F429 HydrophobicContact CB-CE1 3.47Å; F394-F429 VanDerWaalsContact CB-CE1 3.47Å; F394-F429 HydrophobicContact CB-CG 4.35Å; F394-F429 HydrophobicContact CB-CZ 4.18Å; F394-F429 HydrophobicContact CD1-CE1 4.43Å; F394-F429 HydrophobicContact CG-CE1 4.33Å
395	R	87.2	Confident	71.4	Confident	48 Å²	48	62.1 Å²	62.1	18%	0.181	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	147.9	157.6	67.4	172.1	177.9	-172.1	4.9	110.6	L397 D401 R402 W403 Y427 Q428	R395-L397 HydrophobicContact CG-CD2 4.15Å; R395-D401 IonicContact CZ-OD1 3.45Å; R395-D401 IonicContact NE-OD1 3.56Å; R395-D401 IonicContact NH1-OD1 2.59Å; R395-D401 PolarHBondContact NH1-OD1 2.92Å; R395-D401 IonicContact NH1-OD2 3.97Å; R395-R402 WeakPolarHBondContact CB-O 3.41Å; R395-W403 HydrophobicContact CB-CD2 4.14Å; R395-W403 HydrophobicContact CB-CE3 4.25Å; R395-W403 HydrophobicContact CB-CZ2 4.5Å; R395-W403 HydrophobicContact CB-CZ3 4.47Å; R395-W403 HydrophobicContact CG-CD2 4.32Å; R395-W403 HydrophobicContact CG-CE3 4.4Å; R395-W403 HydrophobicContact CG-CH2 3.9Å; R395-W403 HydrophobicContact CG-CZ2 3.79Å; R395-W403 HydrophobicContact CG-CZ3 4.2Å; R395-Y427 WeakPolarHBondContact O-CA 3.48Å; R395-Q428 HydrophobicContact CG-CB 4.1Å; R395-Q428 PolarHBondContact N-O 2.65Å; R395-Q428 VanDerWaalsContact NE-OE1 3.13Å; R395-Q428 PolarHBondContact O-N 3.45Å
396	D	86.3	Confident	72.4	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.016	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	110.1	178.6	-176.8	-49.6	0	0	0	108.3	Q398 Q399 D400 H425 Y427	D396-Q398 PolarHBondContact O-N 3.4Å; D396-Q398 VanDerWaalsContact O-N 3.13Å; D396-Q398 WeakPolarHBondContact OD1-CA 3.17Å; D396-Q398 WeakPolarHBondContact OD1-CB 3.32Å; D396-Q398 PolarHBondContact OD1-N 2.78Å; D396-Q399 HydrophobicContact CB-CB 4.17Å; D396-Q399 HydrophobicContact CB-CG 4.4Å; D396-Q399 PolarHBondContact O-N 3.41Å; D396-Q399 PolarHBondContact OD1-N 2.74Å; D396-D400 PolarHBondContact O-N 3.35Å; D396-H425 VanDerWaalsContact CG-ND1 3.3Å; D396-H425 IonicContact OD1-CE1 3.5Å; D396-H425 IonicContact OD1-CG 3.96Å; D396-H425 IonicContact OD1-ND1 3.51Å; D396-H425 PolarHBondContact OD1-ND1 2.82Å; D396-H425 IonicContact OD2-CE1 3.79Å; D396-H425 IonicContact OD2-CG 2.74Å; D396-H425 IonicContact OD2-ND1 3.62Å; D396-H425 PolarHBondContact OD2-ND1 2.88Å; D396-Y427 HydrophobicContact CB-CD1 4.14Å; D396-Y427 HydrophobicContact CB-CE1 3.58Å; D396-Y427 VanDerWaalsContact OD2-CE1 3.3Å; D396-Y427 WeakPolarHBondContact OD2-CE1 3.3Å; D396-Y427 VanDerWaalsContact OD2-CZ 3.22Å; D396-Y427 PolarHBondContact OD2-OH 3.05Å
397	L	80.1	Confident	73.5	Confident	71 Å²	71	57.1 Å²	57.1	37%	0.372	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-5.3	-171.9	-60.7	179.1	0	0	0	113.9	R395 D426 Q428 F448	R395-L397 HydrophobicContact CG-CD2 4.15Å; L397-D426 HydrophobicContact CB-CB 4.24Å; L397-D426 WeakPolarHBondContact CB-O 3.2Å; L397-D426 HydrophobicContact CD1-CB 4.04Å; L397-D426 HydrophobicContact CG-CB 4.47Å; L397-D426 WeakPolarHBondContact CG-O 3.38Å; L397-D426 PolarHBondContact N-O 3.17Å; L397-Q428 HydrophobicContact CD1-CG 4.25Å; L397-F448 HydrophobicContact CD1-CB 3.9Å; L397-F448 HydrophobicContact CD1-CG 4.45Å
398	Q	77	Confident	73	Confident	88 Å²	88	62.3 Å²	62.3	41%	0.411	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-26.6	-179.4	-82.4	72.3	2.6	0	0	111.7	D396 D426	D396-Q398 PolarHBondContact O-N 3.4Å; D396-Q398 VanDerWaalsContact O-N 3.13Å; D396-Q398 WeakPolarHBondContact OD1-CA 3.17Å; D396-Q398 WeakPolarHBondContact OD1-CB 3.32Å; D396-Q398 PolarHBondContact OD1-N 2.78Å; Q398-D426 PolarHBondContact NE2-OD2 3.46Å
399	Q	70.3	Confident	72.9	Confident	120 Å²	120	64.7 Å²	64.7	56%	0.561	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-64.5	176.6	-66.2	-167.2	-1.4	0	0	113.7	D396	D396-Q399 HydrophobicContact CB-CB 4.17Å; D396-Q399 HydrophobicContact CB-CG 4.4Å; D396-Q399 PolarHBondContact O-N 3.41Å; D396-Q399 PolarHBondContact OD1-N 2.74Å
400	D	63.2	Low	72.9	Confident	63 Å²	63	66.1 Å²	66.1	34%	0.337	31%	0.313	S	S	.	.			trans	-157.6	168.7	-178.9	72.2	32.9	0	0	0	113	D396 R402 Y404	D396-D400 PolarHBondContact O-N 3.35Å; D400-R402 PolarHBondContact O-N 3.02Å; D400-R402 WeakPolarHBondContact OD1-CA 3.18Å; D400-R402 WeakPolarHBondContact OD1-CB 3.5Å; D400-R402 PolarHBondContact OD1-N 3.27Å; D400-Y404 WeakPolarHBondContact OD1-CE2 3.5Å; D400-Y404 PolarHBondContact OD2-OH 2.98Å
401	D	69.9	Low	72	Confident	122 Å²	122	67.1 Å²	67.1	65%	0.652	32%	0.32	S	S	*	.	S	Bend	trans	-87.2	23.8	178.6	-162.2	25.6	0	0	0	113.5	R395	R395-D401 IonicContact CZ-OD1 3.45Å; R395-D401 IonicContact NE-OD1 3.56Å; R395-D401 IonicContact NH1-OD1 2.59Å; R395-D401 PolarHBondContact NH1-OD1 2.92Å; R395-D401 IonicContact NH1-OD2 3.97Å
402	R	70.1	Confident	70.6	Confident	163 Å²	163	73.6 Å²	73.6	62%	0.615	35%	0.347	S	S	*	.			trans	-94.3	146.7	-177.3	-165	178.6	177.8	175.6	-0.4	111.2	R395 D400 Y404	R395-R402 WeakPolarHBondContact CB-O 3.41Å; D400-R402 PolarHBondContact O-N 3.02Å; D400-R402 WeakPolarHBondContact OD1-CA 3.18Å; D400-R402 WeakPolarHBondContact OD1-CB 3.5Å; D400-R402 PolarHBondContact OD1-N 3.27Å; R402-Y404 HydrophobicContact CB-CE2 3.8Å; R402-Y404 HydrophobicContact CG-CE2 4.32Å; R402-Y404 WeakPolarHBondContact O-CD2 3.44Å
403	W	78.9	Confident	69	Low	41 Å²	41	75.1 Å²	75.1	16%	0.155	36%	0.36	C	S	.	.			trans	-92.7	127.2	172.7	-68.7	82.8	0	0	0	110.2	E393 F394 R395 Q428 R430 P445	E393-W403 HydrophobicContact CB-CB 4.34Å; E393-W403 HydrophobicContact CB-CE3 3.96Å; F394-W403 CarbonylContact O-C 3.46Å; F394-W403 WeakPolarHBondContact O-CA 3.47Å; R395-W403 HydrophobicContact CB-CD2 4.14Å; R395-W403 HydrophobicContact CB-CE3 4.25Å; R395-W403 HydrophobicContact CB-CZ2 4.5Å; R395-W403 HydrophobicContact CB-CZ3 4.47Å; R395-W403 HydrophobicContact CG-CD2 4.32Å; R395-W403 HydrophobicContact CG-CE3 4.4Å; R395-W403 HydrophobicContact CG-CH2 3.9Å; R395-W403 HydrophobicContact CG-CZ2 3.79Å; R395-W403 HydrophobicContact CG-CZ3 4.2Å; W403-Q428 HydrophobicContact CH2-CB 4.11Å; W403-Q428 WeakPolarHBondContact CZ3-O 3.42Å; W403-R430 VanDerWaalsContact CD1-NH1 3.26Å; W403-R430 HydrophobicContact CD2-CG 4.23Å; W403-R430 HydrophobicContact CE3-CB 4.46Å; W403-R430 HydrophobicContact CE3-CG 3.62Å; W403-R430 HydrophobicContact CH2-CB 4.15Å; W403-R430 HydrophobicContact CH2-CG 4.12Å; W403-R430 HydrophobicContact CZ3-CB 3.91Å; W403-R430 HydrophobicContact CZ3-CG 3.56Å; W403-P445 HydrophobicContact CH2-CB 3.9Å; W403-P445 HydrophobicContact CH2-CG 4.02Å; W403-P445 HydrophobicContact CZ2-CB 4.13Å; W403-P445 HydrophobicContact CZ2-CG 3.81Å
404	Y	73.3	Confident	68.2	Low	78 Å²	78	74.3 Å²	74.3	31%	0.306	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	127.5	-178.4	-69.4	-80.6	0	0	0	109.7	E393 F394 D400 R402	E393-Y404 CarbonylContact C-O 3.51Å; E393-Y404 WeakPolarHBondContact CA-O 3.5Å; F394-Y404 HydrophobicContact CE2-CD2 4.3Å; F394-Y404 HydrophobicContact CE2-CG 4.48Å; F394-Y404 PolarHBondContact N-O 3.47Å; F394-Y404 PolarHBondContact O-N 3.32Å; D400-Y404 WeakPolarHBondContact OD1-CE2 3.5Å; D400-Y404 PolarHBondContact OD2-OH 2.98Å; R402-Y404 HydrophobicContact CB-CE2 3.8Å; R402-Y404 HydrophobicContact CG-CE2 4.32Å; R402-Y404 WeakPolarHBondContact O-CD2 3.44Å
405	K	75.4	Confident	66.8	Low	91 Å²	91	77.4 Å²	77.4	40%	0.396	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	137.4	177.5	-157.2	-162.7	-171	-152.9	0	110.1	D391 N407 D408	D391-K405 WeakPolarHBondContact OD1-CE 3.43Å; D391-K405 IonicContact OD1-NZ 2.77Å; D391-K405 PolarHBondContact OD1-NZ 3.25Å; D391-K405 WeakPolarHBondContact OD2-CE 3.33Å; D391-K405 IonicContact OD2-NZ 3.29Å; D391-K405 PolarHBondContact OD2-NZ 2.95Å; K405-N407 WeakPolarHBondContact CD-O 3.28Å; K405-N407 WeakPolarHBondContact CE-O 3.4Å; K405-N407 PolarHBondContact NZ-O 3.15Å; K405-D408 PolarHBondContact NZ-O 3.15Å; K405-D408 VanDerWaalsContact NZ-O 3.15Å
406	V	69.5	Low	65.9	Low	44 Å²	44	76.4 Å²	76.4	27%	0.267	37%	0.369	S	S	.	.			trans	-105.5	-24.4	-171.6	-167.9	0	0	0	0	112.9	V392 F394 M416 V418	V392-V406 HydrophobicContact CB-CB 4.43Å; V392-V406 HydrophobicContact CG1-CB 4.29Å; V392-V406 HydrophobicContact CG1-CG2 4.06Å; V392-V406 PolarHBondContact O-N 3.37Å; F394-V406 HydrophobicContact CB-CG2 4.27Å; F394-V406 HydrophobicContact CD1-CG2 3.44Å; F394-V406 VanDerWaalsContact CD1-CG2 3.44Å; F394-V406 HydrophobicContact CE1-CG2 4.18Å; F394-V406 HydrophobicContact CG-CG2 4.21Å; V406-M416 HydrophobicContact CB-CE 3.75Å; V406-M416 HydrophobicContact CG1-CE 3.41Å; V406-M416 VanDerWaalsContact CG1-CE 3.41Å; V406-V418 HydrophobicContact CG1-CB 4.29Å; V406-V418 HydrophobicContact CG1-CG1 3.66Å; V406-V418 HydrophobicContact CG1-CG2 3.84Å
407	N	69.6	Low	65.3	Low	13 Å²	13	80 Å²	80	7%	0.07	39%	0.391	C	S	.	.			trans	-122.6	129.2	-178	66.1	-66.7	0	0	0	110.5	Y390 D391 V392 K405 Q409 V411 M416	Y390-N407 PolarHBondContact O-ND2 2.88Å; D391-N407 WeakPolarHBondContact CA-OD1 3.32Å; D391-N407 PolarHBondContact OD1-ND2 3.39Å; V392-N407 PolarHBondContact N-OD1 3.49Å; V392-N407 PolarHBondContact O-OD1 2.99Å; K405-N407 WeakPolarHBondContact CD-O 3.28Å; K405-N407 WeakPolarHBondContact CE-O 3.4Å; K405-N407 PolarHBondContact NZ-O 3.15Å; N407-Q409 PolarHBondContact ND2-O 3.35Å; N407-V411 HydrophobicContact CB-CG2 3.79Å; N407-M416 HydrophobicContact CB-SD 4.07Å
408	D	48.7	Very low	64.9	Low	149 Å²	149	76.8 Å²	76.8	80%	0.797	37%	0.374	S	S	*	.	S	Bend	trans	-71.2	-42.6	176.1	-63.7	-58.6	0	0	0	111.8	K405	K405-D408 PolarHBondContact NZ-O 3.15Å; K405-D408 VanDerWaalsContact NZ-O 3.15Å
409	Q	47.1	Very low	64.4	Low	153 Å²	153	73.7 Å²	73.7	72%	0.715	37%	0.365	S	S	*	.	S	Bend	trans	-104.8	139.6	178.7	-61.3	-57.2	-33.9	0	0	111.9	N407 V411	N407-Q409 PolarHBondContact ND2-O 3.35Å; Q409-V411 PolarHBondContact O-N 2.9Å
410	P	55.2	Low	64.1	Low	31 Å²	31	72.8 Å²	72.8	20%	0.201	36%	0.364	C	S	.	.			trans	-56.2	126.7	-177.5	-27.9	36.1	0	0	0	113.5	Y390 F412	Y390-P410 CarbonylContact O-C 3.52Å; P410-F412 WeakPolarHBondContact O-CD2 3.15Å; P410-F412 VanDerWaalsContact O-CE2 3.28Å; P410-F412 WeakPolarHBondContact O-CE2 3.29Å; P410-F412 PolarHBondContact O-N 3.41Å
411	V	53.9	Low	64.6	Low	31 Å²	31	70.1 Å²	70.1	19%	0.188	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-81.4	117.6	-177	-174.7	0	0	0	0	110	Y390 N407 Q409 A413 M416	Y390-V411 VanDerWaalsContact CD2-O 3.32Å; Y390-V411 WeakPolarHBondContact CD2-O 3.49Å; Y390-V411 PolarHBondContact N-O 2.89Å; Y390-V411 PolarHBondContact O-N 2.85Å; N407-V411 HydrophobicContact CB-CG2 3.79Å; Q409-V411 PolarHBondContact O-N 2.9Å; V411-A413 WeakPolarHBondContact CG1-O 3.37Å; V411-M416 HydrophobicContact CG2-CG 4.5Å; V411-M416 HydrophobicContact CG2-SD 3.67Å
412	F	49.4	Very low	64.7	Low	157 Å²	157	67.5 Å²	67.5	69%	0.689	34%	0.336	S	S	*	.			trans	-76.6	-23.3	-177.7	-59.6	-84.6	0	0	0	113.9	M388 P410	M388-F412 VanDerWaalsContact C-CE1 3.46Å; M388-F412 WeakPolarHBondContact O-CE1 3.26Å; P410-F412 WeakPolarHBondContact O-CD2 3.15Å; P410-F412 VanDerWaalsContact O-CE2 3.28Å; P410-F412 WeakPolarHBondContact O-CE2 3.29Å; P410-F412 PolarHBondContact O-N 3.41Å
413	A	47.8	Very low	64.9	Low	32 Å²	32	64.3 Å²	64.3	26%	0.264	33%	0.329	S	S	.	.	S	Bend	trans	-85.6	134.9	174.9	0	0	0	0	0	111.1	W378 V411 K415	W378-A413 VanDerWaalsContact CZ2-O 3.25Å; W378-A413 WeakPolarHBondContact CZ2-O 3.44Å; V411-A413 WeakPolarHBondContact CG1-O 3.37Å; A413-K415 HydrophobicContact CB-CG 4.48Å; A413-K415 PolarHBondContact O-N 2.97Å
414	C	70.8	Confident	64.5	Low	18 Å²	18	66.8 Å²	66.8	12%	0.122	35%	0.345	C	S	.	.	S	Bend	trans	-76	44.2	172.8	-47.7	0	0	0	0	113.6	C377 W378 Y390	C377-C414 WeakPolarHBondContact CA-O 3.3Å; C377-C414 WeakPolarHBondContact CB-O 3.45Å; W378-C414 HydrophobicContact CD2-CB 4.21Å; W378-C414 VanDerWaalsContact CE2-CA 3.47Å; W378-C414 HydrophobicContact CG-CB 4.08Å; W378-C414 PolarHBondContact N-O 3.26Å; W378-C414 VanDerWaalsContact N-O 3.1Å; W378-C414 WeakPolarHBondContact O-CB 3.47Å; Y390-C414 VanDerWaalsContact CE2-SG 3.55Å
415	K	59.5	Low	64.8	Low	110 Å²	110	64.9 Å²	64.9	48%	0.478	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	147.9	168.7	66.6	154.1	-165.4	157.6	0	109.1	I376 C377 A413	I376-K415 CarbonylContact O-C 3.5Å; I376-K415 VanDerWaalsContact O-CA 3.24Å; I376-K415 WeakPolarHBondContact O-CA 3.19Å; C377-K415 HydrophobicContact CB-CB 3.9Å; A413-K415 HydrophobicContact CB-CG 4.48Å; A413-K415 PolarHBondContact O-N 2.97Å
416	M	67	Low	65.1	Low	27 Å²	27	61.9 Å²	61.9	13%	0.133	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	144.7	173.8	-164.5	-178.2	82.2	0	0	110.4	T375 I376 W378 V392 V406 N407 V411 V418	T375-M416 CarbonylContact C-O 3.54Å; T375-M416 WeakPolarHBondContact CA-O 3.13Å; I376-M416 PolarHBondContact N-O 2.91Å; I376-M416 PolarHBondContact O-N 2.89Å; W378-M416 HydrophobicContact CH2-CB 3.99Å; W378-M416 HydrophobicContact CZ3-CB 4.05Å; V392-M416 HydrophobicContact CB-CE 3.76Å; V392-M416 HydrophobicContact CB-SD 4.29Å; V392-M416 HydrophobicContact CG1-CE 3.74Å; V392-M416 HydrophobicContact CG2-CE 4.01Å; V392-M416 HydrophobicContact CG2-SD 4.05Å; V406-M416 HydrophobicContact CB-CE 3.75Å; V406-M416 HydrophobicContact CG1-CE 3.41Å; V406-M416 VanDerWaalsContact CG1-CE 3.41Å; N407-M416 HydrophobicContact CB-SD 4.07Å; V411-M416 HydrophobicContact CG2-CG 4.5Å; V411-M416 HydrophobicContact CG2-SD 3.67Å; M416-V418 HydrophobicContact CE-CG2 3.66Å
417	T	73.9	Confident	65.8	Low	78 Å²	78	60 Å²	60	48%	0.479	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	126.3	171.6	-52.4	0	0	0	0	108.9	K373 I374 T375	K373-T417 HydrophobicContact CB-CG2 4.37Å; I374-T417 WeakPolarHBondContact O-CA 3.35Å; T375-T417 WeakPolarHBondContact OG1-CG2 3.23Å; T375-T417 PolarHBondContact OG1-OG1 2.86Å
418	V	73.5	Confident	66.7	Low	4 Å²	4	60.6 Å²	60.6	2%	0.024	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	128.5	171.8	-169.7	0	0	0	0	106.7	K373 I374 F394 V406 M416 L421 F429	K373-V418 CarbonylContact C-O 3.57Å; K373-V418 VanDerWaalsContact CA-O 3.28Å; K373-V418 WeakPolarHBondContact CA-O 3.37Å; I374-V418 PolarHBondContact N-O 2.6Å; I374-V418 PolarHBondContact O-N 3.08Å; F394-V418 HydrophobicContact CD1-CG1 4.18Å; F394-V418 HydrophobicContact CE1-CG1 4.48Å; V406-V418 HydrophobicContact CG1-CB 4.29Å; V406-V418 HydrophobicContact CG1-CG1 3.66Å; V406-V418 HydrophobicContact CG1-CG2 3.84Å; M416-V418 HydrophobicContact CE-CG2 3.66Å; V418-L421 HydrophobicContact CB-CD1 4.46Å; V418-L421 HydrophobicContact CG1-CD1 4.33Å; V418-L421 HydrophobicContact CG1-CD2 3.9Å; V418-L421 HydrophobicContact CG1-CG 4.26Å; V418-F429 HydrophobicContact CB-CE1 4.07Å; V418-F429 HydrophobicContact CG1-CE1 4.19Å; V418-F429 HydrophobicContact CG2-CD1 4.23Å; V418-F429 HydrophobicContact CG2-CE1 3.7Å
419	G	66.1	Low	68.7	Low	22 Å²	22	53.5 Å²	53.5	23%	0.227	28%	0.28	C	S	.	.			trans	-118.6	-171.4	175.7	0	0	0	0	0	111.4	D372 L421	D372-G419 CarbonylContact O-C 3.48Å; D372-G419 WeakPolarHBondContact O-CA 3.42Å; G419-L421 PolarHBondContact O-N 2.82Å
420	D	62.5	Low	70.7	Confident	101 Å²	101	48.8 Å²	48.8	54%	0.54	26%	0.256	S	S	.	.			trans	62.8	22.5	177.3	-38.6	-54.8	0	0	0	113.4	R209 D372	R209-D420 IonicContact CZ-OD1 3.75Å; R209-D420 IonicContact CZ-OD2 3.85Å; R209-D420 VanDerWaalsContact CZ-OD2 3.25Å; R209-D420 IonicContact NH1-OD2 2.86Å; R209-D420 PolarHBondContact NH1-OD2 2.79Å; R209-D420 IonicContact NH2-OD1 3.79Å; R209-D420 PolarHBondContact NH2-OD1 3.15Å; R209-D420 IonicContact NH2-OD2 3.7Å; R209-D420 PolarHBondContact NH2-OD2 2.6Å; D372-D420 PolarHBondContact O-N 2.94Å; D372-D420 PolarHBondContact OD2-N 3.45Å
421	L	74.2	Confident	72.2	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.037	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-79.6	142.5	-178.3	-60.3	175.4	0	0	0	111.6	D372 I374 F394 V418 G419 Y427 F429 I451	D372-L421 WeakPolarHBondContact O-CB 3.41Å; D372-L421 PolarHBondContact O-N 3.46Å; I374-L421 HydrophobicContact CB-CD1 4.03Å; I374-L421 HydrophobicContact CD1-CD1 3.64Å; I374-L421 HydrophobicContact CG1-CD1 3.74Å; F394-L421 HydrophobicContact CD1-CD2 4.49Å; F394-L421 HydrophobicContact CE1-CD2 4.38Å; V418-L421 HydrophobicContact CB-CD1 4.46Å; V418-L421 HydrophobicContact CG1-CD1 4.33Å; V418-L421 HydrophobicContact CG1-CD2 3.9Å; V418-L421 HydrophobicContact CG1-CG 4.26Å; G419-L421 PolarHBondContact O-N 2.82Å; L421-Y427 HydrophobicContact CB-CD2 4.24Å; L421-Y427 HydrophobicContact CB-CE2 3.8Å; L421-Y427 HydrophobicContact CD1-CD2 4.36Å; L421-Y427 HydrophobicContact CD2-CD1 4.05Å; L421-Y427 HydrophobicContact CD2-CD2 4.36Å; L421-Y427 HydrophobicContact CD2-CE1 3.93Å; L421-Y427 HydrophobicContact CD2-CE2 4.23Å; L421-Y427 HydrophobicContact CD2-CG 4.28Å; L421-Y427 HydrophobicContact CG-CE2 4.47Å; L421-F429 HydrophobicContact CD1-CZ 4.11Å; L421-I451 HydrophobicContact CB-CD1 4.04Å; L421-I451 HydrophobicContact CB-CG1 4.1Å; L421-I451 HydrophobicContact CD1-CD1 4.17Å
422	I	73.1	Confident	73.7	Confident	68 Å²	68	47.1 Å²	47.1	35%	0.349	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-76.6	140.4	-170.5	-54.1	173.1	0	0	0	110.5	H425 Y427 I451	I422-H425 HydrophobicContact CB-CB 4.31Å; I422-H425 WeakPolarHBondContact O-CB 3.31Å; I422-Y427 VanDerWaalsContact CB-OH 3.27Å; I422-Y427 WeakPolarHBondContact CB-OH 3.16Å; I422-Y427 WeakPolarHBondContact CG1-OH 3.31Å; I422-Y427 PolarHBondContact N-OH 3.22Å; I422-I451 VanDerWaalsContact O-CB 3.29Å; I422-I451 WeakPolarHBondContact O-CB 3.32Å; I422-I451 WeakPolarHBondContact O-CG1 3.27Å
423	M	72.6	Confident	75	Confident	95 Å²	95	39.6 Å²	39.6	47%	0.468	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	145.2	-178.8	-55.6	172.4	76.7	0	0	111.2	H425 I451 P453	M423-H425 PolarHBondContact O-CD2 3Å; M423-H425 PolarHBondContact O-N 3.02Å; M423-I451 HydrophobicContact CB-CG2 4.46Å; M423-I451 HydrophobicContact CG-CG2 4.29Å; M423-P453 HydrophobicContact CE-CB 3.8Å; M423-P453 HydrophobicContact CE-CG 4.36Å
424	D	72.4	Confident	75.8	Confident	93 Å²	93	39.3 Å²	39.3	50%	0.497	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	14.5	-172.8	-56.9	-39.8	0	0	0	115.2	H450 I451 P453	D424-H450 PolarHBondContact O-CE1 3.01Å; D424-H450 VanDerWaalsContact O-CE1 3.22Å; D424-I451 WeakPolarHBondContact CA-O 3.3Å; D424-I451 PolarHBondContact N-O 2.73Å; D424-P453 VanDerWaalsContact OD1-CD 3.3Å; D424-P453 WeakPolarHBondContact OD1-CD 3.29Å; D424-P453 WeakPolarHBondContact OD1-CG 3.32Å
425	H	79.1	Confident	75.5	Confident	38 Å²	38	39 Å²	39	18%	0.176	20%	0.201	C	C	.	.			trans	-99.3	155	174.3	-75.9	-143.3	0	0	0	112.7	D396 I422 M423 Y427 H450 I451	D396-H425 VanDerWaalsContact CG-ND1 3.3Å; D396-H425 IonicContact OD1-CE1 3.5Å; D396-H425 IonicContact OD1-CG 3.96Å; D396-H425 IonicContact OD1-ND1 3.51Å; D396-H425 PolarHBondContact OD1-ND1 2.82Å; D396-H425 IonicContact OD2-CE1 3.79Å; D396-H425 IonicContact OD2-CG 2.74Å; D396-H425 IonicContact OD2-ND1 3.62Å; D396-H425 PolarHBondContact OD2-ND1 2.88Å; I422-H425 HydrophobicContact CB-CB 4.31Å; I422-H425 WeakPolarHBondContact O-CB 3.31Å; M423-H425 PolarHBondContact O-CD2 3Å; M423-H425 PolarHBondContact O-N 3.02Å; H425-Y427 HydrophobicContact CB-CD2 4.49Å; H425-Y427 HydrophobicContact CB-CE2 3.67Å; H425-H450 WeakPolarHBondContact O-CA 3.49Å; H425-I451 PolarHBondContact O-N 2.89Å
426	D	81	Confident	74.9	Confident	29 Å²	29	36.7 Å²	36.7	16%	0.155	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	121	176.7	-64.7	-59.5	0	0	0	111.5	L397 Q398 F448 V449 H450	L397-D426 HydrophobicContact CB-CB 4.24Å; L397-D426 WeakPolarHBondContact CB-O 3.2Å; L397-D426 HydrophobicContact CD1-CB 4.04Å; L397-D426 HydrophobicContact CG-CB 4.47Å; L397-D426 WeakPolarHBondContact CG-O 3.38Å; L397-D426 PolarHBondContact N-O 3.17Å; Q398-D426 PolarHBondContact NE2-OD2 3.46Å; D426-F448 HydrophobicContact CB-CD2 3.97Å; D426-F448 WeakPolarHBondContact OD1-CD2 3.46Å; D426-V449 CarbonylContact C-O 3.52Å; D426-V449 WeakPolarHBondContact CA-O 3.43Å; D426-H450 WeakPolarHBondContact OD1-CB 3.39Å; D426-H450 IonicContact OD1-CG 3.52Å; D426-H450 IonicContact OD1-ND1 3.67Å; D426-H450 PolarHBondContact OD1-ND1 2.99Å; D426-H450 IonicContact OD2-ND1 2.74Å
427	Y	84.6	Confident	74.1	Confident	3 Å²	3	37.5 Å²	37.5	1%	0.012	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	148.2	-178.8	-67.9	-82.7	0	0	0	113.2	F394 R395 D396 L421 I422 H425 F448 V449 I451	F394-Y427 AromaticContact CD2-CD1 3.97Å; F394-Y427 HydrophobicContact CD2-CD1 3.97Å; F394-Y427 HydrophobicContact CD2-CE1 4.18Å; F394-Y427 HydrophobicContact CE2-CD1 4.37Å; F394-Y427 HydrophobicContact CE2-CE1 4.12Å; F394-Y427 HydrophobicContact CG-CD1 4.49Å; R395-Y427 WeakPolarHBondContact O-CA 3.48Å; D396-Y427 HydrophobicContact CB-CD1 4.14Å; D396-Y427 HydrophobicContact CB-CE1 3.58Å; D396-Y427 VanDerWaalsContact OD2-CE1 3.3Å; D396-Y427 WeakPolarHBondContact OD2-CE1 3.3Å; D396-Y427 VanDerWaalsContact OD2-CZ 3.22Å; D396-Y427 PolarHBondContact OD2-OH 3.05Å; L421-Y427 HydrophobicContact CB-CD2 4.24Å; L421-Y427 HydrophobicContact CB-CE2 3.8Å; L421-Y427 HydrophobicContact CD1-CD2 4.36Å; L421-Y427 HydrophobicContact CD2-CD1 4.05Å; L421-Y427 HydrophobicContact CD2-CD2 4.36Å; L421-Y427 HydrophobicContact CD2-CE1 3.93Å; L421-Y427 HydrophobicContact CD2-CE2 4.23Å; L421-Y427 HydrophobicContact CD2-CG 4.28Å; L421-Y427 HydrophobicContact CG-CE2 4.47Å; I422-Y427 VanDerWaalsContact CB-OH 3.27Å; I422-Y427 WeakPolarHBondContact CB-OH 3.16Å; I422-Y427 WeakPolarHBondContact CG1-OH 3.31Å; I422-Y427 PolarHBondContact N-OH 3.22Å; H425-Y427 HydrophobicContact CB-CD2 4.49Å; H425-Y427 HydrophobicContact CB-CE2 3.67Å; Y427-F448 VanDerWaalsContact O-CA 3.27Å; Y427-F448 WeakPolarHBondContact O-CA 3.31Å; Y427-V449 PolarHBondContact N-O 2.84Å; Y427-V449 WeakPolarHBondContact O-CG1 3.34Å; Y427-V449 PolarHBondContact O-N 3.48Å; Y427-I451 HydrophobicContact CD2-CD1 4.46Å; Y427-I451 HydrophobicContact CD2-CG1 3.92Å; Y427-I451 HydrophobicContact CE2-CG1 3.87Å
428	Q	88.3	Confident	73.2	Confident	27 Å²	27	35.3 Å²	35.3	13%	0.126	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	147	166.5	-72.9	-173.4	-67.1	0	0	111.2	F394 R395 L397 W403 S446 F448	F394-Q428 CarbonylContact C-O 3.5Å; F394-Q428 WeakPolarHBondContact CA-O 3.4Å; R395-Q428 HydrophobicContact CG-CB 4.1Å; R395-Q428 PolarHBondContact N-O 2.65Å; R395-Q428 VanDerWaalsContact NE-OE1 3.13Å; R395-Q428 PolarHBondContact O-N 3.45Å; L397-Q428 HydrophobicContact CD1-CG 4.25Å; W403-Q428 HydrophobicContact CH2-CB 4.11Å; W403-Q428 WeakPolarHBondContact CZ3-O 3.42Å; Q428-S446 PolarHBondContact NE2-O 2.99Å; Q428-F448 HydrophobicContact CG-CB 3.68Å
429	F	91.4	Very high	72.6	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	148.8	-172.5	-59.9	-95.8	0	0	0	111.8	P364 F366 I374 I376 E393 F394 V418 L421 P445 S446 V449	P364-F429 HydrophobicContact CG-CB 4.12Å; P364-F429 WeakPolarHBondContact CG-O 3.31Å; F366-F429 AromaticContact CE1-CD2 3.53Å; F366-F429 HydrophobicContact CE1-CD2 3.53Å; F366-F429 AromaticContact CE1-CE2 3.78Å; F366-F429 HydrophobicContact CE1-CE2 3.78Å; F366-F429 AromaticContact CZ-CD2 3.97Å; F366-F429 HydrophobicContact CZ-CD2 3.97Å; F366-F429 HydrophobicContact CZ-CE2 4.34Å; I374-F429 HydrophobicContact CD1-CE2 4.24Å; I374-F429 HydrophobicContact CD1-CZ 4.34Å; I374-F429 HydrophobicContact CG2-CE2 4.42Å; I376-F429 HydrophobicContact CD1-CB 4.11Å; I376-F429 HydrophobicContact CD1-CD1 4.32Å; I376-F429 HydrophobicContact CD1-CG 4.42Å; I376-F429 HydrophobicContact CG2-CB 4.3Å; I376-F429 HydrophobicContact CG2-CD1 4.39Å; I376-F429 HydrophobicContact CG2-CD2 4.15Å; I376-F429 HydrophobicContact CG2-CG 4.01Å; E393-F429 CarbonylContact O-C 3.48Å; E393-F429 WeakPolarHBondContact O-CA 3.39Å; F394-F429 HydrophobicContact CB-CD1 3.57Å; F394-F429 HydrophobicContact CB-CE1 3.47Å; F394-F429 VanDerWaalsContact CB-CE1 3.47Å; F394-F429 HydrophobicContact CB-CG 4.35Å; F394-F429 HydrophobicContact CB-CZ 4.18Å; F394-F429 HydrophobicContact CD1-CE1 4.43Å; F394-F429 HydrophobicContact CG-CE1 4.33Å; V418-F429 HydrophobicContact CB-CE1 4.07Å; V418-F429 HydrophobicContact CG1-CE1 4.19Å; V418-F429 HydrophobicContact CG2-CD1 4.23Å; V418-F429 HydrophobicContact CG2-CE1 3.7Å; L421-F429 HydrophobicContact CD1-CZ 4.11Å; F429-P445 CarbonylContact O-C 3.43Å; F429-P445 WeakPolarHBondContact O-CA 3.4Å; F429-S446 PolarHBondContact N-OG 3.14Å; F429-S446 PolarHBondContact O-N 2.78Å; F429-V449 HydrophobicContact CE2-CG1 3.98Å
430	R	88.3	Confident	73.1	Confident	54 Å²	54	38 Å²	38	20%	0.204	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	165.4	172	75	-173.5	-169.6	-167.3	-1.4	111	E393 W403 P442 S443	E393-R430 HydrophobicContact CB-CG 4.13Å; E393-R430 PolarHBondContact N-O 3Å; E393-R430 PolarHBondContact O-N 2.92Å; E393-R430 IonicContact OE1-NH2 3.85Å; E393-R430 IonicContact OE2-CZ 3.09Å; E393-R430 IonicContact OE2-NE 2.9Å; E393-R430 PolarHBondContact OE2-NE 3.01Å; E393-R430 IonicContact OE2-NH2 2.68Å; E393-R430 PolarHBondContact OE2-NH2 3.05Å; W403-R430 VanDerWaalsContact CD1-NH1 3.26Å; W403-R430 HydrophobicContact CD2-CG 4.23Å; W403-R430 HydrophobicContact CE3-CB 4.46Å; W403-R430 HydrophobicContact CE3-CG 3.62Å; W403-R430 HydrophobicContact CH2-CB 4.15Å; W403-R430 HydrophobicContact CH2-CG 4.12Å; W403-R430 HydrophobicContact CZ3-CB 3.91Å; W403-R430 HydrophobicContact CZ3-CG 3.56Å; R430-P442 HydrophobicContact CG-CB 4.2Å; R430-S443 WeakPolarHBondContact CA-OG 3.15Å
431	V	86.3	Confident	73.8	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	143	-172.3	-169	0	0	0	0	111.7	I360 P364 W378 Y390 D391 V392 P442 S443	I360-V431 HydrophobicContact CD1-CB 3.88Å; I360-V431 HydrophobicContact CD1-CG1 3.74Å; P364-V431 HydrophobicContact CB-CG2 4.15Å; P364-V431 HydrophobicContact CG-CG2 4.12Å; W378-V431 HydrophobicContact CB-CG2 4.42Å; W378-V431 HydrophobicContact CD2-CG1 4.07Å; W378-V431 HydrophobicContact CD2-CG2 3.89Å; W378-V431 HydrophobicContact CE3-CG2 3.97Å; W378-V431 HydrophobicContact CG-CG1 4.27Å; W378-V431 HydrophobicContact CG-CG2 4.11Å; W378-V431 HydrophobicContact CZ2-CG1 4.18Å; Y390-V431 HydrophobicContact CD1-CG1 3.97Å; Y390-V431 HydrophobicContact CG-CG1 4.24Å; D391-V431 CarbonylContact O-C 3.43Å; D391-V431 WeakPolarHBondContact O-CA 3.33Å; V392-V431 HydrophobicContact CG2-CG2 4.43Å; V431-P442 CarbonylContact O-C 3.58Å; V431-P442 WeakPolarHBondContact O-CA 3.41Å; V431-S443 PolarHBondContact N-OG 3.13Å; V431-S443 PolarHBondContact O-N 3.27Å
432	L	86.1	Confident	74.2	Confident	25 Å²	25	41.5 Å²	41.5	13%	0.131	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	148.6	171.7	-59.7	82.5	0	0	0	109.5	Y390 D391 E393 P442	Y390-L432 CarbonylContact C-O 3.56Å; Y390-L432 WeakPolarHBondContact CA-O 3.11Å; Y390-L432 WeakPolarHBondContact CB-O 3.46Å; Y390-L432 WeakPolarHBondContact CD1-O 3.4Å; D391-L432 HydrophobicContact CB-CB 4.4Å; D391-L432 PolarHBondContact N-O 2.82Å; D391-L432 PolarHBondContact O-N 2.94Å; E393-L432 HydrophobicContact CG-CD1 4.09Å; L432-P442 HydrophobicContact CD1-CB 4.29Å; L432-P442 HydrophobicContact CD1-CG 4.28Å; L432-P442 HydrophobicContact CD2-CG 4.11Å; L432-P442 HydrophobicContact CG-CB 4.17Å; L432-P442 HydrophobicContact CG-CG 3.99Å
433	A	76.4	Confident	74.9	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	140.4	176	0	0	0	0	0	111.3	A357 I360 A381 V387 Y390 C439 S440	A357-A433 WeakPolarHBondContact CB-O 3.41Å; I360-A433 HydrophobicContact CD1-CB 4.21Å; I360-A433 HydrophobicContact CG1-CB 4.25Å; A381-A433 HydrophobicContact CB-CB 3.6Å; V387-A433 HydrophobicContact CG1-CB 4.13Å; Y390-A433 HydrophobicContact CD1-CB 3.82Å; Y390-A433 HydrophobicContact CE1-CB 3.65Å; A433-C439 CarbonylContact O-C 3.55Å; A433-C439 WeakPolarHBondContact O-CA 3.35Å; A433-S440 PolarHBondContact N-OG 3Å; A433-S440 PolarHBondContact O-N 3.41Å
434	H	65.3	Low	75.6	Confident	26 Å²	26	36.9 Å²	36.9	12%	0.12	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.8	-176.2	-63.1	-113.8	0	0	0	110.1	V387 M388 G389 D391 C439	V387-H434 CarbonylContact C-O 3.56Å; V387-H434 VanDerWaalsContact CA-O 3.25Å; V387-H434 WeakPolarHBondContact CA-O 3.5Å; V387-H434 WeakPolarHBondContact CG1-O 3.23Å; M388-H434 PolarHBondContact N-O 2.68Å; G389-H434 PolarHBondContact O-N 2.82Å; D391-H434 WeakPolarHBondContact CB-NE2 3.42Å; D391-H434 VanDerWaalsContact CG-CE1 3.48Å; D391-H434 IonicContact OD1-NE2 3.7Å; D391-H434 IonicContact OD2-CE1 3.14Å; D391-H434 PolarHBondContact OD2-CE1 2.9Å; D391-H434 IonicContact OD2-NE2 3.95Å; D391-H434 PolarHBondContact OD2-NE2 3.12Å; D391-H434 VanDerWaalsContact OD2-NE2 3.14Å; H434-C439 PolarHBondContact CE1-SG 2.85Å; H434-C439 PolarHBondContact ND1-SG 2.79Å
435	N	63.1	Low	76.4	Confident	10 Å²	10	35.1 Å²	35.1	5%	0.053	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	178.5	165.2	82	9	0	0	0	110.5	R355 A357 P386 S437 G438	R355-N435 PolarHBondContact O-ND2 3.07Å; R355-N435 VanDerWaalsContact O-ND2 3.1Å; A357-N435 WeakPolarHBondContact CA-ND2 2.99Å; A357-N435 HydrophobicContact CB-CB 4.09Å; A357-N435 PolarHBondContact N-ND2 2.79Å; P386-N435 WeakPolarHBondContact O-CB 3.36Å; N435-S437 PolarHBondContact O-N 2.86Å; N435-S437 WeakPolarHBondContact OD1-CA 3.48Å; N435-S437 VanDerWaalsContact OD1-CB 3.31Å; N435-S437 WeakPolarHBondContact OD1-CB 3.37Å; N435-S437 PolarHBondContact OD1-N 3.11Å; N435-S437 PolarHBondContact OD1-OG 3.48Å; N435-G438 PolarHBondContact N-O 2.82Å; N435-G438 PolarHBondContact O-N 3.28Å; N435-G438 PolarHBondContact OD1-N 2.89Å
436	A	48.4	Very low	76.8	Confident	63 Å²	63	33.5 Å²	33.5	52%	0.521	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-2.8	-179.3	0	0	0	0	0	115.5	L354 M388	L354-A436 HydrophobicContact CD2-CB 4.14Å; M388-A436 HydrophobicContact SD-CB 3.93Å; M388-A436 PolarHBondContact SD-N 3.47Å; M388-A436 VanDerWaalsContact SD-N 3.41Å
437	S	48.9	Very low	76.7	Confident	44 Å²	44	37.2 Å²	37.2	31%	0.308	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118	1.6	179	-21	0	0	0	0	113.5	L354 R355 N435	L354-S437 WeakPolarHBondContact CB-OG 3.28Å; R355-S437 VanDerWaalsContact C-CB 3.44Å; R355-S437 VanDerWaalsContact C-OG 3.27Å; R355-S437 PolarHBondContact N-OG 2.81Å; R355-S437 VanDerWaalsContact O-CB 3.32Å; R355-S437 WeakPolarHBondContact O-CB 3.43Å; R355-S437 PolarHBondContact O-OG 2.97Å; N435-S437 PolarHBondContact O-N 2.86Å; N435-S437 WeakPolarHBondContact OD1-CA 3.48Å; N435-S437 VanDerWaalsContact OD1-CB 3.31Å; N435-S437 WeakPolarHBondContact OD1-CB 3.37Å; N435-S437 PolarHBondContact OD1-N 3.11Å; N435-S437 PolarHBondContact OD1-OG 3.48Å
438	G	54.9	Low	76.6	Confident	32 Å²	32	43.3 Å²	43.3	33%	0.33	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	121.3	-172.2	179.4	0	0	0	0	0	115	N435	N435-G438 PolarHBondContact N-O 2.82Å; N435-G438 PolarHBondContact O-N 3.28Å; N435-G438 PolarHBondContact OD1-N 2.89Å
439	C	61.9	Low	76	Confident	70 Å²	70	42.9 Å²	42.9	47%	0.473	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	154.2	-174.5	-39.4	0	0	0	0	112.7	A433 H434	A433-C439 CarbonylContact O-C 3.55Å; A433-C439 WeakPolarHBondContact O-CA 3.35Å; H434-C439 PolarHBondContact CE1-SG 2.85Å; H434-C439 PolarHBondContact ND1-SG 2.79Å
440	S	77.3	Confident	75.5	Confident	11 Å²	11	46.6 Å²	46.6	8%	0.077	27%	0.267	C	S	.	.			trans	-77.2	174.2	168.2	75.5	0	0	0	0	111.5	P358 A433	P358-S440 WeakPolarHBondContact O-CB 3.49Å; A433-S440 PolarHBondContact N-OG 3Å; A433-S440 PolarHBondContact O-N 3.41Å
441	Q	76.8	Confident	75	Confident	130 Å²	130	44.1 Å²	44.1	61%	0.607	26%	0.258	S	S	*	.	P	Polyproline II helix	trans	-68.4	153	159.1	-61	-177.2	-42.5	0	0	110.1	N359	N359-Q441 PolarHBondContact ND2-OE1 3.43Å; N359-Q441 WeakPolarHBondContact OD1-CB 3.39Å; N359-Q441 PolarHBondContact OD1-N 3.37Å; N359-Q441 VanDerWaalsContact OD1-N 3.07Å
442	P	81.3	Confident	74.1	Confident	52 Å²	52	49.9 Å²	49.9	34%	0.338	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-60.9	150.5	173.4	-20.1	31	0	0	0	112.6	R430 V431 L432	R430-P442 HydrophobicContact CG-CB 4.2Å; V431-P442 CarbonylContact O-C 3.58Å; V431-P442 WeakPolarHBondContact O-CA 3.41Å; L432-P442 HydrophobicContact CD1-CB 4.29Å; L432-P442 HydrophobicContact CD1-CG 4.28Å; L432-P442 HydrophobicContact CD2-CG 4.11Å; L432-P442 HydrophobicContact CG-CB 4.17Å; L432-P442 HydrophobicContact CG-CG 3.99Å
443	S	87.9	Confident	72.4	Confident	6 Å²	6	51.7 Å²	51.7	4%	0.042	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-59.9	162.8	170	74.6	0	0	0	0	111.4	R430 V431	R430-S443 WeakPolarHBondContact CA-OG 3.15Å; V431-S443 PolarHBondContact N-OG 3.13Å; V431-S443 PolarHBondContact O-N 3.27Å
444	P	88.1	Confident	70.8	Confident	60 Å²	60	56.3 Å²	56.3	39%	0.39	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-51.7	141.8	157.3	-21.6	33.4	0	0	0	110.1	A363	A363-P444 WeakPolarHBondContact CA-O 3.43Å; A363-P444 HydrophobicContact CB-CB 4.3Å; A363-P444 WeakPolarHBondContact CB-O 3.49Å
445	P	88.4	Confident	69.4	Low	57 Å²	57	61.4 Å²	61.4	37%	0.37	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-58	148.5	169.8	-27.7	37.2	0	0	0	112.4	A363 W403 F429	A363-P445 VanDerWaalsContact CB-O 3.31Å; A363-P445 WeakPolarHBondContact CB-O 3.35Å; W403-P445 HydrophobicContact CH2-CB 3.9Å; W403-P445 HydrophobicContact CH2-CG 4.02Å; W403-P445 HydrophobicContact CZ2-CB 4.13Å; W403-P445 HydrophobicContact CZ2-CG 3.81Å; F429-P445 CarbonylContact O-C 3.43Å; F429-P445 WeakPolarHBondContact O-CA 3.4Å
446	S	87.9	Confident	68	Low	3 Å²	3	68.3 Å²	68.3	2%	0.021	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-58.2	165.6	165.3	67.8	0	0	0	0	111.6	P364 F366 Q428 F429	P364-S446 WeakPolarHBondContact O-CB 3.33Å; F366-S446 WeakPolarHBondContact CZ-OG 3.32Å; Q428-S446 PolarHBondContact NE2-O 2.99Å; F429-S446 PolarHBondContact N-OG 3.14Å; F429-S446 PolarHBondContact O-N 2.78Å
447	D	79.9	Confident	67.1	Low	108 Å²	108	75.7 Å²	75.7	58%	0.578	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-60.9	162.2	154.4	-65.1	-42.9	0	0	0	109.1	F366 R995	F366-D447 VanDerWaalsContact CE2-O 3.24Å; F366-D447 WeakPolarHBondContact CE2-O 3.45Å; F366-D447 VanDerWaalsContact CZ-O 3.29Å; F366-D447 WeakPolarHBondContact CZ-O 3.46Å; D447-R995 IonicContact OD1-NH2 3Å
448	F	81.4	Confident	66.1	Low	131 Å²	131	83.4 Å²	83.4	58%	0.575	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-83.2	158.5	-179.6	71.8	-87.6	0	0	0	112.3	L397 D426 Y427 Q428	L397-F448 HydrophobicContact CD1-CB 3.9Å; L397-F448 HydrophobicContact CD1-CG 4.45Å; D426-F448 HydrophobicContact CB-CD2 3.97Å; D426-F448 WeakPolarHBondContact OD1-CD2 3.46Å; Y427-F448 VanDerWaalsContact O-CA 3.27Å; Y427-F448 WeakPolarHBondContact O-CA 3.31Å; Q428-F448 HydrophobicContact CG-CB 3.68Å
449	V	76.1	Confident	64.8	Low	18 Å²	18	87.8 Å²	87.8	11%	0.109	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	130.7	-178.2	53	0	0	0	0	110.7	F366 V369 I374 D426 Y427 F429	F366-V449 HydrophobicContact CD1-CG1 4.17Å; F366-V449 HydrophobicContact CD2-CB 4.28Å; F366-V449 HydrophobicContact CE1-CB 4.18Å; F366-V449 HydrophobicContact CE1-CG1 3.44Å; F366-V449 VanDerWaalsContact CE1-CG1 3.44Å; F366-V449 HydrophobicContact CE2-CB 3.79Å; F366-V449 HydrophobicContact CE2-CG1 3.87Å; F366-V449 HydrophobicContact CZ-CB 3.75Å; F366-V449 HydrophobicContact CZ-CG1 3.25Å; V369-V449 HydrophobicContact CG2-CG2 4.02Å; I374-V449 HydrophobicContact CD1-CB 4.28Å; I374-V449 HydrophobicContact CD1-CG1 3.43Å; I374-V449 VanDerWaalsContact CD1-CG1 3.43Å; I374-V449 HydrophobicContact CD1-CG2 3.82Å; D426-V449 CarbonylContact C-O 3.52Å; D426-V449 WeakPolarHBondContact CA-O 3.43Å; Y427-V449 PolarHBondContact N-O 2.84Å; Y427-V449 WeakPolarHBondContact O-CG1 3.34Å; Y427-V449 PolarHBondContact O-N 3.48Å; F429-V449 HydrophobicContact CE2-CG1 3.98Å
450	H	81.4	Confident	63.2	Low	78 Å²	78	90 Å²	90	36%	0.361	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	139.3	-176.7	-161.6	71.6	0	0	0	111.1	D424 H425 D426	D424-H450 PolarHBondContact O-CE1 3.01Å; D424-H450 VanDerWaalsContact O-CE1 3.22Å; H425-H450 WeakPolarHBondContact O-CA 3.49Å; D426-H450 WeakPolarHBondContact OD1-CB 3.39Å; D426-H450 IonicContact OD1-CG 3.52Å; D426-H450 IonicContact OD1-ND1 3.67Å; D426-H450 PolarHBondContact OD1-ND1 2.99Å; D426-H450 IonicContact OD2-ND1 2.74Å
451	I	77.7	Confident	60.9	Low	1 Å²	1	96.8 Å²	96.8	1%	0.005	52%	0.52	C	S	.	.			trans	-94	105	174.4	-56.6	-61.4	0	0	0	109.9	I374 L421 I422 M423 D424 H425 Y427	I374-I451 HydrophobicContact CD1-CD1 3.59Å; I374-I451 HydrophobicContact CG1-CD1 3.96Å; L421-I451 HydrophobicContact CB-CD1 4.04Å; L421-I451 HydrophobicContact CB-CG1 4.1Å; L421-I451 HydrophobicContact CD1-CD1 4.17Å; I422-I451 VanDerWaalsContact O-CB 3.29Å; I422-I451 WeakPolarHBondContact O-CB 3.32Å; I422-I451 WeakPolarHBondContact O-CG1 3.27Å; M423-I451 HydrophobicContact CB-CG2 4.46Å; M423-I451 HydrophobicContact CG-CG2 4.29Å; D424-I451 WeakPolarHBondContact CA-O 3.3Å; D424-I451 PolarHBondContact N-O 2.73Å; H425-I451 PolarHBondContact O-N 2.89Å; Y427-I451 HydrophobicContact CD2-CD1 4.46Å; Y427-I451 HydrophobicContact CD2-CG1 3.92Å; Y427-I451 HydrophobicContact CE2-CG1 3.87Å
452	E	66.3	Low	58.5	Low	123 Å²	123	97.3 Å²	97.3	58%	0.575	53%	0.533	S	S	*	.			trans	-83.9	146.1	178.6	-70.4	-176.6	179.7	0	0	113	S454	E452-S454 PolarHBondContact O-N 2.73Å
453	P	50.7	Low	56	Low	62 Å²	62	103.7 Å²	103.7	40%	0.403	56%	0.56	S	S	.	*			trans	-66.8	130.7	177.4	-24.2	35.5	0	0	0	114.7	M423 D424 T455	M423-P453 HydrophobicContact CE-CB 3.8Å; M423-P453 HydrophobicContact CE-CG 4.36Å; D424-P453 VanDerWaalsContact OD1-CD 3.3Å; D424-P453 WeakPolarHBondContact OD1-CD 3.29Å; D424-P453 WeakPolarHBondContact OD1-CG 3.32Å; P453-T455 PolarHBondContact O-N 3.25Å
454	S	42.9	Very low	53	Low	97 Å²	97	112.5 Å²	112.5	68%	0.678	60%	0.601	S	S	*	*			trans	-71	87.5	179.5	56.8	0	0	0	0	112.6	E452 N456	E452-S454 PolarHBondContact O-N 2.73Å; S454-N456 PolarHBondContact O-N 3.05Å
455	T	35.2	Very low	49.9	Very low	133 Å²	133	115.2 Å²	115.2	82%	0.816	62%	0.621	S	S	*	*			trans	-68.1	101.1	178.7	57.7	0	0	0	0	111.9	P453 R457	P453-T455 PolarHBondContact O-N 3.25Å; T455-R457 PolarHBondContact O-N 3.06Å
456	N	34.8	Very low	47	Very low	155 Å²	155	118.3 Å²	118.3	83%	0.829	64%	0.641	S	S	*	*			trans	-70	127.5	177.9	-163.8	-2.7	0	0	0	111	S454 F458	S454-N456 PolarHBondContact O-N 3.05Å; N456-F458 PolarHBondContact O-N 3.33Å
457	R	28.6	Very low	44.1	Very low	219 Å²	219	126.7 Å²	126.7	83%	0.826	68%	0.679	S	S	*	*			trans	-88.3	101.3	172.4	-73.7	-173.5	-174.3	169.9	4.2	109.4	T455	T455-R457 PolarHBondContact O-N 3.06Å
458	F	29.1	Very low	41.4	Very low	206 Å²	206	129.8 Å²	129.8	90%	0.904	70%	0.695	S	S	*	*			trans	-176.9	131.6	132.1	-92.5	-61.4	0	0	0	109.1	N456	N456-F458 PolarHBondContact O-N 3.33Å
459	S	28.1	Very low	38.7	Very low	124 Å²	124	126.7 Å²	126.7	87%	0.867	70%	0.7	S	S	*	*			trans	-141.9	122.9	167	-54.3	0	0	0	0	107.5
460	S	27.6	Very low	36.2	Very low	115 Å²	115	135.2 Å²	135.2	80%	0.804	74%	0.739	S	S	*	*			trans	-87	127	178.8	51.4	0	0	0	0	110
461	D	28.3	Very low	33.6	Very low	154 Å²	154	139.7 Å²	139.7	82%	0.824	76%	0.759	S	S	*	*			trans	-161	102.7	148.1	-123.8	-17.7	0	0	0	113
462	T	27.5	Very low	31.1	Very low	142 Å²	142	146.3 Å²	146.3	87%	0.871	80%	0.795	S	S	*	*				164.1	134.6	129.7	33.8	0	0	0	0	109.8
463	M	28	Very low	29.1	Very low	186 Å²	186	147 Å²	147	92%	0.916	81%	0.807	S	S	*	*			trans	-91.2	125.6	170.3	-64.3	-178.7	73.1	0	0	110.1
464	E	25.1	Very low	27.7	Very low	191 Å²	191	150.4 Å²	150.4	89%	0.893	83%	0.826	S	S	*	*			trans	-160.2	121.1	144	-121	173.9	-151.1	0	0	110.9
465	S	22.4	Very low	26.8	Very low	117 Å²	117	154.8 Å²	154.8	82%	0.818	83%	0.833	S	S	*	*			trans	-103.7	135.2	171.5	-67.3	0	0	0	0	109.7
466	P	28.5	Very low	26.3	Very low	121 Å²	121	158 Å²	158	79%	0.786	83%	0.832	S	S	*	*			trans	-128.7	147.1	134.9	35.7	-28.2	0	0	0	112.5
467	H	25.6	Very low	25.7	Very low	179 Å²	179	157 Å²	157	83%	0.829	83%	0.831	S	S	*	*			trans	-74.3	133.6	178.6	-48.1	-90.1	0	0	0	111.7
468	L	24.4	Very low	25.6	Very low	173 Å²	173	155.7 Å²	155.7	91%	0.906	83%	0.834	S	S	*	*				-164.2	147.2	113.4	-123.3	70.6	0	0	0	109.5
469	G	24.4	Very low	25.4	Very low	67 Å²	67	150 Å²	150	69%	0.691	83%	0.825	S	S	*	*			trans	-90.4	165.6	-165.4	0	0	0	0	0	116.2
470	H	24.1	Very low	25.4	Very low	197 Å²	197	152.6 Å²	152.6	91%	0.912	82%	0.823	S	S	*	*			trans	-141.9	166	151.6	-107	55	0	0	0	109
471	H	25.9	Very low	25.5	Very low	171 Å²	171	158.3 Å²	158.3	79%	0.792	83%	0.827	S	S	*	*			trans	-76.2	161.9	177.8	-95	-112.8	0	0	0	113.1
472	D	24.9	Very low	25.4	Very low	140 Å²	140	156.4 Å²	156.4	75%	0.749	81%	0.812	S	S	*	*			trans	76.8	153.9	159.1	-54.1	-31.2	0	0	0	120.8
473	V	24.1	Very low	25.5	Very low	138 Å²	138	153.1 Å²	153.1	84%	0.836	81%	0.806	S	S	*	*			trans	64.3	101.7	173.2	-160.9	0	0	0	0	114.3
474	V	22.7	Very low	25.4	Very low	133 Å²	133	148.5 Å²	148.5	81%	0.806	80%	0.797	S	S	*	*				-149.1	127.3	72.1	172.5	0	0	0	0	112.5
475	K	24.1	Very low	25.4	Very low	189 Å²	189	143.1 Å²	143.1	82%	0.822	78%	0.777	S	S	*	*			trans	-145.9	173.5	146.4	-87.6	-165.5	176.8	-177.2	0	107.4
476	Y	23	Very low	25.6	Very low	202 Å²	202	142.7 Å²	142.7	79%	0.792	77%	0.772	S	S	*	*			trans	74.5	102.9	-172.4	-59	-81.4	0	0	0	116.3
477	V	23.8	Very low	25.5	Very low	134 Å²	134	143 Å²	143	81%	0.812	77%	0.766	S	S	*	*	S	Bend		-136	164.5	113.1	-162.8	0	0	0	0	106.6
478	E	25.1	Very low	25.6	Very low	191 Å²	191	142.7 Å²	142.7	89%	0.893	77%	0.77	S	S	*	*	S	Bend	trans	70	46	167.6	-49.6	-153.7	151.6	0	0	118.3
479	A	25	Very low	26	Very low	85 Å²	85	143.2 Å²	143.2	70%	0.702	77%	0.767	S	S	*	*			trans	-126.2	11.2	163.2	0	0	0	0	0	114.3
480	E	29.6	Very low	26.2	Very low	179 Å²	179	148.6 Å²	148.6	84%	0.836	78%	0.775	S	S	*	*			trans	-114.8	100.7	-175	-67.9	-173.8	162.3	0	0	112.4
481	R	28.1	Very low	26.3	Very low	235 Å²	235	148 Å²	148	89%	0.887	77%	0.772	S	S	*	*	S	Bend	trans	-157.9	-12.4	161.1	-119	175.9	-165.4	-167	5.6	116
482	F	27.6	Very low	26.3	Very low	115 Å²	115	148.3 Å²	148.3	50%	0.504	78%	0.776	S	S	.	*	S	Bend	trans	-135.2	120.9	175.6	-65.6	-87.4	0	0	0	109	A484 D639	F482-A484 PolarHBondContact O-N 3.49Å; F482-A484 VanDerWaalsContact O-N 3.08Å; F482-D639 WeakPolarHBondContact CE1-OD2 3.37Å
483	G	29.2	Very low	26.4	Very low	72 Å²	72	147.4 Å²	147.4	74%	0.742	78%	0.776	S	S	*	*			trans	-71.1	101.3	-167	0	0	0	0	0	114
484	A	25	Very low	26.7	Very low	89 Å²	89	151.6 Å²	151.6	74%	0.736	78%	0.777	S	S	*	*			trans	-109.5	93.7	163.6	0	0	0	0	0	108.7	F482 P486	F482-A484 PolarHBondContact O-N 3.49Å; F482-A484 VanDerWaalsContact O-N 3.08Å; A484-P486 WeakPolarHBondContact O-CD 3.45Å
485	V	26	Very low	27.1	Very low	78 Å²	78	154 Å²	154	47%	0.473	78%	0.779	S	S	.	*			trans	-71.4	121.3	178.5	179.2	0	0	0	0	109.4	L487	V485-L487 PolarHBondContact O-N 2.89Å
486	P	25.9	Very low	27.3	Very low	108 Å²	108	150.1 Å²	150.1	70%	0.701	78%	0.775	S	S	*	*			trans	-64.9	127.8	170.1	-17	31.5	0	0	0	109.5	A484 L488	A484-P486 WeakPolarHBondContact O-CD 3.45Å; P486-L488 PolarHBondContact O-N 2.82Å
487	L	27.1	Very low	27.7	Very low	127 Å²	127	145.9 Å²	145.9	67%	0.665	77%	0.773	S	S	*	*			trans	-71.6	102.8	174.1	-72.3	172.8	0	0	0	109.3	V485 Q489	V485-L487 PolarHBondContact O-N 2.89Å; L487-Q489 PolarHBondContact O-N 2.85Å; L487-Q489 VanDerWaalsContact O-N 3.15Å
488	L	27.1	Very low	28	Very low	174 Å²	174	145.7 Å²	145.7	91%	0.911	77%	0.774	S	S	*	*			trans	-54.9	118.5	170.6	-76.5	168.7	0	0	0	110	P486	P486-L488 PolarHBondContact O-N 2.82Å
489	Q	32.8	Very low	28.3	Very low	183 Å²	183	143.7 Å²	143.7	86%	0.855	77%	0.769	S	S	*	*			trans	-82.5	125.8	161.3	-61	173.3	-94.5	0	0	107.4	L487	L487-Q489 PolarHBondContact O-N 2.85Å; L487-Q489 VanDerWaalsContact O-N 3.15Å
490	E	28.3	Very low	28.9	Very low	181 Å²	181	145 Å²	145	85%	0.846	77%	0.77	S	S	*	*				-175.6	136.1	128.6	-105.2	170.5	-167.4	0	0	113
491	E	27.1	Very low	29.4	Very low	184 Å²	184	145.8 Å²	145.8	86%	0.86	77%	0.774	S	S	*	*			trans	141.6	86.2	139.7	-78.5	-138.3	131.6	0	0	112.4
492	M	25.8	Very low	29.9	Very low	177 Å²	177	145.1 Å²	145.1	87%	0.872	77%	0.772	S	S	*	*			trans	-155.2	47	145.5	-113.2	-162.3	76.1	0	0	110.8	R494	M492-R494 PolarHBondContact O-N 2.83Å; M492-R494 VanDerWaalsContact O-N 3.1Å
493	V	27.7	Very low	30.6	Very low	122 Å²	122	145.6 Å²	145.6	74%	0.739	78%	0.779	S	S	*	*			trans	-69.6	108.3	175.3	-178.1	0	0	0	0	109.3	E495	V493-E495 HydrophobicContact CG1-CG 4.05Å
494	R	28.9	Very low	31	Very low	226 Å²	226	150 Å²	150	85%	0.853	79%	0.785	S	S	*	*			trans	-109.7	107.7	152.3	-79.3	-171.7	173	-173.1	-1.5	107.2	M492	M492-R494 PolarHBondContact O-N 2.83Å; M492-R494 VanDerWaalsContact O-N 3.1Å
495	E	31.8	Very low	31.5	Very low	183 Å²	183	149.4 Å²	149.4	86%	0.855	78%	0.776	S	S	*	*			trans	-55.2	142.6	178.7	-61.2	-177.2	135	0	0	110.9	V493	V493-E495 HydrophobicContact CG1-CG 4.05Å
496	S	28	Very low	32.1	Very low	107 Å²	107	151.2 Å²	151.2	75%	0.748	79%	0.79	S	S	*	*			trans	-134.6	141.8	165	-70.3	0	0	0	0	106.7
497	P	31.5	Very low	32.5	Very low	113 Å²	113	151.4 Å²	151.4	73%	0.734	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-63.2	152.5	-170.5	26.3	-35.4	0	0	0	111.6	L499	P497-L499 PolarHBondContact O-N 3.43Å
498	P	30.7	Very low	32.9	Very low	131 Å²	131	151.6 Å²	151.6	85%	0.851	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-59.1	123.7	179.7	25	-34.1	0	0	0	110.3
499	L	30.3	Very low	33.4	Very low	148 Å²	148	150.2 Å²	150.2	78%	0.775	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-73.4	146.3	167.6	-70.6	172.4	0	0	0	109	P497	P497-L499 PolarHBondContact O-N 3.43Å
500	P	37.8	Very low	33.6	Very low	112 Å²	112	153.2 Å²	153.2	73%	0.727	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-65.5	163.2	177.8	29.5	-36	0	0	0	111.7	R502	P500-R502 PolarHBondContact O-N 2.77Å
501	E	40.8	Very low	34.4	Very low	197 Å²	197	156.6 Å²	156.6	92%	0.921	80%	0.801	S	S	*	*			trans	-46	131.2	176.7	-62.4	173.1	153.5	0	0	111.4
502	R	39.4	Very low	34.8	Very low	221 Å²	221	152.4 Å²	152.4	83%	0.834	80%	0.798	S	S	*	*			trans	-85.4	117.2	178.7	-83.3	-172.2	169.7	-174.1	-2.4	110.5	P500 D504	P500-R502 PolarHBondContact O-N 2.77Å; R502-D504 PolarHBondContact O-N 2.82Å
503	D	40.3	Very low	35.6	Very low	125 Å²	125	151.2 Å²	151.2	67%	0.668	80%	0.795	S	S	*	*			trans	-49.5	124.7	153.2	174.4	7.7	0	0	0	110.1	S505	D503-S505 PolarHBondContact O-N 2.89Å; D503-S505 WeakPolarHBondContact OD1-CB 3.24Å; D503-S505 PolarHBondContact OD1-N 2.79Å; D503-S505 PolarHBondContact OD1-OG 2.82Å; D503-S505 PolarHBondContact OD2-OG 3.39Å
504	D	39.4	Very low	36.4	Very low	163 Å²	163	151.9 Å²	151.9	87%	0.872	79%	0.794	S	S	*	*			trans	-72.3	3.4	179.1	-77.8	-48.7	0	0	0	113.5	R502 P506	R502-D504 PolarHBondContact O-N 2.82Å; D504-P506 WeakPolarHBondContact O-CD 3.39Å
505	S	35.6	Very low	37.5	Very low	77 Å²	77	149.3 Å²	149.3	54%	0.538	80%	0.798	S	S	.	*	P	Polyproline II helix	trans	-66.8	120.1	175.7	-61.7	0	0	0	0	112.4	D503	D503-S505 PolarHBondContact O-N 2.89Å; D503-S505 WeakPolarHBondContact OD1-CB 3.24Å; D503-S505 PolarHBondContact OD1-N 2.79Å; D503-S505 PolarHBondContact OD1-OG 2.82Å; D503-S505 PolarHBondContact OD2-OG 3.39Å
506	P	37.2	Very low	38.7	Very low	117 Å²	117	145.8 Å²	145.8	76%	0.76	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-67.8	140.9	-180	26.6	-34.1	0	0	0	112.1	D504	D504-P506 WeakPolarHBondContact O-CD 3.39Å
507	P	33.9	Very low	40.5	Very low	112 Å²	112	149.5 Å²	149.5	73%	0.727	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-69.5	147	-172.7	27.5	-35.3	0	0	0	113	L509	P507-L509 PolarHBondContact O-N 3.1Å
508	P	37	Very low	42.3	Very low	130 Å²	130	154.7 Å²	154.7	84%	0.844	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-68.7	121.6	-173	26.5	-34.6	0	0	0	112.8	R510	P508-R510 PolarHBondContact O-N 2.63Å
509	L	37.5	Very low	44.8	Very low	146 Å²	146	155.4 Å²	155.4	76%	0.764	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-61.6	122.7	-179.1	-65.5	169.4	0	0	0	112.5	P507 R511	P507-L509 PolarHBondContact O-N 3.1Å; L509-R511 PolarHBondContact O-N 2.7Å
510	R	36.9	Very low	47.2	Very low	246 Å²	246	154.3 Å²	154.3	93%	0.928	78%	0.78	S	S	*	*			trans	-68.6	114.9	162.5	-85.4	-170.9	171.1	-169	-1.5	109.3	P508 A512	P508-R510 PolarHBondContact O-N 2.63Å; R510-A512 PolarHBondContact O-N 2.78Å
511	R	45.4	Very low	49.5	Very low	251 Å²	251	150.6 Å²	150.6	95%	0.947	76%	0.755	S	S	*	*			trans	-62.3	123	179.6	-68.8	178.7	174.7	173.6	-2.6	112.2	L509	L509-R511 PolarHBondContact O-N 2.7Å
512	A	35	Very low	51.9	Low	96 Å²	96	144.1 Å²	144.1	79%	0.793	73%	0.732	S	S	*	*			trans	-134.9	156.7	151.3	0	0	0	0	0	107.6	R510	R510-A512 PolarHBondContact O-N 2.78Å
513	N	43.1	Very low	54.5	Low	152 Å²	152	134.6 Å²	134.6	81%	0.813	70%	0.698	S	S	*	*	S	Bend	trans	-70.5	156.5	-162.7	-78.2	-8.9	0	0	0	115.5
514	N	43.3	Very low	57	Low	136 Å²	136	133.8 Å²	133.8	73%	0.727	69%	0.688	S	S	*	*	S	Bend	trans	92.2	97.5	162.2	-54.1	-20	0	0	0	118.1	V516	N514-V516 VanDerWaalsContact C-N 3.26Å; N514-V516 PolarHBondContact O-N 2.76Å
515	N	53	Low	59.5	Low	173 Å²	173	128.2 Å²	128.2	93%	0.925	66%	0.657	S	S	*	*			trans	40.1	5	141	-73.7	16.6	0	0	0	123.3	Q517	N515-Q517 PolarHBondContact O-N 2.91Å
516	V	56.1	Low	62.4	Low	109 Å²	109	124.6 Å²	124.6	66%	0.661	63%	0.632	S	S	*	*			trans	-75.1	109.8	174.8	179	0	0	0	0	109.7	N514 W518	N514-V516 VanDerWaalsContact C-N 3.26Å; N514-V516 PolarHBondContact O-N 2.76Å; V516-W518 HydrophobicContact CG1-CZ2 4.48Å
517	Q	65.3	Low	65.2	Low	184 Å²	184	119.2 Å²	119.2	86%	0.86	60%	0.596	S	S	*	*			trans	-85.8	127.8	165.8	-71.4	-177.6	-22.7	0	0	109.4	N515	N515-Q517 PolarHBondContact O-N 2.91Å
518	W	69.7	Low	68.1	Low	222 Å²	222	119.6 Å²	119.6	84%	0.841	59%	0.588	S	S	*	*			trans	-83	117.8	169.2	-60.6	99.7	0	0	0	108.9	V516	V516-W518 HydrophobicContact CG1-CZ2 4.48Å
519	R	83.3	Confident	71	Confident	146 Å²	146	117.3 Å²	117.3	55%	0.551	56%	0.563	S	S	*	*			trans	-137.4	153.4	164.8	72.2	170.3	-178.8	106.3	-6.6	108.5	E525	R519-E525 IonicContact CZ-OE1 3.37Å; R519-E525 IonicContact CZ-OE2 3.76Å; R519-E525 IonicContact NH1-OE1 3.2Å; R519-E525 PolarHBondContact NH1-OE1 3.27Å; R519-E525 IonicContact NH1-OE2 2.86Å; R519-E525 PolarHBondContact NH1-OE2 3.24Å; R519-E525 IonicContact NH2-OE1 2.66Å; R519-E525 PolarHBondContact NH2-OE1 3.41Å; R519-E525 IonicContact NH2-OE2 3.72Å
520	D	80.3	Confident	73.8	Confident	125 Å²	125	110.5 Å²	110.5	67%	0.668	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-73.8	130.6	164.2	-65.9	-70.8	0	0	0	109.9	Y544	D520-Y544 PolarHBondContact OD1-OH 3.25Å
521	P	86.4	Confident	76.5	Confident	34 Å²	34	102.3 Å²	102.3	22%	0.221	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-77.5	142.8	170	32	-33.1	0	0	0	110.3	E525 V526 Y529 Y544	P521-E525 HydrophobicContact CB-CB 4.24Å; P521-V526 HydrophobicContact CB-CG2 3.92Å; P521-V526 HydrophobicContact CG-CG2 3.57Å; P521-Y529 HydrophobicContact CB-CE2 4.29Å; P521-Y544 HydrophobicContact CG-CD1 4.27Å; P521-Y544 HydrophobicContact CG-CE1 3.8Å
522	S	92.1	Very high	78.9	Confident	62 Å²	62	91.9 Å²	91.9	43%	0.434	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-66.4	154.6	171.5	63	0	0	0	0	111.2	K524 E525 V526	S522-K524 PolarHBondContact O-N 3.21Å; S522-K524 VanDerWaalsContact O-N 3.11Å; S522-E525 WeakPolarHBondContact CB-OE2 3.2Å; S522-E525 PolarHBondContact N-OE2 2.99Å; S522-E525 WeakPolarHBondContact O-CB 3.37Å; S522-E525 PolarHBondContact O-N 3.06Å; S522-E525 VanDerWaalsContact OG-CG 3.29Å; S522-E525 WeakPolarHBondContact OG-CG 3.47Å; S522-E525 PolarHBondContact OG-OE2 3.03Å; S522-V526 WeakPolarHBondContact O-CG2 3.38Å; S522-V526 PolarHBondContact O-N 2.7Å
523	L	92.8	Very high	81.6	Confident	20 Å²	20	92.4 Å²	92.4	11%	0.105	48%	0.478	C	S	.	.	H	α-helix	trans	-53.8	-36.3	-177.4	-177.7	57.3	0	0	0	112.9	V526 I527 L545 L548 I555 E558 Y562	L523-V526 PolarHBondContact O-N 3.29Å; L523-I527 HydrophobicContact CD1-CD1 4Å; L523-I527 HydrophobicContact CD1-CG1 4.41Å; L523-I527 HydrophobicContact CG-CD1 3.95Å; L523-I527 WeakPolarHBondContact O-CB 3.38Å; L523-I527 VanDerWaalsContact O-CG1 3.28Å; L523-I527 WeakPolarHBondContact O-CG1 3.39Å; L523-I527 PolarHBondContact O-N 2.74Å; L523-L545 HydrophobicContact CD1-CD1 3.4Å; L523-L548 HydrophobicContact CD1-CD1 4.32Å; L523-I555 HydrophobicContact CD2-CD1 4.03Å; L523-I555 HydrophobicContact CD2-CG2 4.35Å; L523-E558 HydrophobicContact CD2-CB 3.55Å; L523-Y562 HydrophobicContact CB-CE2 4.46Å; L523-Y562 HydrophobicContact CD2-CD2 4.19Å; L523-Y562 HydrophobicContact CD2-CE2 4.04Å; L523-Y562 HydrophobicContact CG-CD2 4.15Å; L523-Y562 HydrophobicContact CG-CE2 4.29Å
524	K	93.8	Very high	84.1	Confident	108 Å²	108	87.9 Å²	87.9	47%	0.47	45%	0.454	S	S	.	.	H	α-helix	trans	-62.5	-46.6	174.6	-66.9	-179.9	-179.1	176.9	0	112.2	S522 V526 I527 E528 Y562	S522-K524 PolarHBondContact O-N 3.21Å; S522-K524 VanDerWaalsContact O-N 3.11Å; K524-V526 PolarHBondContact O-N 2.9Å; K524-I527 PolarHBondContact O-N 3Å; K524-E528 WeakPolarHBondContact O-CG 3.46Å; K524-E528 PolarHBondContact O-N 3.21Å; K524-Y562 HydrophobicContact CD-CD2 4.5Å; K524-Y562 HydrophobicContact CD-CE1 4.43Å; K524-Y562 HydrophobicContact CD-CE2 4.4Å; K524-Y562 HydrophobicContact CG-CD1 4.34Å; K524-Y562 HydrophobicContact CG-CD2 3.61Å; K524-Y562 HydrophobicContact CG-CE2 3.79Å; K524-Y562 HydrophobicContact CG-CG 3.91Å
525	E	92.8	Very high	86.4	Confident	47 Å²	47	85.2 Å²	85.2	22%	0.22	44%	0.436	C	S	.	.	H	α-helix	trans	-64.1	-39.3	177.3	-65.3	170.7	112	0	0	111.8	R519 P521 S522 I527 E528 Y529	R519-E525 IonicContact CZ-OE1 3.37Å; R519-E525 IonicContact CZ-OE2 3.76Å; R519-E525 IonicContact NH1-OE1 3.2Å; R519-E525 PolarHBondContact NH1-OE1 3.27Å; R519-E525 IonicContact NH1-OE2 2.86Å; R519-E525 PolarHBondContact NH1-OE2 3.24Å; R519-E525 IonicContact NH2-OE1 2.66Å; R519-E525 PolarHBondContact NH2-OE1 3.41Å; R519-E525 IonicContact NH2-OE2 3.72Å; P521-E525 HydrophobicContact CB-CB 4.24Å; S522-E525 WeakPolarHBondContact CB-OE2 3.2Å; S522-E525 PolarHBondContact N-OE2 2.99Å; S522-E525 WeakPolarHBondContact O-CB 3.37Å; S522-E525 PolarHBondContact O-N 3.06Å; S522-E525 VanDerWaalsContact OG-CG 3.29Å; S522-E525 WeakPolarHBondContact OG-CG 3.47Å; S522-E525 PolarHBondContact OG-OE2 3.03Å; E525-I527 VanDerWaalsContact C-N 3.33Å; E525-I527 PolarHBondContact O-N 2.89Å; E525-E528 PolarHBondContact O-N 3.31Å; E525-Y529 HydrophobicContact CB-CE1 4.49Å; E525-Y529 HydrophobicContact CB-CE2 4.43Å; E525-Y529 WeakPolarHBondContact O-CD1 3.22Å; E525-Y529 WeakPolarHBondContact O-CD2 3.42Å; E525-Y529 PolarHBondContact O-N 3.29Å
526	V	95.2	Very high	88.3	Confident	1 Å²	1	82.1 Å²	82.1	1%	0.006	42%	0.419	C	S	.	.	H	α-helix	trans	-59.6	-45.3	173.8	179.3	0	0	0	0	110.8	P521 S522 L523 K524 Y529 L530 A541 Y544 L545	P521-V526 HydrophobicContact CB-CG2 3.92Å; P521-V526 HydrophobicContact CG-CG2 3.57Å; S522-V526 WeakPolarHBondContact O-CG2 3.38Å; S522-V526 PolarHBondContact O-N 2.7Å; L523-V526 PolarHBondContact O-N 3.29Å; K524-V526 PolarHBondContact O-N 2.9Å; V526-Y529 PolarHBondContact O-N 3.35Å; V526-L530 PolarHBondContact O-N 3.41Å; V526-A541 HydrophobicContact CG1-CB 4.36Å; V526-A541 WeakPolarHBondContact CG1-O 3.22Å; V526-Y544 HydrophobicContact CG1-CD1 4.15Å; V526-Y544 HydrophobicContact CG2-CD1 3.6Å; V526-Y544 HydrophobicContact CG2-CE1 3.79Å; V526-L545 HydrophobicContact CG1-CB 3.88Å; V526-L545 HydrophobicContact CG1-CD1 4.36Å
527	I	96.6	Very high	90.1	Very high	3 Å²	3	81.8 Å²	81.8	2%	0.015	41%	0.409	C	S	.	.	H	α-helix	trans	-68.6	-34.4	178.9	-71.6	168.8	0	0	0	111.7	L523 K524 E525 L530 L545 T559 Y562 K567	L523-I527 HydrophobicContact CD1-CD1 4Å; L523-I527 HydrophobicContact CD1-CG1 4.41Å; L523-I527 HydrophobicContact CG-CD1 3.95Å; L523-I527 WeakPolarHBondContact O-CB 3.38Å; L523-I527 VanDerWaalsContact O-CG1 3.28Å; L523-I527 WeakPolarHBondContact O-CG1 3.39Å; L523-I527 PolarHBondContact O-N 2.74Å; K524-I527 PolarHBondContact O-N 3Å; E525-I527 VanDerWaalsContact C-N 3.33Å; E525-I527 PolarHBondContact O-N 2.89Å; I527-L530 WeakPolarHBondContact O-CB 3.19Å; I527-L530 PolarHBondContact O-N 2.67Å; I527-L545 HydrophobicContact CG1-CD2 4.12Å; I527-T559 HydrophobicContact CD1-CG2 4.18Å; I527-Y562 HydrophobicContact CD1-CD2 4.21Å; I527-K567 HydrophobicContact CG2-CD 3.56Å; I527-K567 WeakPolarHBondContact O-CD 3.35Å
528	E	95.4	Very high	91.5	Very high	120 Å²	120	74.2 Å²	74.2	56%	0.561	37%	0.374	S	S	*	.	H	α-helix	trans	-64.1	-42.5	169.9	-74.8	174.9	-170.7	0	0	112	K524 E525 L530 S531	K524-E528 WeakPolarHBondContact O-CG 3.46Å; K524-E528 PolarHBondContact O-N 3.21Å; E525-E528 PolarHBondContact O-N 3.31Å; E528-L530 PolarHBondContact O-N 3.45Å; E528-S531 WeakPolarHBondContact O-CB 3.25Å; E528-S531 PolarHBondContact O-N 3.21Å
529	Y	96.3	Very high	92.6	Very high	82 Å²	82	64.4 Å²	64.4	32%	0.322	34%	0.338	S	S	.	.	H	α-helix	trans	-64.8	-22.4	180	-61.9	-13.2	0	0	0	113.7	P521 E525 V526 S531 S532	P521-Y529 HydrophobicContact CB-CE2 4.29Å; E525-Y529 HydrophobicContact CB-CE1 4.49Å; E525-Y529 HydrophobicContact CB-CE2 4.43Å; E525-Y529 WeakPolarHBondContact O-CD1 3.22Å; E525-Y529 WeakPolarHBondContact O-CD2 3.42Å; E525-Y529 PolarHBondContact O-N 3.29Å; V526-Y529 PolarHBondContact O-N 3.35Å; Y529-S531 PolarHBondContact O-N 2.96Å; Y529-S532 VanDerWaalsContact O-CB 3.23Å; Y529-S532 WeakPolarHBondContact O-CB 3.13Å; Y529-S532 PolarHBondContact O-N 2.77Å; Y529-S532 VanDerWaalsContact O-N 3.09Å
530	L	96.4	Very high	93.1	Very high	3 Å²	3	62.8 Å²	62.8	2%	0.016	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-31.4	168.2	-56.9	178.9	0	0	0	112.2	V526 I527 E528 S532 Q538 A541 L545 K567 L568 L571	V526-L530 PolarHBondContact O-N 3.41Å; I527-L530 WeakPolarHBondContact O-CB 3.19Å; I527-L530 PolarHBondContact O-N 2.67Å; E528-L530 PolarHBondContact O-N 3.45Å; L530-S532 VanDerWaalsContact C-N 3.35Å; L530-Q538 PolarHBondContact O-NE2 3.35Å; L530-A541 HydrophobicContact CD2-CB 4.08Å; L530-L545 HydrophobicContact CD1-CD2 3.87Å; L530-K567 HydrophobicContact CB-CB 4.16Å; L530-K567 HydrophobicContact CD1-CB 3.97Å; L530-L568 HydrophobicContact CD1-CD2 3.98Å; L530-L568 HydrophobicContact CD1-CG 3.98Å; L530-L568 HydrophobicContact CD2-CD2 4.28Å; L530-L571 HydrophobicContact CB-CD1 4.12Å; L530-L571 HydrophobicContact CD2-CD1 3.87Å; L530-L571 HydrophobicContact CG-CD1 4.5Å
531	S	95.3	Very high	93.7	Very high	74 Å²	74	57.1 Å²	57.1	52%	0.517	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	8.5	178.8	-55.3	0	0	0	0	113.5	E528 Y529 K567	E528-S531 WeakPolarHBondContact O-CB 3.25Å; E528-S531 PolarHBondContact O-N 3.21Å; Y529-S531 PolarHBondContact O-N 2.96Å; S531-K567 PolarHBondContact OG-NZ 2.78Å
532	S	94.6	Very high	94.2	Very high	33 Å²	33	55.5 Å²	55.5	23%	0.231	30%	0.3	C	S	.	.			trans	-68.7	143.7	179	-159.3	0	0	0	0	112.2	Y529 L530 D534 Q538	Y529-S532 VanDerWaalsContact O-CB 3.23Å; Y529-S532 WeakPolarHBondContact O-CB 3.13Å; Y529-S532 PolarHBondContact O-N 2.77Å; Y529-S532 VanDerWaalsContact O-N 3.09Å; L530-S532 VanDerWaalsContact C-N 3.35Å; S532-D534 PolarHBondContact O-N 3.25Å; S532-D534 PolarHBondContact OG-N 3.06Å; S532-Q538 WeakPolarHBondContact O-CG 3.41Å; S532-Q538 PolarHBondContact O-NE2 3.39Å; S532-Q538 VanDerWaalsContact O-NE2 3.09Å
533	A	92.3	Very high	94.1	Very high	106 Å²	106	53.7 Å²	53.7	88%	0.876	29%	0.291	S	S	*	.	S	Bend	trans	-70.2	-14.2	168.5	0	0	0	0	0	112.8
534	D	94.9	Very high	94.2	Very high	57 Å²	57	56 Å²	56	31%	0.305	30%	0.299	S	S	.	.			trans	-84	109.5	177.6	179.5	-28	0	0	0	110.1	S532 D536 K537 Q538	S532-D534 PolarHBondContact O-N 3.25Å; S532-D534 PolarHBondContact OG-N 3.06Å; D534-D536 VanDerWaalsContact C-N 3.29Å; D534-D536 PolarHBondContact O-N 3.49Å; D534-D536 PolarHBondContact OD1-N 3.07Å; D534-K537 HydrophobicContact CB-CB 4.02Å; D534-K537 HydrophobicContact CB-CD 4.04Å; D534-K537 HydrophobicContact CB-CG 4.01Å; D534-K537 WeakPolarHBondContact O-CB 3.22Å; D534-K537 PolarHBondContact O-N 3.36Å; D534-K537 VanDerWaalsContact O-N 3.15Å; D534-K537 PolarHBondContact OD1-N 2.74Å; D534-K537 WeakPolarHBondContact OD2-CG 3.39Å; D534-K537 IonicContact OD2-NZ 2.67Å; D534-K537 PolarHBondContact OD2-NZ 3.32Å; D534-Q538 WeakPolarHBondContact O-CG 3.17Å; D534-Q538 PolarHBondContact O-N 2.74Å
535	K	93	Very high	94.3	Very high	80 Å²	80	50.9 Å²	50.9	35%	0.348	28%	0.277	S	S	.	.	H	α-helix	trans	-61.5	-32.8	-177.3	-71.1	-83.7	174.2	159.6	0	113.1	Q538 L539 S574 D575 I579	K535-Q538 PolarHBondContact O-N 3.18Å; K535-L539 VanDerWaalsContact O-CB 3.25Å; K535-L539 WeakPolarHBondContact O-CB 3.27Å; K535-L539 PolarHBondContact O-N 2.91Å; K535-S574 PolarHBondContact NZ-OG 3.35Å; K535-D575 IonicContact NZ-OD1 2.67Å; K535-D575 PolarHBondContact NZ-OD1 2.89Å; K535-D575 IonicContact NZ-OD2 3.75Å; K535-I579 HydrophobicContact CB-CD1 4.38Å; K535-I579 HydrophobicContact CD-CD1 3.77Å
536	D	92.8	Very high	94.4	Very high	108 Å²	108	51 Å²	51	58%	0.578	28%	0.278	S	S	*	.	H	α-helix	trans	-74.2	-35	177.1	-75.6	-45.4	0	0	0	110.8	D534 L539 N540	D534-D536 VanDerWaalsContact C-N 3.29Å; D534-D536 PolarHBondContact O-N 3.49Å; D534-D536 PolarHBondContact OD1-N 3.07Å; D536-L539 PolarHBondContact O-N 3Å; D536-N540 WeakPolarHBondContact O-CB 3.32Å; D536-N540 PolarHBondContact O-N 2.93Å; D536-N540 PolarHBondContact O-ND2 3.01Å
537	K	92	Very high	94.2	Very high	103 Å²	103	57.5 Å²	57.5	45%	0.448	31%	0.307	S	S	.	.	H	α-helix	trans	-64	-45.6	168.8	-69.6	-174.5	-174.3	96.7	0	111.8	D534 L539 N540 A541	D534-K537 HydrophobicContact CB-CB 4.02Å; D534-K537 HydrophobicContact CB-CD 4.04Å; D534-K537 HydrophobicContact CB-CG 4.01Å; D534-K537 WeakPolarHBondContact O-CB 3.22Å; D534-K537 PolarHBondContact O-N 3.36Å; D534-K537 VanDerWaalsContact O-N 3.15Å; D534-K537 PolarHBondContact OD1-N 2.74Å; D534-K537 WeakPolarHBondContact OD2-CG 3.39Å; D534-K537 IonicContact OD2-NZ 2.67Å; D534-K537 PolarHBondContact OD2-NZ 3.32Å; K537-L539 VanDerWaalsContact C-N 3.33Å; K537-L539 PolarHBondContact O-N 3.11Å; K537-N540 PolarHBondContact O-N 2.81Å; K537-A541 WeakPolarHBondContact O-CB 3.47Å; K537-A541 PolarHBondContact O-N 2.76Å
538	Q	94.9	Very high	94	Very high	25 Å²	25	59.6 Å²	59.6	12%	0.117	32%	0.318	C	S	.	.	H	α-helix	trans	-59.2	-43	175.7	-67.8	-173.2	-51.1	0	0	112.2	L530 S532 D534 K535 S542 L571 I579	L530-Q538 PolarHBondContact O-NE2 3.35Å; S532-Q538 WeakPolarHBondContact O-CG 3.41Å; S532-Q538 PolarHBondContact O-NE2 3.39Å; S532-Q538 VanDerWaalsContact O-NE2 3.09Å; D534-Q538 WeakPolarHBondContact O-CG 3.17Å; D534-Q538 PolarHBondContact O-N 2.74Å; K535-Q538 PolarHBondContact O-N 3.18Å; Q538-S542 VanDerWaalsContact O-CB 3.3Å; Q538-S542 WeakPolarHBondContact O-CB 3.43Å; Q538-S542 PolarHBondContact O-N 3.46Å; Q538-S542 PolarHBondContact O-OG 3.11Å; Q538-L571 HydrophobicContact CB-CD2 4.38Å; Q538-L571 HydrophobicContact CG-CD2 4.35Å; Q538-L571 VanDerWaalsContact NE2-CD2 3.27Å; Q538-I579 HydrophobicContact CB-CD1 4.07Å
539	L	93.8	Very high	93.8	Very high	16 Å²	16	53.9 Å²	53.9	8%	0.084	29%	0.292	C	S	.	.	H	α-helix	trans	-64.2	-47.5	179.2	177.7	61.8	0	0	0	112.2	K535 D536 K537 S542 G543 R578 I579 N582	K535-L539 VanDerWaalsContact O-CB 3.25Å; K535-L539 WeakPolarHBondContact O-CB 3.27Å; K535-L539 PolarHBondContact O-N 2.91Å; D536-L539 PolarHBondContact O-N 3Å; K537-L539 VanDerWaalsContact C-N 3.33Å; K537-L539 PolarHBondContact O-N 3.11Å; L539-S542 PolarHBondContact O-OG 3.3Å; L539-S542 VanDerWaalsContact O-OG 3.08Å; L539-G543 PolarHBondContact O-N 3.42Å; L539-G543 VanDerWaalsContact O-N 3.13Å; L539-R578 HydrophobicContact CD1-CB 3.55Å; L539-I579 HydrophobicContact CB-CD1 4.36Å; L539-I579 HydrophobicContact CB-CG1 3.96Å; L539-I579 HydrophobicContact CD1-CG1 4.03Å; L539-N582 PolarHBondContact O-ND2 3.45Å
540	N	93.5	Very high	93.5	Very high	111 Å²	111	57.3 Å²	57.3	59%	0.594	31%	0.305	S	S	*	.	H	α-helix	trans	-70.2	-41.6	179.5	-71.8	-60.2	0	0	0	111.8	D536 K537 G543 Y544	D536-N540 WeakPolarHBondContact O-CB 3.32Å; D536-N540 PolarHBondContact O-N 2.93Å; D536-N540 PolarHBondContact O-ND2 3.01Å; K537-N540 PolarHBondContact O-N 2.81Å; N540-G543 PolarHBondContact O-N 2.94Å; N540-Y544 WeakPolarHBondContact O-CB 3.34Å; N540-Y544 PolarHBondContact O-N 2.75Å
541	A	93.8	Very high	92.9	Very high	6 Å²	6	62.6 Å²	62.6	5%	0.05	34%	0.338	C	S	.	.	H	α-helix	trans	-64	-44.6	178.1	0	0	0	0	0	112.6	V526 L530 K537 G543 Y544 L545	V526-A541 HydrophobicContact CG1-CB 4.36Å; V526-A541 WeakPolarHBondContact CG1-O 3.22Å; L530-A541 HydrophobicContact CD2-CB 4.08Å; K537-A541 WeakPolarHBondContact O-CB 3.47Å; K537-A541 PolarHBondContact O-N 2.76Å; A541-G543 VanDerWaalsContact C-N 3.35Å; A541-G543 PolarHBondContact O-N 3.38Å; A541-Y544 PolarHBondContact O-N 2.93Å; A541-L545 WeakPolarHBondContact O-CB 3.35Å; A541-L545 PolarHBondContact O-N 3.05Å
542	S	95.1	Very high	92.6	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-65.4	-36.1	176	55.6	0	0	0	0	112.7	Q538 L539 Q546 N582	Q538-S542 VanDerWaalsContact O-CB 3.3Å; Q538-S542 WeakPolarHBondContact O-CB 3.43Å; Q538-S542 PolarHBondContact O-N 3.46Å; Q538-S542 PolarHBondContact O-OG 3.11Å; L539-S542 PolarHBondContact O-OG 3.3Å; L539-S542 VanDerWaalsContact O-OG 3.08Å; S542-Q546 WeakPolarHBondContact O-CB 3.33Å; S542-Q546 PolarHBondContact O-N 3.4Å; S542-N582 WeakPolarHBondContact OG-CB 3.36Å; S542-N582 PolarHBondContact OG-ND2 3.18Å
543	G	91.2	Very high	92.4	Very high	25 Å²	25	63.8 Å²	63.8	26%	0.258	34%	0.336	S	S	.	.	H	α-helix	trans	-70.8	-38.1	175.3	0	0	0	0	0	113.4	L539 N540 A541 H547 N582	L539-G543 PolarHBondContact O-N 3.42Å; L539-G543 VanDerWaalsContact O-N 3.13Å; N540-G543 PolarHBondContact O-N 2.94Å; A541-G543 VanDerWaalsContact C-N 3.35Å; A541-G543 PolarHBondContact O-N 3.38Å; G543-H547 PolarHBondContact O-N 2.64Å; G543-N582 WeakPolarHBondContact CA-ND2 3.47Å; G543-N582 PolarHBondContact N-ND2 3.17Å
544	Y	94.4	Very high	92.5	Very high	68 Å²	68	64.8 Å²	64.8	27%	0.267	32%	0.322	S	S	.	.	H	α-helix	trans	-69.1	-43.4	174.9	-171.7	-110.3	0	0	0	111.2	D520 P521 V526 N540 A541 Q546 H547 L548	D520-Y544 PolarHBondContact OD1-OH 3.25Å; P521-Y544 HydrophobicContact CG-CD1 4.27Å; P521-Y544 HydrophobicContact CG-CE1 3.8Å; V526-Y544 HydrophobicContact CG1-CD1 4.15Å; V526-Y544 HydrophobicContact CG2-CD1 3.6Å; V526-Y544 HydrophobicContact CG2-CE1 3.79Å; N540-Y544 WeakPolarHBondContact O-CB 3.34Å; N540-Y544 PolarHBondContact O-N 2.75Å; A541-Y544 PolarHBondContact O-N 2.93Å; Y544-Q546 VanDerWaalsContact C-N 3.32Å; Y544-Q546 PolarHBondContact O-N 2.94Å; Y544-H547 WeakPolarHBondContact O-CB 3.04Å; Y544-H547 PolarHBondContact O-N 2.8Å; Y544-L548 HydrophobicContact CD1-CD1 3.87Å; Y544-L548 HydrophobicContact CD1-CG 4.33Å; Y544-L548 HydrophobicContact CE1-CD1 3.68Å; Y544-L548 HydrophobicContact CE1-CD2 4.45Å; Y544-L548 HydrophobicContact CE1-CG 4.24Å; Y544-L548 WeakPolarHBondContact O-CG 3.47Å; Y544-L548 PolarHBondContact O-N 3.17Å
545	L	95.8	Very high	92.4	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64.1	-35.4	175.3	-169.1	60.6	0	0	0	112.8	L523 V526 I527 L530 A541 H547 L548 T549 T559 L568	L523-L545 HydrophobicContact CD1-CD1 3.4Å; V526-L545 HydrophobicContact CG1-CB 3.88Å; V526-L545 HydrophobicContact CG1-CD1 4.36Å; I527-L545 HydrophobicContact CG1-CD2 4.12Å; L530-L545 HydrophobicContact CD1-CD2 3.87Å; A541-L545 WeakPolarHBondContact O-CB 3.35Å; A541-L545 PolarHBondContact O-N 3.05Å; L545-H547 VanDerWaalsContact C-N 3.3Å; L545-H547 PolarHBondContact O-N 2.94Å; L545-L548 PolarHBondContact O-N 3.15Å; L545-T549 HydrophobicContact CD1-CG2 4.18Å; L545-T549 HydrophobicContact CG-CG2 4.32Å; L545-T549 WeakPolarHBondContact O-CB 3.49Å; L545-T549 WeakPolarHBondContact O-CG2 3.06Å; L545-T549 PolarHBondContact O-N 3.49Å; L545-T549 PolarHBondContact O-OG1 3.01Å; L545-T559 HydrophobicContact CD1-CG2 4.23Å; L545-T559 HydrophobicContact CD2-CG2 4.03Å; L545-T559 HydrophobicContact CG-CG2 4.46Å; L545-L568 HydrophobicContact CD2-CD1 4.18Å; L545-L568 HydrophobicContact CD2-CD2 4.32Å; L545-L568 HydrophobicContact CD2-CG 4.48Å
546	Q	94.6	Very high	92.6	Very high	51 Å²	51	60 Å²	60	24%	0.238	30%	0.3	C	S	.	.	H	α-helix	trans	-59	-41.4	170.2	-178.1	-164	-17.8	0	0	111.6	S542 Y544 T549 A585 C586 N589	S542-Q546 WeakPolarHBondContact O-CB 3.33Å; S542-Q546 PolarHBondContact O-N 3.4Å; Y544-Q546 VanDerWaalsContact C-N 3.32Å; Y544-Q546 PolarHBondContact O-N 2.94Å; Q546-T549 PolarHBondContact O-OG1 3.26Å; Q546-A585 VanDerWaalsContact CD-CB 3.46Å; Q546-A585 HydrophobicContact CG-CB 3.94Å; Q546-C586 HydrophobicContact CB-CB 4.2Å; Q546-N589 PolarHBondContact O-ND2 3.09Å
547	H	91.7	Very high	92.7	Very high	136 Å²	136	59.2 Å²	59.2	63%	0.63	29%	0.293	S	S	*	.	H	α-helix	trans	-65.6	-49.2	177	171.9	45.9	0	0	0	111.8	G543 Y544 L545 T549 Y550	G543-H547 PolarHBondContact O-N 2.64Å; Y544-H547 WeakPolarHBondContact O-CB 3.04Å; Y544-H547 PolarHBondContact O-N 2.8Å; L545-H547 VanDerWaalsContact C-N 3.3Å; L545-H547 PolarHBondContact O-N 2.94Å; H547-T549 VanDerWaalsContact C-N 3.35Å; H547-T549 PolarHBondContact O-N 3.17Å; H547-Y550 WeakPolarHBondContact O-CB 3.18Å; H547-Y550 PolarHBondContact O-N 3.25Å
548	L	91.5	Very high	92.9	Very high	48 Å²	48	56.2 Å²	56.2	25%	0.251	28%	0.281	S	S	.	.	H	α-helix	trans	-61.6	-39.7	-179.4	-61.6	178.1	0	0	0	112.6	L523 Y544 L545 Y550 I555	L523-L548 HydrophobicContact CD1-CD1 4.32Å; Y544-L548 HydrophobicContact CD1-CD1 3.87Å; Y544-L548 HydrophobicContact CD1-CG 4.33Å; Y544-L548 HydrophobicContact CE1-CD1 3.68Å; Y544-L548 HydrophobicContact CE1-CD2 4.45Å; Y544-L548 HydrophobicContact CE1-CG 4.24Å; Y544-L548 WeakPolarHBondContact O-CG 3.47Å; Y544-L548 PolarHBondContact O-N 3.17Å; L545-L548 PolarHBondContact O-N 3.15Å; L548-Y550 VanDerWaalsContact C-N 3.29Å; L548-Y550 PolarHBondContact O-N 2.77Å; L548-I555 HydrophobicContact CB-CG2 3.88Å
549	T	92.7	Very high	92.9	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-1.4	-177.3	51.8	0	0	0	0	115.1	L545 Q546 H547 I555 K556 L590	L545-T549 HydrophobicContact CD1-CG2 4.18Å; L545-T549 HydrophobicContact CG-CG2 4.32Å; L545-T549 WeakPolarHBondContact O-CB 3.49Å; L545-T549 WeakPolarHBondContact O-CG2 3.06Å; L545-T549 PolarHBondContact O-N 3.49Å; L545-T549 PolarHBondContact O-OG1 3.01Å; Q546-T549 PolarHBondContact O-OG1 3.26Å; H547-T549 VanDerWaalsContact C-N 3.35Å; H547-T549 PolarHBondContact O-N 3.17Å; T549-I555 HydrophobicContact CG2-CG2 4.04Å; T549-K556 HydrophobicContact CG2-CG 4.49Å; T549-K556 WeakPolarHBondContact O-CE 3.34Å; T549-L590 HydrophobicContact CG2-CD2 3.84Å; T549-L590 HydrophobicContact CG2-CG 4.13Å
550	Y	89.1	Confident	93.1	Very high	153 Å²	153	57.9 Å²	57.9	60%	0.6	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-51.1	-167.7	-179.8	-119.1	0	0	0	114.2	H547 L548	H547-Y550 WeakPolarHBondContact O-CB 3.18Å; H547-Y550 PolarHBondContact O-N 3.25Å; L548-Y550 VanDerWaalsContact C-N 3.29Å; L548-Y550 PolarHBondContact O-N 2.77Å
551	T	83.4	Confident	93.3	Very high	115 Å²	115	58.4 Å²	58.4	71%	0.706	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.3	-16.1	-177.8	42.4	0	0	0	0	114
552	D	88.6	Confident	93.4	Very high	71 Å²	71	61.8 Å²	61.8	38%	0.38	30%	0.295	S	S	.	.			trans	-88.2	114.6	-175	-169.7	-43.4	0	0	0	110.8	Q554 I555 K556	D552-Q554 WeakPolarHBondContact OD1-CA 3.45Å; D552-Q554 WeakPolarHBondContact OD1-CB 3.33Å; D552-Q554 PolarHBondContact OD1-N 3.09Å; D552-I555 HydrophobicContact CB-CB 3.98Å; D552-I555 HydrophobicContact CB-CG1 3.94Å; D552-I555 VanDerWaalsContact CG-CG1 3.46Å; D552-I555 PolarHBondContact OD1-N 3.08Å; D552-K556 WeakPolarHBondContact O-CG 3.48Å; D552-K556 PolarHBondContact O-N 3.32Å
553	N	92.1	Very high	93.5	Very high	60 Å²	60	63.1 Å²	63.1	32%	0.321	31%	0.309	S	S	.	.	H	α-helix	trans	-78.1	-27.4	179.7	-79	-15.1	0	0	0	113.4	K556 E557 E595 N596	N553-K556 PolarHBondContact O-N 3.04Å; N553-K556 WeakPolarHBondContact OD1-CD 3.27Å; N553-K556 WeakPolarHBondContact OD1-CE 3.24Å; N553-K556 PolarHBondContact OD1-NZ 3.44Å; N553-E557 PolarHBondContact O-N 3.41Å; N553-E595 VanDerWaalsContact ND2-CG 3.29Å; N553-E595 WeakPolarHBondContact ND2-CG 3.3Å; N553-E595 PolarHBondContact ND2-OE1 3.4Å; N553-N596 PolarHBondContact OD1-ND2 2.96Å
554	Q	93.3	Very high	93.8	Very high	127 Å²	127	61.9 Å²	61.9	59%	0.593	30%	0.297	S	S	*	.	H	α-helix	trans	-67.5	-44.4	174.1	-177.3	-173.2	-36.8	0	0	109.8	D552 K556 E557 E558	D552-Q554 WeakPolarHBondContact OD1-CA 3.45Å; D552-Q554 WeakPolarHBondContact OD1-CB 3.33Å; D552-Q554 PolarHBondContact OD1-N 3.09Å; Q554-K556 VanDerWaalsContact C-N 3.28Å; Q554-K556 PolarHBondContact O-N 3.07Å; Q554-E557 PolarHBondContact O-N 3.16Å; Q554-E557 VanDerWaalsContact O-N 3.13Å; Q554-E558 HydrophobicContact CG-CG 4.5Å; Q554-E558 PolarHBondContact NE2-OE1 2.86Å; Q554-E558 PolarHBondContact O-N 3.33Å
555	I	93.5	Very high	93.9	Very high	33 Å²	33	58.7 Å²	58.7	17%	0.169	28%	0.284	C	S	.	.	H	α-helix	trans	-61.6	-35.9	175.5	-67.2	-67.5	0	0	0	111.7	L523 L548 T549 D552 T559	L523-I555 HydrophobicContact CD2-CD1 4.03Å; L523-I555 HydrophobicContact CD2-CG2 4.35Å; L548-I555 HydrophobicContact CB-CG2 3.88Å; T549-I555 HydrophobicContact CG2-CG2 4.04Å; D552-I555 HydrophobicContact CB-CB 3.98Å; D552-I555 HydrophobicContact CB-CG1 3.94Å; D552-I555 VanDerWaalsContact CG-CG1 3.46Å; D552-I555 PolarHBondContact OD1-N 3.08Å; I555-T559 WeakPolarHBondContact O-CB 3.39Å; I555-T559 PolarHBondContact O-N 2.97Å; I555-T559 PolarHBondContact O-OG1 2.87Å
556	K	96.1	Very high	94	Very high	3 Å²	3	62 Å²	62	1%	0.013	31%	0.306	C	S	.	.	H	α-helix	trans	-63.5	-44.4	173.6	-68.9	172.4	-162.5	171.8	0	111.6	T549 D552 N553 Q554 T559 R560 N589 L590 F592 N596	T549-K556 HydrophobicContact CG2-CG 4.49Å; T549-K556 WeakPolarHBondContact O-CE 3.34Å; D552-K556 WeakPolarHBondContact O-CG 3.48Å; D552-K556 PolarHBondContact O-N 3.32Å; N553-K556 PolarHBondContact O-N 3.04Å; N553-K556 WeakPolarHBondContact OD1-CD 3.27Å; N553-K556 WeakPolarHBondContact OD1-CE 3.24Å; N553-K556 PolarHBondContact OD1-NZ 3.44Å; Q554-K556 VanDerWaalsContact C-N 3.28Å; Q554-K556 PolarHBondContact O-N 3.07Å; K556-T559 WeakPolarHBondContact O-CB 3.32Å; K556-T559 PolarHBondContact O-N 2.89Å; K556-R560 PolarHBondContact O-N 2.79Å; K556-R560 VanDerWaalsContact O-N 3.11Å; K556-N589 WeakPolarHBondContact CE-O 3.17Å; K556-N589 PolarHBondContact NZ-O 3.25Å; K556-L590 HydrophobicContact CB-CD2 3.86Å; K556-L590 HydrophobicContact CG-CD2 4.02Å; K556-F592 PolarHBondContact NZ-O 3.25Å; K556-N596 WeakPolarHBondContact CD-OD1 3.48Å; K556-N596 PolarHBondContact NZ-ND2 3Å
557	E	95.4	Very high	94.2	Very high	93 Å²	93	62.4 Å²	62.4	44%	0.435	31%	0.307	S	S	.	.	H	α-helix	trans	-63.5	-51.2	177	176.1	149.1	-121.7	0	0	112	N553 Q554 T559 R560 E561	N553-E557 PolarHBondContact O-N 3.41Å; Q554-E557 PolarHBondContact O-N 3.16Å; Q554-E557 VanDerWaalsContact O-N 3.13Å; E557-T559 PolarHBondContact O-N 3Å; E557-R560 WeakPolarHBondContact O-CA 3.47Å; E557-R560 WeakPolarHBondContact O-CB 3.49Å; E557-R560 PolarHBondContact O-N 2.95Å; E557-R560 IonicContact OE1-CZ 3.4Å; E557-R560 IonicContact OE1-NH2 3.68Å; E557-R560 PolarHBondContact OE1-NH2 2.92Å; E557-E561 PolarHBondContact O-N 3.31Å
558	E	96.1	Very high	94.5	Very high	40 Å²	40	55.9 Å²	55.9	19%	0.187	28%	0.277	C	S	.	.	H	α-helix	trans	-59	-34.1	174.4	-73.1	-169	-129.8	0	0	112	L523 Q554 R560 E561 Y562	L523-E558 HydrophobicContact CD2-CB 3.55Å; Q554-E558 HydrophobicContact CG-CG 4.5Å; Q554-E558 PolarHBondContact NE2-OE1 2.86Å; Q554-E558 PolarHBondContact O-N 3.33Å; E558-R560 VanDerWaalsContact C-N 3.33Å; E558-R560 PolarHBondContact O-N 3.5Å; E558-E561 PolarHBondContact O-N 3.14Å; E558-Y562 HydrophobicContact CB-CD2 4.28Å; E558-Y562 HydrophobicContact CB-CE2 3.77Å; E558-Y562 HydrophobicContact CG-CE2 4.28Å; E558-Y562 WeakPolarHBondContact O-CB 3.48Å; E558-Y562 WeakPolarHBondContact O-CD2 3.41Å; E558-Y562 VanDerWaalsContact O-CG 3.22Å; E558-Y562 PolarHBondContact O-N 2.93Å; E558-Y562 VanDerWaalsContact OE2-CE2 3.27Å; E558-Y562 WeakPolarHBondContact OE2-CE2 3.35Å; E558-Y562 PolarHBondContact OE2-OH 3.36Å
559	T	96.3	Very high	94.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.8	-32.2	174.8	-61.4	0	0	0	0	112.6	I527 L545 I555 K556 E557 G564 L590	I527-T559 HydrophobicContact CD1-CG2 4.18Å; L545-T559 HydrophobicContact CD1-CG2 4.23Å; L545-T559 HydrophobicContact CD2-CG2 4.03Å; L545-T559 HydrophobicContact CG-CG2 4.46Å; I555-T559 WeakPolarHBondContact O-CB 3.39Å; I555-T559 PolarHBondContact O-N 2.97Å; I555-T559 PolarHBondContact O-OG1 2.87Å; K556-T559 WeakPolarHBondContact O-CB 3.32Å; K556-T559 PolarHBondContact O-N 2.89Å; E557-T559 PolarHBondContact O-N 3Å; T559-G564 VanDerWaalsContact O-CA 3.25Å; T559-G564 WeakPolarHBondContact O-CA 3.49Å; T559-G564 PolarHBondContact O-N 3.02Å; T559-L590 HydrophobicContact CG2-CD1 4.06Å; T559-L590 HydrophobicContact CG2-CD2 3.8Å
560	R	97.4	Very high	95	Very high	75 Å²	75	56.7 Å²	56.7	28%	0.283	29%	0.29	S	S	.	.	H	α-helix	trans	-69.1	-52.1	169.5	171.9	-168.3	60.9	149.9	-2.4	110.1	K556 E557 E558 Y562 G563 I565 N599 A602	K556-R560 PolarHBondContact O-N 2.79Å; K556-R560 VanDerWaalsContact O-N 3.11Å; E557-R560 WeakPolarHBondContact O-CA 3.47Å; E557-R560 WeakPolarHBondContact O-CB 3.49Å; E557-R560 PolarHBondContact O-N 2.95Å; E557-R560 IonicContact OE1-CZ 3.4Å; E557-R560 IonicContact OE1-NH2 3.68Å; E557-R560 PolarHBondContact OE1-NH2 2.92Å; E558-R560 VanDerWaalsContact C-N 3.33Å; E558-R560 PolarHBondContact O-N 3.5Å; R560-Y562 PolarHBondContact O-N 3.36Å; R560-G563 PolarHBondContact O-N 2.86Å; R560-I565 HydrophobicContact CB-CD1 3.86Å; R560-I565 HydrophobicContact CG-CD1 4.21Å; R560-N599 WeakPolarHBondContact CB-OD1 3.5Å; R560-N599 WeakPolarHBondContact CD-OD1 3.49Å; R560-A602 HydrophobicContact CG-CB 4.21Å
561	E	96.6	Very high	95.4	Very high	123 Å²	123	49.8 Å²	49.8	58%	0.575	26%	0.263	S	S	*	.	H	α-helix	trans	-59.5	-41.5	-176.1	-68.7	-173.2	165.2	0	0	113.4	E557 E558 G563	E557-E561 PolarHBondContact O-N 3.31Å; E558-E561 PolarHBondContact O-N 3.14Å; E561-G563 PolarHBondContact O-N 3.1Å
562	Y	96.6	Very high	96.1	Very high	76 Å²	76	44.4 Å²	44.4	30%	0.298	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	12.1	177.2	-52.4	-27.8	0	0	0	113.2	L523 K524 I527 E558 R560 G564	L523-Y562 HydrophobicContact CB-CE2 4.46Å; L523-Y562 HydrophobicContact CD2-CD2 4.19Å; L523-Y562 HydrophobicContact CD2-CE2 4.04Å; L523-Y562 HydrophobicContact CG-CD2 4.15Å; L523-Y562 HydrophobicContact CG-CE2 4.29Å; K524-Y562 HydrophobicContact CD-CD2 4.5Å; K524-Y562 HydrophobicContact CD-CE1 4.43Å; K524-Y562 HydrophobicContact CD-CE2 4.4Å; K524-Y562 HydrophobicContact CG-CD1 4.34Å; K524-Y562 HydrophobicContact CG-CD2 3.61Å; K524-Y562 HydrophobicContact CG-CE2 3.79Å; K524-Y562 HydrophobicContact CG-CG 3.91Å; I527-Y562 HydrophobicContact CD1-CD2 4.21Å; E558-Y562 HydrophobicContact CB-CD2 4.28Å; E558-Y562 HydrophobicContact CB-CE2 3.77Å; E558-Y562 HydrophobicContact CG-CE2 4.28Å; E558-Y562 WeakPolarHBondContact O-CB 3.48Å; E558-Y562 WeakPolarHBondContact O-CD2 3.41Å; E558-Y562 VanDerWaalsContact O-CG 3.22Å; E558-Y562 PolarHBondContact O-N 2.93Å; E558-Y562 VanDerWaalsContact OE2-CE2 3.27Å; E558-Y562 WeakPolarHBondContact OE2-CE2 3.35Å; E558-Y562 PolarHBondContact OE2-OH 3.36Å; R560-Y562 PolarHBondContact O-N 3.36Å; Y562-G564 PolarHBondContact O-N 3.37Å
563	G	96.3	Very high	96.4	Very high	28 Å²	28	49.4 Å²	49.4	29%	0.289	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	72	23.9	174.8	0	0	0	0	0	114.5	R560 E561 K567	R560-G563 PolarHBondContact O-N 2.86Å; E561-G563 PolarHBondContact O-N 3.1Å; G563-K567 WeakPolarHBondContact O-CD 3.34Å; G563-K567 WeakPolarHBondContact O-CG 3.45Å
564	G	97.4	Very high	96.5	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66.6	-35.7	179.7	0	0	0	0	0	113.8	T559 Y562 K567 L568	T559-G564 VanDerWaalsContact O-CA 3.25Å; T559-G564 WeakPolarHBondContact O-CA 3.49Å; T559-G564 PolarHBondContact O-N 3.02Å; Y562-G564 PolarHBondContact O-N 3.37Å; G564-K567 WeakPolarHBondContact O-CB 3.38Å; G564-K567 PolarHBondContact O-N 3.49Å; G564-L568 WeakPolarHBondContact O-CG 3.21Å; G564-L568 PolarHBondContact O-N 3.48Å
565	I	98	Very high	96.4	Very high	1 Å²	1	47 Å²	47	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-59.6	-53.2	-177.9	-72.7	170.4	0	0	0	112.6	R560 K567 L568 I569 L587 L590 N599 A602 V603	R560-I565 HydrophobicContact CB-CD1 3.86Å; R560-I565 HydrophobicContact CG-CD1 4.21Å; I565-K567 VanDerWaalsContact C-N 3.26Å; I565-K567 PolarHBondContact O-N 2.88Å; I565-L568 PolarHBondContact O-N 3.31Å; I565-I569 HydrophobicContact CG2-CD1 3.75Å; I565-I569 WeakPolarHBondContact O-CG1 3.21Å; I565-I569 PolarHBondContact O-N 2.93Å; I565-L587 HydrophobicContact CG2-CD2 4.48Å; I565-L590 HydrophobicContact CG1-CD1 4.06Å; I565-N599 HydrophobicContact CD1-CB 4.03Å; I565-A602 HydrophobicContact CD1-CB 3.89Å; I565-A602 HydrophobicContact CG2-CB 4.29Å; I565-V603 HydrophobicContact CG2-CB 4.41Å; I565-V603 HydrophobicContact CG2-CG2 3.62Å
566	P	98.2	Very high	96.5	Very high	70 Å²	70	47.3 Å²	47.3	46%	0.455	24%	0.239	S	C	.	.	H	α-helix	trans	-57.7	-34.8	174.3	-27.2	34.6	0	0	0	114	I569 A570 A606	P566-I569 PolarHBondContact O-N 3.06Å; P566-A570 PolarHBondContact O-N 2.89Å; P566-A606 HydrophobicContact CB-CB 4.34Å; P566-A606 HydrophobicContact CG-CB 4.16Å
567	K	97.9	Very high	96.4	Very high	58 Å²	58	49.7 Å²	49.7	25%	0.252	26%	0.255	S	S	.	.	H	α-helix	trans	-69.2	-41.9	178	-67.1	162.2	172.8	-91.7	0	111.8	I527 L530 S531 G563 G564 I565 I569 A570 L571	I527-K567 HydrophobicContact CG2-CD 3.56Å; I527-K567 WeakPolarHBondContact O-CD 3.35Å; L530-K567 HydrophobicContact CB-CB 4.16Å; L530-K567 HydrophobicContact CD1-CB 3.97Å; S531-K567 PolarHBondContact OG-NZ 2.78Å; G563-K567 WeakPolarHBondContact O-CD 3.34Å; G563-K567 WeakPolarHBondContact O-CG 3.45Å; G564-K567 WeakPolarHBondContact O-CB 3.38Å; G564-K567 PolarHBondContact O-N 3.49Å; I565-K567 VanDerWaalsContact C-N 3.26Å; I565-K567 PolarHBondContact O-N 2.88Å; K567-I569 VanDerWaalsContact C-N 3.32Å; K567-A570 WeakPolarHBondContact O-CB 3.27Å; K567-A570 PolarHBondContact O-N 3.36Å; K567-L571 WeakPolarHBondContact O-CG 3.33Å; K567-L571 PolarHBondContact O-N 2.91Å; K567-L571 VanDerWaalsContact O-N 3.11Å
568	L	98.3	Very high	96.4	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-39.3	172.8	-70.7	166.3	0	0	0	111.6	L530 L545 G564 I565 L571 L572 C586 L587 L590	L530-L568 HydrophobicContact CD1-CD2 3.98Å; L530-L568 HydrophobicContact CD1-CG 3.98Å; L530-L568 HydrophobicContact CD2-CD2 4.28Å; L545-L568 HydrophobicContact CD2-CD1 4.18Å; L545-L568 HydrophobicContact CD2-CD2 4.32Å; L545-L568 HydrophobicContact CD2-CG 4.48Å; G564-L568 WeakPolarHBondContact O-CG 3.21Å; G564-L568 PolarHBondContact O-N 3.48Å; I565-L568 PolarHBondContact O-N 3.31Å; L568-L571 WeakPolarHBondContact O-CB 3.32Å; L568-L571 PolarHBondContact O-N 3.38Å; L568-L572 PolarHBondContact O-N 3.45Å; L568-C586 HydrophobicContact CD1-CB 4.13Å; L568-C586 VanDerWaalsContact CD1-SG 3.54Å; L568-C586 HydrophobicContact CD2-CB 4.05Å; L568-L587 HydrophobicContact CB-CD1 4.41Å; L568-L587 HydrophobicContact CB-CD2 3.99Å; L568-L587 HydrophobicContact CB-CG 4.09Å; L568-L587 HydrophobicContact CD1-CD2 4.36Å; L568-L590 HydrophobicContact CD1-CD1 3.42Å; L568-L590 VanDerWaalsContact CD1-CD1 3.42Å
569	I	98.2	Very high	96.5	Very high	5 Å²	5	51.4 Å²	51.4	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-68	-36.1	176.7	-69.5	162.2	0	0	0	111.5	I565 P566 K567 L571 L572 L587 V603 A606 L611	I565-I569 HydrophobicContact CG2-CD1 3.75Å; I565-I569 WeakPolarHBondContact O-CG1 3.21Å; I565-I569 PolarHBondContact O-N 2.93Å; P566-I569 PolarHBondContact O-N 3.06Å; K567-I569 VanDerWaalsContact C-N 3.32Å; I569-L571 VanDerWaalsContact C-N 3.31Å; I569-L571 PolarHBondContact O-N 2.65Å; I569-L572 HydrophobicContact CG1-CD1 4.5Å; I569-L572 HydrophobicContact CG2-CD1 4.36Å; I569-L572 VanDerWaalsContact O-CB 3.28Å; I569-L572 WeakPolarHBondContact O-CB 3.46Å; I569-L572 WeakPolarHBondContact O-CG 3.48Å; I569-L572 PolarHBondContact O-N 3.11Å; I569-L587 HydrophobicContact CD1-CD2 4.42Å; I569-L587 HydrophobicContact CG1-CD1 3.95Å; I569-L587 HydrophobicContact CG1-CD2 4.01Å; I569-V603 HydrophobicContact CD1-CB 4.43Å; I569-V603 HydrophobicContact CD1-CG1 4.24Å; I569-V603 HydrophobicContact CD1-CG2 4.44Å; I569-A606 HydrophobicContact CD1-CB 3.55Å; I569-A606 WeakPolarHBondContact CG2-O 3.19Å; I569-L611 HydrophobicContact CG2-CB 4.39Å; I569-L611 HydrophobicContact CG2-CD1 3.43Å; I569-L611 VanDerWaalsContact CG2-CD1 3.43Å
570	A	96.9	Very high	96.5	Very high	60 Å²	60	52.3 Å²	52.3	50%	0.496	26%	0.26	S	S	.	.	H	α-helix	trans	-62.1	-37.3	170.8	0	0	0	0	0	112.4	P566 K567 L572 R573	P566-A570 PolarHBondContact O-N 2.89Å; K567-A570 WeakPolarHBondContact O-CB 3.27Å; K567-A570 PolarHBondContact O-N 3.36Å; A570-L572 PolarHBondContact O-N 3.46Å; A570-R573 PolarHBondContact O-N 3.37Å; A570-R573 VanDerWaalsContact O-N 3.16Å
571	L	97.1	Very high	96.4	Very high	7 Å²	7	52 Å²	52	4%	0.037	26%	0.261	C	S	.	.	H	α-helix	trans	-65.5	-18.7	176.3	-70.4	-178.7	0	0	0	114.2	L530 Q538 K567 L568 I569 R573 S574 I579 A583	L530-L571 HydrophobicContact CB-CD1 4.12Å; L530-L571 HydrophobicContact CD2-CD1 3.87Å; L530-L571 HydrophobicContact CG-CD1 4.5Å; Q538-L571 HydrophobicContact CB-CD2 4.38Å; Q538-L571 HydrophobicContact CG-CD2 4.35Å; Q538-L571 VanDerWaalsContact NE2-CD2 3.27Å; K567-L571 WeakPolarHBondContact O-CG 3.33Å; K567-L571 PolarHBondContact O-N 2.91Å; K567-L571 VanDerWaalsContact O-N 3.11Å; L568-L571 WeakPolarHBondContact O-CB 3.32Å; L568-L571 PolarHBondContact O-N 3.38Å; I569-L571 VanDerWaalsContact C-N 3.31Å; I569-L571 PolarHBondContact O-N 2.65Å; L571-R573 PolarHBondContact O-N 2.93Å; L571-S574 WeakPolarHBondContact O-CB 3.49Å; L571-S574 PolarHBondContact O-N 2.91Å; L571-I579 HydrophobicContact CB-CG2 4.04Å; L571-I579 HydrophobicContact CD1-CG2 4.25Å; L571-I579 HydrophobicContact CD2-CG2 3.87Å; L571-I579 HydrophobicContact CG-CG2 4.28Å; L571-A583 HydrophobicContact CB-CB 3.93Å
572	L	96.9	Very high	96.5	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.016	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-27.9	172.4	-61	177.9	0	0	0	112.3	L568 I569 A570 S574 Q580 A583 C584 L587 L611 I612 V615	L568-L572 PolarHBondContact O-N 3.45Å; I569-L572 HydrophobicContact CG1-CD1 4.5Å; I569-L572 HydrophobicContact CG2-CD1 4.36Å; I569-L572 VanDerWaalsContact O-CB 3.28Å; I569-L572 WeakPolarHBondContact O-CB 3.46Å; I569-L572 WeakPolarHBondContact O-CG 3.48Å; I569-L572 PolarHBondContact O-N 3.11Å; A570-L572 PolarHBondContact O-N 3.46Å; L572-S574 PolarHBondContact O-N 2.71Å; L572-Q580 PolarHBondContact O-NE2 2.8Å; L572-A583 HydrophobicContact CD2-CB 3.95Å; L572-C584 WeakPolarHBondContact CD2-SG 3.39Å; L572-L587 HydrophobicContact CD1-CD1 4.03Å; L572-L587 HydrophobicContact CD2-CD1 4.17Å; L572-L587 HydrophobicContact CG-CD1 4.31Å; L572-L611 HydrophobicContact CD1-CB 4.03Å; L572-I612 HydrophobicContact CD1-CG1 3.64Å; L572-V615 HydrophobicContact CB-CG2 3.87Å; L572-V615 HydrophobicContact CD2-CG2 4.41Å; L572-V615 WeakPolarHBondContact O-CG2 3.46Å
573	R	95.2	Very high	96.5	Very high	175 Å²	175	43.8 Å²	43.8	66%	0.66	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	4.6	176	-54.8	-177.4	-173.6	172.8	3	113.3	A570 L571 L611	A570-R573 PolarHBondContact O-N 3.37Å; A570-R573 VanDerWaalsContact O-N 3.16Å; L571-R573 PolarHBondContact O-N 2.93Å; R573-L611 HydrophobicContact CG-CD2 4.44Å
574	S	94.1	Very high	96.6	Very high	10 Å²	10	42.4 Å²	42.4	7%	0.07	21%	0.212	C	C	.	.			trans	-72.1	134.1	177.7	-166	0	0	0	0	111.4	K535 L571 L572 T576 Q580	K535-S574 PolarHBondContact NZ-OG 3.35Å; L571-S574 WeakPolarHBondContact O-CB 3.49Å; L571-S574 PolarHBondContact O-N 2.91Å; L572-S574 PolarHBondContact O-N 2.71Å; S574-T576 PolarHBondContact O-N 3.01Å; S574-T576 VanDerWaalsContact O-N 3.16Å; S574-Q580 VanDerWaalsContact O-CD 3.29Å; S574-Q580 WeakPolarHBondContact O-CG 3.43Å; S574-Q580 PolarHBondContact O-NE2 2.9Å
575	D	92.8	Very high	96.6	Very high	126 Å²	126	42.4 Å²	42.4	67%	0.674	21%	0.212	S	C	*	.	S	Bend	trans	-57.8	-18.3	170.2	58.5	1.9	0	0	0	114.8	K535 P577	K535-D575 IonicContact NZ-OD1 2.67Å; K535-D575 PolarHBondContact NZ-OD1 2.89Å; K535-D575 IonicContact NZ-OD2 3.75Å; D575-P577 WeakPolarHBondContact O-CD 3.07Å
576	T	94.4	Very high	96.6	Very high	41 Å²	41	42.4 Å²	42.4	25%	0.252	21%	0.211	S	C	.	.			trans	-95.3	110	-171	-56.7	0	0	0	0	110	S574 R578 I579 Q580	S574-T576 PolarHBondContact O-N 3.01Å; S574-T576 VanDerWaalsContact O-N 3.16Å; T576-R578 VanDerWaalsContact C-N 3.26Å; T576-R578 PolarHBondContact O-N 3.03Å; T576-R578 VanDerWaalsContact O-N 3.14Å; T576-I579 HydrophobicContact CG2-CB 4.38Å; T576-I579 HydrophobicContact CG2-CD1 3.97Å; T576-I579 HydrophobicContact CG2-CG1 3.82Å; T576-I579 WeakPolarHBondContact O-CB 3.13Å; T576-I579 PolarHBondContact O-N 2.66Å; T576-Q580 PolarHBondContact O-N 3.17Å; T576-Q580 VanDerWaalsContact O-N 3.15Å
577	P	95.1	Very high	96.6	Very high	52 Å²	52	39.1 Å²	39.1	34%	0.338	19%	0.19	S	C	.	.	H	α-helix	trans	-60.8	-32.1	-172.5	-26.3	36	0	0	0	113.7	D575 I579 Q580 K581 D621 V624	D575-P577 WeakPolarHBondContact O-CD 3.07Å; P577-I579 VanDerWaalsContact C-N 3.31Å; P577-I579 PolarHBondContact O-N 3.22Å; P577-Q580 PolarHBondContact O-N 2.77Å; P577-K581 WeakPolarHBondContact O-CB 3.3Å; P577-K581 PolarHBondContact O-N 2.78Å; P577-D621 HydrophobicContact CB-CB 4.13Å; P577-V624 HydrophobicContact CB-CG2 4.1Å; P577-V624 VanDerWaalsContact O-CG2 3.26Å; P577-V624 WeakPolarHBondContact O-CG2 3.28Å
578	R	95.6	Very high	96.5	Very high	169 Å²	169	38.4 Å²	38.4	64%	0.638	19%	0.187	S	C	*	.	H	α-helix	trans	-64.5	-33.6	175.3	-62	-177.9	66.8	-166.4	-0.9	112.7	L539 T576 N582	L539-R578 HydrophobicContact CD1-CB 3.55Å; T576-R578 VanDerWaalsContact C-N 3.26Å; T576-R578 PolarHBondContact O-N 3.03Å; T576-R578 VanDerWaalsContact O-N 3.14Å; R578-N582 PolarHBondContact O-N 3.17Å; R578-N582 VanDerWaalsContact O-N 3.13Å; R578-N582 PolarHBondContact O-OD1 3.19Å
579	I	96.4	Very high	96.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-73.5	-45.3	175.7	-63.7	179.5	0	0	0	109.8	K535 Q538 L539 L571 T576 P577 K581 N582 A583	K535-I579 HydrophobicContact CB-CD1 4.38Å; K535-I579 HydrophobicContact CD-CD1 3.77Å; Q538-I579 HydrophobicContact CB-CD1 4.07Å; L539-I579 HydrophobicContact CB-CD1 4.36Å; L539-I579 HydrophobicContact CB-CG1 3.96Å; L539-I579 HydrophobicContact CD1-CG1 4.03Å; L571-I579 HydrophobicContact CB-CG2 4.04Å; L571-I579 HydrophobicContact CD1-CG2 4.25Å; L571-I579 HydrophobicContact CD2-CG2 3.87Å; L571-I579 HydrophobicContact CG-CG2 4.28Å; T576-I579 HydrophobicContact CG2-CB 4.38Å; T576-I579 HydrophobicContact CG2-CD1 3.97Å; T576-I579 HydrophobicContact CG2-CG1 3.82Å; T576-I579 WeakPolarHBondContact O-CB 3.13Å; T576-I579 PolarHBondContact O-N 2.66Å; P577-I579 VanDerWaalsContact C-N 3.31Å; P577-I579 PolarHBondContact O-N 3.22Å; I579-K581 VanDerWaalsContact C-N 3.29Å; I579-K581 PolarHBondContact O-N 2.86Å; I579-N582 PolarHBondContact O-N 3.32Å; I579-A583 WeakPolarHBondContact O-CB 2.99Å; I579-A583 PolarHBondContact O-N 2.85Å
580	Q	96.3	Very high	96.5	Very high	20 Å²	20	38.6 Å²	38.6	9%	0.093	19%	0.188	C	C	.	.	H	α-helix	trans	-56.3	-44.3	173.5	-63.5	-173.2	-50.1	0	0	111.5	L572 S574 T576 P577 A583 C584 V624	L572-Q580 PolarHBondContact O-NE2 2.8Å; S574-Q580 VanDerWaalsContact O-CD 3.29Å; S574-Q580 WeakPolarHBondContact O-CG 3.43Å; S574-Q580 PolarHBondContact O-NE2 2.9Å; T576-Q580 PolarHBondContact O-N 3.17Å; T576-Q580 VanDerWaalsContact O-N 3.15Å; P577-Q580 PolarHBondContact O-N 2.77Å; Q580-A583 PolarHBondContact O-N 3.05Å; Q580-C584 WeakPolarHBondContact O-CB 3.34Å; Q580-C584 PolarHBondContact O-N 2.93Å; Q580-C584 PolarHBondContact O-SG 3.48Å; Q580-C584 VanDerWaalsContact O-SG 3.34Å; Q580-V624 HydrophobicContact CB-CG1 3.88Å; Q580-V624 HydrophobicContact CB-CG2 4.29Å
581	K	96.8	Very high	96.4	Very high	69 Å²	69	35.8 Å²	35.8	30%	0.3	17%	0.165	S	C	.	.	H	α-helix	trans	-59.9	-52.4	178.2	-170.2	-179.5	-174.3	167.6	0	112	P577 I579 A583 C584 A585 S623 V624 E627	P577-K581 WeakPolarHBondContact O-CB 3.3Å; P577-K581 PolarHBondContact O-N 2.78Å; I579-K581 VanDerWaalsContact C-N 3.29Å; I579-K581 PolarHBondContact O-N 2.86Å; K581-A583 VanDerWaalsContact C-N 3.28Å; K581-A583 PolarHBondContact O-N 2.98Å; K581-C584 PolarHBondContact O-N 2.8Å; K581-A585 VanDerWaalsContact O-CB 3.27Å; K581-A585 WeakPolarHBondContact O-CB 3.48Å; K581-A585 PolarHBondContact O-N 2.81Å; K581-S623 WeakPolarHBondContact CD-OG 3.43Å; K581-S623 WeakPolarHBondContact CE-OG 3.39Å; K581-S623 VanDerWaalsContact NZ-CB 3.25Å; K581-S623 PolarHBondContact NZ-OG 2.88Å; K581-V624 HydrophobicContact CB-CG2 3.95Å; K581-E627 HydrophobicContact CG-CG 3.97Å
582	N	97.6	Very high	96.3	Very high	25 Å²	25	41 Å²	41	13%	0.134	19%	0.188	C	C	.	.	H	α-helix	trans	-60.9	-39.8	179.9	-68.4	5.8	0	0	0	111.1	L539 S542 G543 R578 I579 A585 C586	L539-N582 PolarHBondContact O-ND2 3.45Å; S542-N582 WeakPolarHBondContact OG-CB 3.36Å; S542-N582 PolarHBondContact OG-ND2 3.18Å; G543-N582 WeakPolarHBondContact CA-ND2 3.47Å; G543-N582 PolarHBondContact N-ND2 3.17Å; R578-N582 PolarHBondContact O-N 3.17Å; R578-N582 VanDerWaalsContact O-N 3.13Å; R578-N582 PolarHBondContact O-OD1 3.19Å; I579-N582 PolarHBondContact O-N 3.32Å; N582-A585 PolarHBondContact O-N 3.23Å; N582-C586 VanDerWaalsContact O-CB 3.28Å; N582-C586 WeakPolarHBondContact O-CB 3.16Å; N582-C586 PolarHBondContact O-N 3.01Å
583	A	97.9	Very high	95.8	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.4	-51.5	175	0	0	0	0	0	112.2	L571 L572 I579 Q580 K581 A585 C586 L587	L571-A583 HydrophobicContact CB-CB 3.93Å; L572-A583 HydrophobicContact CD2-CB 3.95Å; I579-A583 WeakPolarHBondContact O-CB 2.99Å; I579-A583 PolarHBondContact O-N 2.85Å; Q580-A583 PolarHBondContact O-N 3.05Å; K581-A583 VanDerWaalsContact C-N 3.28Å; K581-A583 PolarHBondContact O-N 2.98Å; A583-A585 VanDerWaalsContact C-N 3.33Å; A583-A585 PolarHBondContact O-N 2.84Å; A583-C586 PolarHBondContact O-N 2.78Å; A583-L587 WeakPolarHBondContact O-CB 3.44Å; A583-L587 VanDerWaalsContact O-CG 3.26Å; A583-L587 WeakPolarHBondContact O-CG 3.2Å; A583-L587 PolarHBondContact O-N 2.87Å
584	C	98	Very high	95.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57.4	-43.9	174.4	-71.3	0	0	0	0	112.4	L572 Q580 K581 L587 K588 E627	L572-C584 WeakPolarHBondContact CD2-SG 3.39Å; Q580-C584 WeakPolarHBondContact O-CB 3.34Å; Q580-C584 PolarHBondContact O-N 2.93Å; Q580-C584 PolarHBondContact O-SG 3.48Å; Q580-C584 VanDerWaalsContact O-SG 3.34Å; K581-C584 PolarHBondContact O-N 2.8Å; C584-L587 PolarHBondContact O-N 3.43Å; C584-K588 WeakPolarHBondContact O-CB 3.13Å; C584-K588 PolarHBondContact O-N 3.44Å; C584-E627 HydrophobicContact CB-CB 3.68Å
585	A	96.6	Very high	95.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-69.3	-34.6	-178.4	0	0	0	0	0	112.5	Q546 K581 N582 A583 K588 N589 E627	Q546-A585 VanDerWaalsContact CD-CB 3.46Å; Q546-A585 HydrophobicContact CG-CB 3.94Å; K581-A585 VanDerWaalsContact O-CB 3.27Å; K581-A585 WeakPolarHBondContact O-CB 3.48Å; K581-A585 PolarHBondContact O-N 2.81Å; N582-A585 PolarHBondContact O-N 3.23Å; A583-A585 VanDerWaalsContact C-N 3.33Å; A583-A585 PolarHBondContact O-N 2.84Å; A585-K588 WeakPolarHBondContact O-CB 3.5Å; A585-N589 PolarHBondContact O-N 2.76Å; A585-N589 VanDerWaalsContact O-N 3.1Å; A585-N589 PolarHBondContact O-OD1 3.02Å; A585-E627 HydrophobicContact CB-CB 4.38Å; A585-E627 HydrophobicContact CB-CG 4.02Å
586	C	97.6	Very high	95	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-70.7	-43	172.4	-170.3	0	0	0	0	111.3	Q546 L568 N582 A583 K588 N589 L590	Q546-C586 HydrophobicContact CB-CB 4.2Å; L568-C586 HydrophobicContact CD1-CB 4.13Å; L568-C586 VanDerWaalsContact CD1-SG 3.54Å; L568-C586 HydrophobicContact CD2-CB 4.05Å; N582-C586 VanDerWaalsContact O-CB 3.28Å; N582-C586 WeakPolarHBondContact O-CB 3.16Å; N582-C586 PolarHBondContact O-N 3.01Å; A583-C586 PolarHBondContact O-N 2.78Å; C586-K588 VanDerWaalsContact C-N 3.31Å; C586-K588 PolarHBondContact O-N 3.18Å; C586-N589 PolarHBondContact O-N 2.98Å; C586-N589 VanDerWaalsContact O-N 3.09Å; C586-L590 WeakPolarHBondContact O-CB 3.38Å; C586-L590 WeakPolarHBondContact O-CD1 3.48Å; C586-L590 VanDerWaalsContact O-CG 3.31Å; C586-L590 WeakPolarHBondContact O-CG 3.48Å; C586-L590 PolarHBondContact O-N 2.83Å
587	L	98.3	Very high	94.9	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-61.8	-36.8	173.9	-69.5	167.7	0	0	0	112.4	I565 L568 I569 L572 A583 C584 S591 V603 I612	I565-L587 HydrophobicContact CG2-CD2 4.48Å; L568-L587 HydrophobicContact CB-CD1 4.41Å; L568-L587 HydrophobicContact CB-CD2 3.99Å; L568-L587 HydrophobicContact CB-CG 4.09Å; L568-L587 HydrophobicContact CD1-CD2 4.36Å; I569-L587 HydrophobicContact CD1-CD2 4.42Å; I569-L587 HydrophobicContact CG1-CD1 3.95Å; I569-L587 HydrophobicContact CG1-CD2 4.01Å; L572-L587 HydrophobicContact CD1-CD1 4.03Å; L572-L587 HydrophobicContact CD2-CD1 4.17Å; L572-L587 HydrophobicContact CG-CD1 4.31Å; A583-L587 WeakPolarHBondContact O-CB 3.44Å; A583-L587 VanDerWaalsContact O-CG 3.26Å; A583-L587 WeakPolarHBondContact O-CG 3.2Å; A583-L587 PolarHBondContact O-N 2.87Å; C584-L587 PolarHBondContact O-N 3.43Å; L587-S591 WeakPolarHBondContact O-CB 3.5Å; L587-S591 PolarHBondContact O-N 3.49Å; L587-S591 PolarHBondContact O-OG 2.96Å; L587-V603 HydrophobicContact CD2-CG2 3.89Å; L587-I612 HydrophobicContact CD1-CD1 4.37Å
588	K	97.6	Very high	94.9	Very high	44 Å²	44	39.3 Å²	39.3	19%	0.191	19%	0.187	C	C	.	.	H	α-helix	trans	-58.2	-50.5	168.5	172.5	-161.4	71	-170.1	0	111.3	C584 A585 C586 S591 F592 E627 A630 A631 N634	C584-K588 WeakPolarHBondContact O-CB 3.13Å; C584-K588 PolarHBondContact O-N 3.44Å; A585-K588 WeakPolarHBondContact O-CB 3.5Å; C586-K588 VanDerWaalsContact C-N 3.31Å; C586-K588 PolarHBondContact O-N 3.18Å; K588-S591 PolarHBondContact O-N 2.9Å; K588-S591 PolarHBondContact O-OG 2.71Å; K588-S591 VanDerWaalsContact O-OG 3.13Å; K588-F592 PolarHBondContact O-N 3.32Å; K588-F592 VanDerWaalsContact O-N 3.17Å; K588-E627 WeakPolarHBondContact CD-OE2 3.4Å; K588-E627 WeakPolarHBondContact CE-OE2 3.27Å; K588-E627 IonicContact NZ-OE1 2.7Å; K588-E627 PolarHBondContact NZ-OE1 3.16Å; K588-E627 IonicContact NZ-OE2 3.25Å; K588-E627 PolarHBondContact NZ-OE2 2.78Å; K588-A630 HydrophobicContact CD-CB 3.54Å; K588-A630 HydrophobicContact CG-CB 3.91Å; K588-A631 HydrophobicContact CB-CB 4.11Å; K588-N634 PolarHBondContact O-ND2 3.02Å
589	N	97.8	Very high	94.9	Very high	9 Å²	9	31.4 Å²	31.4	5%	0.048	16%	0.157	C	C	.	.	H	α-helix	trans	-63	-45.4	-179.6	-68.1	-0.8	0	0	0	111.8	Q546 K556 A585 C586 S591 F592	Q546-N589 PolarHBondContact O-ND2 3.09Å; K556-N589 WeakPolarHBondContact CE-O 3.17Å; K556-N589 PolarHBondContact NZ-O 3.25Å; A585-N589 PolarHBondContact O-N 2.76Å; A585-N589 VanDerWaalsContact O-N 3.1Å; A585-N589 PolarHBondContact O-OD1 3.02Å; C586-N589 PolarHBondContact O-N 2.98Å; C586-N589 VanDerWaalsContact O-N 3.09Å; N589-S591 VanDerWaalsContact C-N 3.28Å; N589-S591 PolarHBondContact O-N 3.5Å; N589-F592 WeakPolarHBondContact O-CB 3.4Å; N589-F592 PolarHBondContact O-N 3.26Å
590	L	97.1	Very high	94.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.3	-32.4	177.8	-73.4	161.2	0	0	0	113.4	T549 K556 T559 I565 L568 C586 N596 N599	T549-L590 HydrophobicContact CG2-CD2 3.84Å; T549-L590 HydrophobicContact CG2-CG 4.13Å; K556-L590 HydrophobicContact CB-CD2 3.86Å; K556-L590 HydrophobicContact CG-CD2 4.02Å; T559-L590 HydrophobicContact CG2-CD1 4.06Å; T559-L590 HydrophobicContact CG2-CD2 3.8Å; I565-L590 HydrophobicContact CG1-CD1 4.06Å; L568-L590 HydrophobicContact CD1-CD1 3.42Å; L568-L590 VanDerWaalsContact CD1-CD1 3.42Å; C586-L590 WeakPolarHBondContact O-CB 3.38Å; C586-L590 WeakPolarHBondContact O-CD1 3.48Å; C586-L590 VanDerWaalsContact O-CG 3.31Å; C586-L590 WeakPolarHBondContact O-CG 3.48Å; C586-L590 PolarHBondContact O-N 2.83Å; L590-N596 WeakPolarHBondContact O-CB 3.39Å; L590-N599 VanDerWaalsContact O-CB 3.26Å; L590-N599 WeakPolarHBondContact O-CB 3.23Å; L590-N599 PolarHBondContact O-ND2 2.95Å
591	S	96.4	Very high	94.7	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.007	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	0.2	177.9	56.2	0	0	0	0	114.4	L587 K588 N589 K600 N634	L587-S591 WeakPolarHBondContact O-CB 3.5Å; L587-S591 PolarHBondContact O-N 3.49Å; L587-S591 PolarHBondContact O-OG 2.96Å; K588-S591 PolarHBondContact O-N 2.9Å; K588-S591 PolarHBondContact O-OG 2.71Å; K588-S591 VanDerWaalsContact O-OG 3.13Å; N589-S591 VanDerWaalsContact C-N 3.28Å; N589-S591 PolarHBondContact O-N 3.5Å; S591-K600 WeakPolarHBondContact O-CE 3.19Å; S591-N634 WeakPolarHBondContact OG-CB 3.3Å
592	F	94.4	Very high	94.7	Very high	117 Å²	117	31.1 Å²	31.1	51%	0.513	16%	0.161	S	C	.	.			trans	-82	131.7	179.8	-174.6	-96.2	0	0	0	111.9	K556 K588 N589 N596	K556-F592 PolarHBondContact NZ-O 3.25Å; K588-F592 PolarHBondContact O-N 3.32Å; K588-F592 VanDerWaalsContact O-N 3.17Å; N589-F592 WeakPolarHBondContact O-CB 3.4Å; N589-F592 PolarHBondContact O-N 3.26Å; F592-N596 PolarHBondContact O-ND2 3.33Å
593	G	86.7	Confident	94.6	Very high	22 Å²	22	30 Å²	30	23%	0.227	16%	0.155	C	C	.	.	S	Bend	trans	105.1	171.8	-173.3	0	0	0	0	0	112.7	E595 K600	G593-E595 VanDerWaalsContact CA-OE2 3.26Å; G593-E595 WeakPolarHBondContact CA-OE2 3.3Å; G593-K600 VanDerWaalsContact O-CE 3.26Å; G593-K600 WeakPolarHBondContact O-CE 3.32Å; G593-K600 PolarHBondContact O-NZ 3.29Å
594	K	85.5	Confident	94.4	Very high	139 Å²	139	32.9 Å²	32.9	60%	0.604	17%	0.169	S	C	*	.	S	Bend	trans	-100	-33.8	171.3	-170.9	-168.4	174.1	-165.6	0	111	N596 D597	K594-N596 PolarHBondContact O-N 3.27Å; K594-N596 VanDerWaalsContact O-N 3.12Å; K594-D597 WeakPolarHBondContact CG-OD2 3.43Å; K594-D597 VanDerWaalsContact O-CB 3.27Å; K594-D597 WeakPolarHBondContact O-CB 3.48Å; K594-D597 PolarHBondContact O-N 3.46Å
595	E	88.8	Confident	94.2	Very high	119 Å²	119	39.2 Å²	39.2	56%	0.556	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-26.1	167.4	72.7	-70.4	178	0	0	112.7	N553 G593	N553-E595 VanDerWaalsContact ND2-CG 3.29Å; N553-E595 WeakPolarHBondContact ND2-CG 3.3Å; N553-E595 PolarHBondContact ND2-OE1 3.4Å; G593-E595 VanDerWaalsContact CA-OE2 3.26Å; G593-E595 WeakPolarHBondContact CA-OE2 3.3Å
596	N	90.9	Very high	94	Very high	7 Å²	7	40.5 Å²	40.5	4%	0.037	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	15.8	174.6	-69.4	-73	0	0	0	114.2	N553 K556 L590 F592 K594 A598 N599 K600	N553-N596 PolarHBondContact OD1-ND2 2.96Å; K556-N596 WeakPolarHBondContact CD-OD1 3.48Å; K556-N596 PolarHBondContact NZ-ND2 3Å; L590-N596 WeakPolarHBondContact O-CB 3.39Å; F592-N596 PolarHBondContact O-ND2 3.33Å; K594-N596 PolarHBondContact O-N 3.27Å; K594-N596 VanDerWaalsContact O-N 3.12Å; N596-A598 PolarHBondContact O-N 3.39Å; N596-N599 WeakPolarHBondContact O-CB 3.43Å; N596-N599 PolarHBondContact O-N 3.17Å; N596-N599 PolarHBondContact OD1-ND2 2.88Å; N596-K600 PolarHBondContact O-N 3.14Å
597	D	92.1	Very high	93.9	Very high	40 Å²	40	43.2 Å²	43.2	21%	0.214	22%	0.224	C	C	.	.	H	α-helix	trans	-57.5	-32.7	177.7	-80.9	-11.2	0	0	0	112.5	K594 N599 K600 L601	K594-D597 WeakPolarHBondContact CG-OD2 3.43Å; K594-D597 VanDerWaalsContact O-CB 3.27Å; K594-D597 WeakPolarHBondContact O-CB 3.48Å; K594-D597 PolarHBondContact O-N 3.46Å; D597-N599 VanDerWaalsContact C-N 3.29Å; D597-N599 PolarHBondContact O-N 3.28Å; D597-K600 WeakPolarHBondContact O-CB 3.27Å; D597-K600 PolarHBondContact O-N 3.35Å; D597-K600 VanDerWaalsContact O-N 3.1Å; D597-K600 WeakPolarHBondContact OD1-CD 3.49Å; D597-K600 WeakPolarHBondContact OD1-CE 3.35Å; D597-K600 IonicContact OD1-NZ 2.69Å; D597-K600 PolarHBondContact OD1-NZ 2.94Å; D597-L601 PolarHBondContact O-N 3.36Å
598	A	94.2	Very high	93.8	Very high	43 Å²	43	43.2 Å²	43.2	36%	0.355	22%	0.224	S	C	.	.	H	α-helix	trans	-66.5	-27.2	174.1	0	0	0	0	0	113.5	N596 A602	N596-A598 PolarHBondContact O-N 3.39Å; A598-A602 PolarHBondContact O-N 2.9Å; A598-A602 VanDerWaalsContact O-N 3.1Å
599	N	96.3	Very high	93.7	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-74.5	-35	170.9	-61.3	-22.8	0	0	0	110.9	R560 I565 L590 N596 D597 L601 A602 V603	R560-N599 WeakPolarHBondContact CB-OD1 3.5Å; R560-N599 WeakPolarHBondContact CD-OD1 3.49Å; I565-N599 HydrophobicContact CD1-CB 4.03Å; L590-N599 VanDerWaalsContact O-CB 3.26Å; L590-N599 WeakPolarHBondContact O-CB 3.23Å; L590-N599 PolarHBondContact O-ND2 2.95Å; N596-N599 WeakPolarHBondContact O-CB 3.43Å; N596-N599 PolarHBondContact O-N 3.17Å; N596-N599 PolarHBondContact OD1-ND2 2.88Å; D597-N599 VanDerWaalsContact C-N 3.29Å; D597-N599 PolarHBondContact O-N 3.28Å; N599-L601 VanDerWaalsContact C-N 3.31Å; N599-A602 PolarHBondContact O-N 3.19Å; N599-V603 VanDerWaalsContact O-CG2 3.31Å; N599-V603 WeakPolarHBondContact O-CG2 3.37Å; N599-V603 PolarHBondContact O-N 2.86Å
600	K	96.4	Very high	93.7	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.009	23%	0.234	C	C	.	.	H	α-helix	trans	-63.3	-40.3	173.7	-56.3	175.9	-168.9	159.7	0	110.8	S591 G593 N596 D597 V603 M604 L635 S637 A638 L641	S591-K600 WeakPolarHBondContact O-CE 3.19Å; G593-K600 VanDerWaalsContact O-CE 3.26Å; G593-K600 WeakPolarHBondContact O-CE 3.32Å; G593-K600 PolarHBondContact O-NZ 3.29Å; N596-K600 PolarHBondContact O-N 3.14Å; D597-K600 WeakPolarHBondContact O-CB 3.27Å; D597-K600 PolarHBondContact O-N 3.35Å; D597-K600 VanDerWaalsContact O-N 3.1Å; D597-K600 WeakPolarHBondContact OD1-CD 3.49Å; D597-K600 WeakPolarHBondContact OD1-CE 3.35Å; D597-K600 IonicContact OD1-NZ 2.69Å; D597-K600 PolarHBondContact OD1-NZ 2.94Å; K600-V603 PolarHBondContact O-N 3.38Å; K600-M604 PolarHBondContact O-N 3.28Å; K600-M604 VanDerWaalsContact O-N 3.07Å; K600-L635 HydrophobicContact CB-CD2 3.92Å; K600-L635 HydrophobicContact CG-CD2 4.09Å; K600-S637 PolarHBondContact NZ-OG 2.8Å; K600-A638 HydrophobicContact CD-CB 3.76Å; K600-L641 HydrophobicContact CB-CD1 4.04Å; K600-L641 HydrophobicContact CB-CD2 4.31Å
601	L	92.9	Very high	93.7	Very high	67 Å²	67	47.1 Å²	47.1	35%	0.351	24%	0.238	S	C	.	.	H	α-helix	trans	-61.2	-50.4	173.1	-173	66.6	0	0	0	111.5	D597 N599 V603 M604 E605	D597-L601 PolarHBondContact O-N 3.36Å; N599-L601 VanDerWaalsContact C-N 3.31Å; L601-V603 PolarHBondContact O-N 3.44Å; L601-M604 HydrophobicContact CD1-CE 3.84Å; L601-M604 CarbonylContact O-C 3.6Å; L601-M604 WeakPolarHBondContact O-CA 3.41Å; L601-M604 VanDerWaalsContact O-CB 3.29Å; L601-M604 WeakPolarHBondContact O-CB 3.25Å; L601-M604 PolarHBondContact O-N 2.8Å; L601-E605 HydrophobicContact CG-CG 4.44Å; L601-E605 WeakPolarHBondContact O-CG 3.18Å; L601-E605 PolarHBondContact O-N 3.05Å
602	A	96.1	Very high	93.8	Very high	13 Å²	13	47 Å²	47	11%	0.107	24%	0.238	C	C	.	.	H	α-helix	trans	-59.8	-29.7	176.2	0	0	0	0	0	113.6	R560 I565 A598 N599 A606	R560-A602 HydrophobicContact CG-CB 4.21Å; I565-A602 HydrophobicContact CD1-CB 3.89Å; I565-A602 HydrophobicContact CG2-CB 4.29Å; A598-A602 PolarHBondContact O-N 2.9Å; A598-A602 VanDerWaalsContact O-N 3.1Å; N599-A602 PolarHBondContact O-N 3.19Å; A602-A606 WeakPolarHBondContact O-CB 3.02Å; A602-A606 PolarHBondContact O-N 3.1Å
603	V	96.1	Very high	93.9	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-71.7	-31.4	171.4	171.4	0	0	0	0	112.1	I565 I569 L587 N599 K600 L601 G608 I612 L635	I565-V603 HydrophobicContact CG2-CB 4.41Å; I565-V603 HydrophobicContact CG2-CG2 3.62Å; I569-V603 HydrophobicContact CD1-CB 4.43Å; I569-V603 HydrophobicContact CD1-CG1 4.24Å; I569-V603 HydrophobicContact CD1-CG2 4.44Å; L587-V603 HydrophobicContact CD2-CG2 3.89Å; N599-V603 VanDerWaalsContact O-CG2 3.31Å; N599-V603 WeakPolarHBondContact O-CG2 3.37Å; N599-V603 PolarHBondContact O-N 2.86Å; K600-V603 PolarHBondContact O-N 3.38Å; L601-V603 PolarHBondContact O-N 3.44Å; V603-G608 WeakPolarHBondContact O-CA 3.36Å; V603-G608 PolarHBondContact O-N 3.31Å; V603-I612 HydrophobicContact CG1-CD1 4.39Å; V603-L635 HydrophobicContact CB-CD2 3.94Å; V603-L635 HydrophobicContact CG1-CD1 3.85Å; V603-L635 HydrophobicContact CG1-CD2 3.75Å; V603-L635 HydrophobicContact CG1-CG 4.48Å; V603-L635 HydrophobicContact CG2-CD2 4.48Å
604	M	93.5	Very high	94.3	Very high	61 Å²	61	43.8 Å²	43.8	30%	0.3	22%	0.218	S	C	.	.	H	α-helix	trans	-73.1	-48.3	174.7	-168.6	-176.4	81.2	0	0	111.6	K600 L601 A606 D607 L641 V644	K600-M604 PolarHBondContact O-N 3.28Å; K600-M604 VanDerWaalsContact O-N 3.07Å; L601-M604 HydrophobicContact CD1-CE 3.84Å; L601-M604 CarbonylContact O-C 3.6Å; L601-M604 WeakPolarHBondContact O-CA 3.41Å; L601-M604 VanDerWaalsContact O-CB 3.29Å; L601-M604 WeakPolarHBondContact O-CB 3.25Å; L601-M604 PolarHBondContact O-N 2.8Å; M604-A606 PolarHBondContact O-N 3.45Å; M604-D607 PolarHBondContact O-N 2.86Å; M604-L641 HydrophobicContact CB-CD2 4.35Å; M604-L641 HydrophobicContact CB-CG 4.27Å; M604-L641 HydrophobicContact CG-CG 4.42Å; M604-L641 HydrophobicContact SD-CD1 4.4Å; M604-L641 HydrophobicContact SD-CG 4.07Å; M604-V644 HydrophobicContact SD-CG2 4.21Å
605	E	92.8	Very high	94.8	Very high	134 Å²	134	37.4 Å²	37.4	63%	0.626	19%	0.191	S	C	*	.	H	α-helix	trans	-56.1	-37.4	177.8	-68.9	170.2	167.2	0	0	112.4	L601 D607	L601-E605 HydrophobicContact CG-CG 4.44Å; L601-E605 WeakPolarHBondContact O-CG 3.18Å; L601-E605 PolarHBondContact O-N 3.05Å; E605-D607 VanDerWaalsContact C-N 3.26Å; E605-D607 PolarHBondContact O-N 3.45Å
606	A	93.5	Very high	95.1	Very high	27 Å²	27	32 Å²	32	22%	0.223	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	18.9	177.9	0	0	0	0	0	114.3	P566 I569 A602 M604 G608	P566-A606 HydrophobicContact CB-CB 4.34Å; P566-A606 HydrophobicContact CG-CB 4.16Å; I569-A606 HydrophobicContact CD1-CB 3.55Å; I569-A606 WeakPolarHBondContact CG2-O 3.19Å; A602-A606 WeakPolarHBondContact O-CB 3.02Å; A602-A606 PolarHBondContact O-N 3.1Å; M604-A606 PolarHBondContact O-N 3.45Å; A606-G608 PolarHBondContact O-N 3.49Å; A606-G608 VanDerWaalsContact O-N 3.13Å
607	D	94.4	Very high	95.3	Very high	57 Å²	57	37 Å²	37	31%	0.305	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	20.4	179.4	-176.7	45.4	0	0	0	113.7	M604 E605 V609 R610 L611	M604-D607 PolarHBondContact O-N 2.86Å; E605-D607 VanDerWaalsContact C-N 3.26Å; E605-D607 PolarHBondContact O-N 3.45Å; D607-V609 PolarHBondContact O-N 3.39Å; D607-R610 PolarHBondContact O-N 2.98Å; D607-R610 VanDerWaalsContact OD1-CB 3.3Å; D607-R610 WeakPolarHBondContact OD1-CB 3.39Å; D607-R610 WeakPolarHBondContact OD1-CD 3.43Å; D607-R610 IonicContact OD1-CZ 2.68Å; D607-R610 IonicContact OD1-NE 3.21Å; D607-R610 PolarHBondContact OD1-NE 3.43Å; D607-R610 IonicContact OD1-NH2 2.76Å; D607-R610 IonicContact OD2-CZ 2.6Å; D607-R610 VanDerWaalsContact OD2-CZ 3.32Å; D607-R610 IonicContact OD2-NE 2.9Å; D607-R610 PolarHBondContact OD2-NE 2.74Å; D607-R610 VanDerWaalsContact OD2-NE 3.16Å; D607-R610 IonicContact OD2-NH2 2.7Å; D607-R610 PolarHBondContact OD2-NH2 3.46Å; D607-L611 HydrophobicContact CB-CD1 4.4Å; D607-L611 WeakPolarHBondContact O-CG 3.33Å; D607-L611 PolarHBondContact O-N 2.91Å
608	G	95.8	Very high	95.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.1	-38.3	-172.7	0	0	0	0	0	113.7	V603 A606 R610 L611 I612	V603-G608 WeakPolarHBondContact O-CA 3.36Å; V603-G608 PolarHBondContact O-N 3.31Å; A606-G608 PolarHBondContact O-N 3.49Å; A606-G608 VanDerWaalsContact O-N 3.13Å; G608-R610 VanDerWaalsContact C-N 3.33Å; G608-R610 PolarHBondContact O-N 2.87Å; G608-L611 PolarHBondContact O-N 3.45Å; G608-I612 WeakPolarHBondContact O-CB 3.41Å; G608-I612 WeakPolarHBondContact O-CD1 3.39Å; G608-I612 WeakPolarHBondContact O-CG1 3.1Å; G608-I612 PolarHBondContact O-N 3.4Å
609	V	96.9	Very high	95.3	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.012	18%	0.18	C	C	.	.	H	α-helix	trans	-56.9	-47.2	178.6	174.9	0	0	0	0	111.3	D607 A613 L632 L641 V644 I645	D607-V609 PolarHBondContact O-N 3.39Å; V609-A613 WeakPolarHBondContact O-CB 3.38Å; V609-A613 PolarHBondContact O-N 3.03Å; V609-L632 HydrophobicContact CG1-CD2 4.35Å; V609-L641 HydrophobicContact CG2-CD2 3.85Å; V609-V644 HydrophobicContact CB-CG1 4.02Å; V609-V644 HydrophobicContact CG1-CB 4.32Å; V609-V644 HydrophobicContact CG1-CG1 3.81Å; V609-I645 HydrophobicContact CG1-CB 4.44Å; V609-I645 HydrophobicContact CG1-CG1 3.58Å; V609-I645 HydrophobicContact CG2-CG1 4.49Å
610	R	96.5	Very high	95	Very high	119 Å²	119	45.5 Å²	45.5	45%	0.449	22%	0.22	S	C	.	.	H	α-helix	trans	-69.3	-37.3	-179.7	-165.6	-173	66.2	87.1	1.3	111.7	D607 G608 A613 E614	D607-R610 PolarHBondContact O-N 2.98Å; D607-R610 VanDerWaalsContact OD1-CB 3.3Å; D607-R610 WeakPolarHBondContact OD1-CB 3.39Å; D607-R610 WeakPolarHBondContact OD1-CD 3.43Å; D607-R610 IonicContact OD1-CZ 2.68Å; D607-R610 IonicContact OD1-NE 3.21Å; D607-R610 PolarHBondContact OD1-NE 3.43Å; D607-R610 IonicContact OD1-NH2 2.76Å; D607-R610 IonicContact OD2-CZ 2.6Å; D607-R610 VanDerWaalsContact OD2-CZ 3.32Å; D607-R610 IonicContact OD2-NE 2.9Å; D607-R610 PolarHBondContact OD2-NE 2.74Å; D607-R610 VanDerWaalsContact OD2-NE 3.16Å; D607-R610 IonicContact OD2-NH2 2.7Å; D607-R610 PolarHBondContact OD2-NH2 3.46Å; G608-R610 VanDerWaalsContact C-N 3.33Å; G608-R610 PolarHBondContact O-N 2.87Å; R610-A613 WeakPolarHBondContact O-CB 3.37Å; R610-A613 PolarHBondContact O-N 2.91Å; R610-E614 PolarHBondContact O-N 3.32Å
611	L	97.4	Very high	94.8	Very high	14 Å²	14	48.1 Å²	48.1	7%	0.073	23%	0.234	C	C	.	.	H	α-helix	trans	-74.2	-35.5	178.8	-69.4	166.3	0	0	0	113	I569 L572 R573 D607 G608 A613 E614 V615	I569-L611 HydrophobicContact CG2-CB 4.39Å; I569-L611 HydrophobicContact CG2-CD1 3.43Å; I569-L611 VanDerWaalsContact CG2-CD1 3.43Å; L572-L611 HydrophobicContact CD1-CB 4.03Å; R573-L611 HydrophobicContact CG-CD2 4.44Å; D607-L611 HydrophobicContact CB-CD1 4.4Å; D607-L611 WeakPolarHBondContact O-CG 3.33Å; D607-L611 PolarHBondContact O-N 2.91Å; G608-L611 PolarHBondContact O-N 3.45Å; L611-A613 VanDerWaalsContact C-N 3.33Å; L611-E614 PolarHBondContact O-N 3.34Å; L611-V615 WeakPolarHBondContact O-CG2 3.44Å; L611-V615 PolarHBondContact O-N 3.38Å
612	I	98.2	Very high	94.7	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65.8	-39.6	170.9	-63.4	161.9	0	0	0	110	L572 L587 V603 G608 V615 L616 A628 A631 L632 L635	L572-I612 HydrophobicContact CD1-CG1 3.64Å; L587-I612 HydrophobicContact CD1-CD1 4.37Å; V603-I612 HydrophobicContact CG1-CD1 4.39Å; G608-I612 WeakPolarHBondContact O-CB 3.41Å; G608-I612 WeakPolarHBondContact O-CD1 3.39Å; G608-I612 WeakPolarHBondContact O-CG1 3.1Å; G608-I612 PolarHBondContact O-N 3.4Å; I612-V615 PolarHBondContact O-N 2.91Å; I612-L616 PolarHBondContact O-N 3.43Å; I612-A628 HydrophobicContact CG2-CB 3.81Å; I612-A628 WeakPolarHBondContact CG2-O 3.43Å; I612-A631 HydrophobicContact CD1-CB 4.26Å; I612-L632 HydrophobicContact CB-CD2 4.24Å; I612-L632 HydrophobicContact CG2-CD1 4.4Å; I612-L632 HydrophobicContact CG2-CD2 4Å; I612-L632 HydrophobicContact CG2-CG 3.75Å; I612-L635 HydrophobicContact CD1-CD1 3.77Å
613	A	96.9	Very high	94.6	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-40	172.2	0	0	0	0	0	112.1	V609 R610 L611 L616 R617 S648 A649 I652	V609-A613 WeakPolarHBondContact O-CB 3.38Å; V609-A613 PolarHBondContact O-N 3.03Å; R610-A613 WeakPolarHBondContact O-CB 3.37Å; R610-A613 PolarHBondContact O-N 2.91Å; L611-A613 VanDerWaalsContact C-N 3.33Å; A613-L616 WeakPolarHBondContact O-CB 3.4Å; A613-L616 PolarHBondContact O-N 3.18Å; A613-R617 PolarHBondContact O-N 3.08Å; A613-S648 WeakPolarHBondContact CB-O 3.34Å; A613-A649 HydrophobicContact CB-CB 4Å; A613-I652 HydrophobicContact CB-CD1 3.81Å; A613-I652 WeakPolarHBondContact O-CD1 3.18Å
614	E	95.8	Very high	94.5	Very high	70 Å²	70	48.8 Å²	48.8	33%	0.327	25%	0.248	S	C	.	.	H	α-helix	trans	-66.9	-37.7	175.4	-169.9	58.2	-157.9	0	0	112.7	R610 L611 L616 R617 T618	R610-E614 PolarHBondContact O-N 3.32Å; L611-E614 PolarHBondContact O-N 3.34Å; E614-L616 VanDerWaalsContact C-N 3.34Å; E614-L616 PolarHBondContact O-N 2.86Å; E614-R617 WeakPolarHBondContact O-CB 3.13Å; E614-R617 PolarHBondContact O-N 2.86Å; E614-R617 WeakPolarHBondContact OE2-CD 3.33Å; E614-R617 IonicContact OE2-CZ 3.85Å; E614-R617 IonicContact OE2-NE 2.73Å; E614-R617 IonicContact OE2-NH1 2.69Å; E614-R617 PolarHBondContact OE2-NH1 2.91Å; E614-T618 HydrophobicContact CG-CG2 4.31Å; E614-T618 WeakPolarHBondContact O-CB 3.38Å; E614-T618 WeakPolarHBondContact O-CG2 3.45Å; E614-T618 PolarHBondContact O-N 2.91Å; E614-T618 PolarHBondContact O-OG1 2.95Å; E614-T618 WeakPolarHBondContact OE1-CG2 3.43Å
615	V	95.9	Very high	94.6	Very high	5 Å²	5	47.1 Å²	47.1	3%	0.03	24%	0.239	C	C	.	.	H	α-helix	trans	-60.5	-43.6	170.5	168.8	0	0	0	0	110.9	L572 L611 I612 R617 T618 T619 V624 A628	L572-V615 HydrophobicContact CB-CG2 3.87Å; L572-V615 HydrophobicContact CD2-CG2 4.41Å; L572-V615 WeakPolarHBondContact O-CG2 3.46Å; L611-V615 WeakPolarHBondContact O-CG2 3.44Å; L611-V615 PolarHBondContact O-N 3.38Å; I612-V615 PolarHBondContact O-N 2.91Å; V615-R617 VanDerWaalsContact C-N 3.32Å; V615-R617 PolarHBondContact O-N 3.13Å; V615-T618 PolarHBondContact O-N 3.13Å; V615-T619 HydrophobicContact CG1-CG2 4.36Å; V615-T619 WeakPolarHBondContact O-CB 3.43Å; V615-T619 WeakPolarHBondContact O-CG2 3.46Å; V615-T619 PolarHBondContact O-N 3.43Å; V615-V624 HydrophobicContact CG1-CG1 3.42Å; V615-V624 VanDerWaalsContact CG1-CG1 3.42Å; V615-A628 HydrophobicContact CG1-CB 4.41Å
616	L	95.3	Very high	94.7	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-37.9	174.3	-79.9	161	0	0	0	112.7	I612 A613 E614 K625 A628 A629 L632 I652 L653 Q656 L677	I612-L616 PolarHBondContact O-N 3.43Å; A613-L616 WeakPolarHBondContact O-CB 3.4Å; A613-L616 PolarHBondContact O-N 3.18Å; E614-L616 VanDerWaalsContact C-N 3.34Å; E614-L616 PolarHBondContact O-N 2.86Å; L616-K625 HydrophobicContact CD2-CB 3.9Å; L616-K625 HydrophobicContact CD2-CD 4.44Å; L616-K625 HydrophobicContact CD2-CG 4.21Å; L616-K625 WeakPolarHBondContact O-CE 3.46Å; L616-K625 PolarHBondContact O-NZ 2.94Å; L616-A628 HydrophobicContact CD1-CB 4.17Å; L616-A628 HydrophobicContact CD2-CB 3.97Å; L616-A628 HydrophobicContact CG-CB 3.7Å; L616-A629 HydrophobicContact CD2-CB 4.32Å; L616-L632 HydrophobicContact CD1-CD1 3.45Å; L616-L632 VanDerWaalsContact CD1-CD1 3.45Å; L616-L632 HydrophobicContact CD1-CG 4.34Å; L616-I652 HydrophobicContact CB-CG2 4.28Å; L616-L653 HydrophobicContact CD1-CD2 3.95Å; L616-L653 HydrophobicContact CD2-CD2 4.46Å; L616-Q656 PolarHBondContact O-OE1 3.05Å; L616-Q656 VanDerWaalsContact O-OE1 3.14Å; L616-L677 HydrophobicContact CD2-CD1 4.48Å
617	R	94.8	Very high	94.8	Very high	112 Å²	112	43.9 Å²	43.9	42%	0.423	22%	0.219	S	C	.	.	H	α-helix	trans	-66.1	-44.7	177.3	-178.8	178.4	-75.8	105.1	0.1	112.2	A613 E614 V615 I652 Q656	A613-R617 PolarHBondContact O-N 3.08Å; E614-R617 WeakPolarHBondContact O-CB 3.13Å; E614-R617 PolarHBondContact O-N 2.86Å; E614-R617 WeakPolarHBondContact OE2-CD 3.33Å; E614-R617 IonicContact OE2-CZ 3.85Å; E614-R617 IonicContact OE2-NE 2.73Å; E614-R617 IonicContact OE2-NH1 2.69Å; E614-R617 PolarHBondContact OE2-NH1 2.91Å; V615-R617 VanDerWaalsContact C-N 3.32Å; V615-R617 PolarHBondContact O-N 3.13Å; R617-I652 HydrophobicContact CB-CD1 4.22Å; R617-I652 HydrophobicContact CB-CG2 4.28Å; R617-Q656 PolarHBondContact O-NE2 2.82Å; R617-Q656 VanDerWaalsContact O-NE2 3.14Å
618	T	93.4	Very high	95	Very high	69 Å²	69	41.2 Å²	41.2	42%	0.423	21%	0.205	S	C	.	.	H	α-helix	trans	-97.9	-34.6	-164.9	54.2	0	0	0	0	115.1	E614 V615	E614-T618 HydrophobicContact CG-CG2 4.31Å; E614-T618 WeakPolarHBondContact O-CB 3.38Å; E614-T618 WeakPolarHBondContact O-CG2 3.45Å; E614-T618 PolarHBondContact O-N 2.91Å; E614-T618 PolarHBondContact O-OG1 2.95Å; E614-T618 WeakPolarHBondContact OE1-CG2 3.43Å; V615-T618 PolarHBondContact O-N 3.13Å
619	T	93	Very high	95.1	Very high	12 Å²	12	41.2 Å²	41.2	7%	0.074	21%	0.205	C	C	.	.			trans	-70.8	151.8	-172.9	-159.9	0	0	0	0	112.4	V615 D621 V624 K625	V615-T619 HydrophobicContact CG1-CG2 4.36Å; V615-T619 WeakPolarHBondContact O-CB 3.43Å; V615-T619 WeakPolarHBondContact O-CG2 3.46Å; V615-T619 PolarHBondContact O-N 3.43Å; T619-D621 PolarHBondContact OG1-N 3.28Å; T619-V624 HydrophobicContact CG2-CB 4Å; T619-V624 HydrophobicContact CG2-CG1 3.92Å; T619-K625 HydrophobicContact CG2-CD 4.27Å; T619-K625 HydrophobicContact CG2-CG 3.45Å; T619-K625 VanDerWaalsContact CG2-CG 3.45Å; T619-K625 WeakPolarHBondContact O-CE 3.47Å; T619-K625 PolarHBondContact O-NZ 3.38Å
620	H	90.1	Very high	95.1	Very high	186 Å²	186	41.6 Å²	41.6	86%	0.861	21%	0.209	S	C	*	.			trans	-106.6	-7.7	171	-59.4	-31.9	0	0	0	112.5	A622	H620-A622 PolarHBondContact O-N 3.29Å
621	D	91.9	Very high	95.2	Very high	56 Å²	56	36 Å²	36	30%	0.299	19%	0.187	S	C	.	.			trans	-78.9	113.6	176.2	-172.1	-56.1	0	0	0	110.1	P577 T619 S623 V624 K625	P577-D621 HydrophobicContact CB-CB 4.13Å; T619-D621 PolarHBondContact OG1-N 3.28Å; D621-S623 PolarHBondContact O-N 2.83Å; D621-S623 VanDerWaalsContact OD1-CA 3.31Å; D621-S623 WeakPolarHBondContact OD1-CA 3.49Å; D621-S623 WeakPolarHBondContact OD1-CB 3.38Å; D621-S623 PolarHBondContact OD1-N 2.93Å; D621-S623 PolarHBondContact OD1-OG 2.79Å; D621-V624 HydrophobicContact CB-CB 4.04Å; D621-V624 HydrophobicContact CB-CG2 3.67Å; D621-V624 PolarHBondContact O-N 3.03Å; D621-V624 PolarHBondContact OD1-N 2.76Å; D621-K625 PolarHBondContact O-N 3.28Å; D621-K625 VanDerWaalsContact O-N 3.11Å
622	A	90.6	Very high	95.2	Very high	66 Å²	66	35.3 Å²	35.3	55%	0.545	18%	0.184	S	C	.	.	H	α-helix	trans	-58.6	-33.3	-179.6	0	0	0	0	0	112.7	H620 K625 E626	H620-A622 PolarHBondContact O-N 3.29Å; A622-K625 PolarHBondContact O-N 3.4Å; A622-E626 WeakPolarHBondContact O-CG 3.46Å; A622-E626 PolarHBondContact O-N 2.92Å
623	S	92.8	Very high	95.2	Very high	29 Å²	29	38 Å²	38	20%	0.203	19%	0.194	C	C	.	.	H	α-helix	trans	-81.8	-22.7	-178.2	82.4	0	0	0	0	113.3	K581 D621 E627	K581-S623 WeakPolarHBondContact CD-OG 3.43Å; K581-S623 WeakPolarHBondContact CE-OG 3.39Å; K581-S623 VanDerWaalsContact NZ-CB 3.25Å; K581-S623 PolarHBondContact NZ-OG 2.88Å; D621-S623 PolarHBondContact O-N 2.83Å; D621-S623 VanDerWaalsContact OD1-CA 3.31Å; D621-S623 WeakPolarHBondContact OD1-CA 3.49Å; D621-S623 WeakPolarHBondContact OD1-CB 3.38Å; D621-S623 PolarHBondContact OD1-N 2.93Å; D621-S623 PolarHBondContact OD1-OG 2.79Å; S623-E627 WeakPolarHBondContact O-CG 3.29Å; S623-E627 PolarHBondContact O-N 2.85Å
624	V	95.6	Very high	95.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-68.1	-42.5	163.4	179.1	0	0	0	0	110	P577 Q580 K581 V615 T619 D621 E626 E627 A628	P577-V624 HydrophobicContact CB-CG2 4.1Å; P577-V624 VanDerWaalsContact O-CG2 3.26Å; P577-V624 WeakPolarHBondContact O-CG2 3.28Å; Q580-V624 HydrophobicContact CB-CG1 3.88Å; Q580-V624 HydrophobicContact CB-CG2 4.29Å; K581-V624 HydrophobicContact CB-CG2 3.95Å; V615-V624 HydrophobicContact CG1-CG1 3.42Å; V615-V624 VanDerWaalsContact CG1-CG1 3.42Å; T619-V624 HydrophobicContact CG2-CB 4Å; T619-V624 HydrophobicContact CG2-CG1 3.92Å; D621-V624 HydrophobicContact CB-CB 4.04Å; D621-V624 HydrophobicContact CB-CG2 3.67Å; D621-V624 PolarHBondContact O-N 3.03Å; D621-V624 PolarHBondContact OD1-N 2.76Å; V624-E626 PolarHBondContact O-N 3.33Å; V624-E627 PolarHBondContact O-N 2.79Å; V624-A628 VanDerWaalsContact O-CB 3.28Å; V624-A628 WeakPolarHBondContact O-CB 3.15Å; V624-A628 PolarHBondContact O-N 3.14Å
625	K	95.1	Very high	95.4	Very high	27 Å²	27	36.1 Å²	36.1	12%	0.117	19%	0.186	C	C	.	.	H	α-helix	trans	-62.6	-41.5	175.5	-62.7	-153.9	-172.6	-150.3	0	112.5	L616 T619 D621 A622 E627 A628 A629 L677	L616-K625 HydrophobicContact CD2-CB 3.9Å; L616-K625 HydrophobicContact CD2-CD 4.44Å; L616-K625 HydrophobicContact CD2-CG 4.21Å; L616-K625 WeakPolarHBondContact O-CE 3.46Å; L616-K625 PolarHBondContact O-NZ 2.94Å; T619-K625 HydrophobicContact CG2-CD 4.27Å; T619-K625 HydrophobicContact CG2-CG 3.45Å; T619-K625 VanDerWaalsContact CG2-CG 3.45Å; T619-K625 WeakPolarHBondContact O-CE 3.47Å; T619-K625 PolarHBondContact O-NZ 3.38Å; D621-K625 PolarHBondContact O-N 3.28Å; D621-K625 VanDerWaalsContact O-N 3.11Å; A622-K625 PolarHBondContact O-N 3.4Å; K625-E627 PolarHBondContact O-N 3.14Å; K625-A628 PolarHBondContact O-N 3.05Å; K625-A629 VanDerWaalsContact O-CB 3.31Å; K625-A629 WeakPolarHBondContact O-CB 3.46Å; K625-A629 PolarHBondContact O-N 3.03Å; K625-L677 HydrophobicContact CB-CD1 3.81Å; K625-L677 HydrophobicContact CB-CD2 3.8Å; K625-L677 HydrophobicContact CB-CG 4.46Å; K625-L677 HydrophobicContact CD-CD2 4.36Å; K625-L677 WeakPolarHBondContact O-CD1 3.4Å
626	E	94.8	Very high	95.4	Very high	60 Å²	60	35.9 Å²	35.9	28%	0.28	18%	0.184	S	C	.	.	H	α-helix	trans	-59.3	-46.1	178.2	-78	-176	150.8	0	0	112.6	A622 V624 A630 T676 L677 N680	A622-E626 WeakPolarHBondContact O-CG 3.46Å; A622-E626 PolarHBondContact O-N 2.92Å; V624-E626 PolarHBondContact O-N 3.33Å; E626-A630 WeakPolarHBondContact O-CB 3.44Å; E626-A630 PolarHBondContact O-N 3.3Å; E626-T676 WeakPolarHBondContact OE1-CB 3.34Å; E626-T676 PolarHBondContact OE1-N 2.94Å; E626-L677 HydrophobicContact CG-CB 3.72Å; E626-L677 PolarHBondContact OE1-N 2.88Å; E626-N680 PolarHBondContact O-ND2 3.04Å
627	E	96.6	Very high	95.3	Very high	33 Å²	33	37.6 Å²	37.6	15%	0.154	20%	0.197	C	C	.	.	H	α-helix	trans	-71	-38	178.2	-65.9	-69.8	-170.6	0	0	112.3	K581 C584 A585 K588 S623 V624 K625 A630 A631	K581-E627 HydrophobicContact CG-CG 3.97Å; C584-E627 HydrophobicContact CB-CB 3.68Å; A585-E627 HydrophobicContact CB-CB 4.38Å; A585-E627 HydrophobicContact CB-CG 4.02Å; K588-E627 WeakPolarHBondContact CD-OE2 3.4Å; K588-E627 WeakPolarHBondContact CE-OE2 3.27Å; K588-E627 IonicContact NZ-OE1 2.7Å; K588-E627 PolarHBondContact NZ-OE1 3.16Å; K588-E627 IonicContact NZ-OE2 3.25Å; K588-E627 PolarHBondContact NZ-OE2 2.78Å; S623-E627 WeakPolarHBondContact O-CG 3.29Å; S623-E627 PolarHBondContact O-N 2.85Å; V624-E627 PolarHBondContact O-N 2.79Å; K625-E627 PolarHBondContact O-N 3.14Å; E627-A630 WeakPolarHBondContact O-CB 3.43Å; E627-A630 PolarHBondContact O-N 3.18Å; E627-A631 PolarHBondContact O-N 3.22Å
628	A	97.9	Very high	95	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.5	-43	175.1	0	0	0	0	0	112.1	I612 V615 L616 V624 K625 A630 A631 L632	I612-A628 HydrophobicContact CG2-CB 3.81Å; I612-A628 WeakPolarHBondContact CG2-O 3.43Å; V615-A628 HydrophobicContact CG1-CB 4.41Å; L616-A628 HydrophobicContact CD1-CB 4.17Å; L616-A628 HydrophobicContact CD2-CB 3.97Å; L616-A628 HydrophobicContact CG-CB 3.7Å; V624-A628 VanDerWaalsContact O-CB 3.28Å; V624-A628 WeakPolarHBondContact O-CB 3.15Å; V624-A628 PolarHBondContact O-N 3.14Å; K625-A628 PolarHBondContact O-N 3.05Å; A628-A630 VanDerWaalsContact C-N 3.34Å; A628-A631 PolarHBondContact O-N 3.24Å; A628-L632 PolarHBondContact O-N 3.44Å
629	A	97.7	Very high	94.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-68.1	-32.5	174.3	0	0	0	0	0	112.3	L616 K625 W633 L653 L677 N680	L616-A629 HydrophobicContact CD2-CB 4.32Å; K625-A629 VanDerWaalsContact O-CB 3.31Å; K625-A629 WeakPolarHBondContact O-CB 3.46Å; K625-A629 PolarHBondContact O-N 3.03Å; A629-W633 WeakPolarHBondContact O-CB 3.25Å; A629-W633 PolarHBondContact O-N 2.69Å; A629-L653 HydrophobicContact CB-CD2 4.41Å; A629-L677 HydrophobicContact CB-CD1 3.75Å; A629-N680 HydrophobicContact CB-CB 3.84Å
630	A	97.4	Very high	94.4	Very high	11 Å²	11	37.3 Å²	37.3	9%	0.091	20%	0.199	C	C	.	.	H	α-helix	trans	-66	-44.7	173	0	0	0	0	0	111.8	K588 E626 E627 A628 W633 N634 N680	K588-A630 HydrophobicContact CD-CB 3.54Å; K588-A630 HydrophobicContact CG-CB 3.91Å; E626-A630 WeakPolarHBondContact O-CB 3.44Å; E626-A630 PolarHBondContact O-N 3.3Å; E627-A630 WeakPolarHBondContact O-CB 3.43Å; E627-A630 PolarHBondContact O-N 3.18Å; A628-A630 VanDerWaalsContact C-N 3.34Å; A630-W633 PolarHBondContact O-N 2.96Å; A630-W633 VanDerWaalsContact O-N 3.15Å; A630-N634 PolarHBondContact O-N 3.01Å; A630-N680 WeakPolarHBondContact CB-ND2 3.37Å
631	A	98.1	Very high	94.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59.8	-47	174.2	0	0	0	0	0	111.3	K588 I612 E627 A628 W633 N634 L635	K588-A631 HydrophobicContact CB-CB 4.11Å; I612-A631 HydrophobicContact CD1-CB 4.26Å; E627-A631 PolarHBondContact O-N 3.22Å; A628-A631 PolarHBondContact O-N 3.24Å; A631-W633 VanDerWaalsContact C-N 3.28Å; A631-W633 PolarHBondContact O-N 2.86Å; A631-N634 PolarHBondContact O-N 3.01Å; A631-L635 WeakPolarHBondContact O-CB 3.47Å; A631-L635 WeakPolarHBondContact O-CD1 3.4Å; A631-L635 WeakPolarHBondContact O-CG 3.42Å; A631-L635 PolarHBondContact O-N 2.8Å
632	L	98.4	Very high	94.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.8	-34	173.7	-72	-173.8	0	0	0	113.2	V609 I612 L616 A628 L635 S636 A649 L653 V684	V609-L632 HydrophobicContact CG1-CD2 4.35Å; I612-L632 HydrophobicContact CB-CD2 4.24Å; I612-L632 HydrophobicContact CG2-CD1 4.4Å; I612-L632 HydrophobicContact CG2-CD2 4Å; I612-L632 HydrophobicContact CG2-CG 3.75Å; L616-L632 HydrophobicContact CD1-CD1 3.45Å; L616-L632 VanDerWaalsContact CD1-CD1 3.45Å; L616-L632 HydrophobicContact CD1-CG 4.34Å; A628-L632 PolarHBondContact O-N 3.44Å; L632-L635 HydrophobicContact CD2-CD1 4.32Å; L632-S636 WeakPolarHBondContact O-CB 3.42Å; L632-S636 PolarHBondContact O-N 2.88Å; L632-S636 PolarHBondContact O-OG 3.14Å; L632-A649 HydrophobicContact CD1-CB 3.58Å; L632-L653 HydrophobicContact CD1-CD1 4.33Å; L632-V684 HydrophobicContact CB-CG2 3.78Å
633	W	98.1	Very high	94.5	Very high	57 Å²	57	26.7 Å²	26.7	22%	0.216	14%	0.143	C	C	.	.	H	α-helix	trans	-66.8	-46.3	177.7	-169.2	10.2	0	0	0	110.7	A629 A630 A631 L635 S636 S637 K679 N680 G683 V684 N729	A629-W633 WeakPolarHBondContact O-CB 3.25Å; A629-W633 PolarHBondContact O-N 2.69Å; A630-W633 PolarHBondContact O-N 2.96Å; A630-W633 VanDerWaalsContact O-N 3.15Å; A631-W633 VanDerWaalsContact C-N 3.28Å; A631-W633 PolarHBondContact O-N 2.86Å; W633-L635 PolarHBondContact O-N 2.88Å; W633-S636 PolarHBondContact O-N 2.83Å; W633-S636 PolarHBondContact O-OG 2.95Å; W633-S637 PolarHBondContact O-N 3.32Å; W633-K679 HydrophobicContact CH2-CG 4.42Å; W633-K679 HydrophobicContact CZ3-CD 4.44Å; W633-K679 HydrophobicContact CZ3-CG 4.29Å; W633-N680 HydrophobicContact CE3-CB 4.13Å; W633-G683 VanDerWaalsContact CD1-C 3.42Å; W633-V684 HydrophobicContact CB-CG2 3.94Å; W633-N729 WeakPolarHBondContact CH2-ND2 3.45Å; W633-N729 VanDerWaalsContact CZ2-ND2 3.34Å; W633-N729 WeakPolarHBondContact CZ2-ND2 3.28Å
634	N	97.8	Very high	94.5	Very high	30 Å²	30	27.8 Å²	27.8	16%	0.16	15%	0.149	C	C	.	.	H	α-helix	trans	-60.1	-47.2	174.7	-72.1	0.1	0	0	0	111.8	K588 S591 A630 A631 S636 S637	K588-N634 PolarHBondContact O-ND2 3.02Å; S591-N634 WeakPolarHBondContact OG-CB 3.3Å; A630-N634 PolarHBondContact O-N 3.01Å; A631-N634 PolarHBondContact O-N 3.01Å; N634-S636 VanDerWaalsContact C-N 3.34Å; N634-S636 PolarHBondContact O-N 2.83Å; N634-S637 WeakPolarHBondContact O-CB 3.12Å; N634-S637 PolarHBondContact O-N 3.26Å; N634-S637 PolarHBondContact O-OG 2.86Å
635	L	97.6	Very high	94.5	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-60.6	-39.5	175.8	-67.9	165.3	0	0	0	112.3	K600 V603 I612 A631 L632 W633 S637 A638 L641 I645	K600-L635 HydrophobicContact CB-CD2 3.92Å; K600-L635 HydrophobicContact CG-CD2 4.09Å; V603-L635 HydrophobicContact CB-CD2 3.94Å; V603-L635 HydrophobicContact CG1-CD1 3.85Å; V603-L635 HydrophobicContact CG1-CD2 3.75Å; V603-L635 HydrophobicContact CG1-CG 4.48Å; V603-L635 HydrophobicContact CG2-CD2 4.48Å; I612-L635 HydrophobicContact CD1-CD1 3.77Å; A631-L635 WeakPolarHBondContact O-CB 3.47Å; A631-L635 WeakPolarHBondContact O-CD1 3.4Å; A631-L635 WeakPolarHBondContact O-CG 3.42Å; A631-L635 PolarHBondContact O-N 2.8Å; L632-L635 HydrophobicContact CD2-CD1 4.32Å; W633-L635 PolarHBondContact O-N 2.88Å; L635-S637 PolarHBondContact O-N 3.47Å; L635-S637 VanDerWaalsContact O-N 3.16Å; L635-A638 PolarHBondContact O-N 2.85Å; L635-L641 HydrophobicContact CB-CD2 3.77Å; L635-L641 HydrophobicContact CD2-CD2 3.57Å; L635-L641 HydrophobicContact CG-CD2 4.19Å; L635-I645 HydrophobicContact CB-CD1 4.12Å
636	S	96.4	Very high	94.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-68.1	-11	-179.4	72.5	0	0	0	0	114.7	L632 W633 N634 A638 K642 N687	L632-S636 WeakPolarHBondContact O-CB 3.42Å; L632-S636 PolarHBondContact O-N 2.88Å; L632-S636 PolarHBondContact O-OG 3.14Å; W633-S636 PolarHBondContact O-N 2.83Å; W633-S636 PolarHBondContact O-OG 2.95Å; N634-S636 VanDerWaalsContact C-N 3.34Å; N634-S636 PolarHBondContact O-N 2.83Å; S636-A638 VanDerWaalsContact C-N 3.33Å; S636-K642 WeakPolarHBondContact O-CE 3.33Å; S636-N687 WeakPolarHBondContact O-CB 3.41Å; S636-N687 WeakPolarHBondContact OG-CB 3.23Å; S636-N687 PolarHBondContact OG-ND2 2.79Å; S636-N687 VanDerWaalsContact OG-ND2 3.08Å
637	S	93.8	Very high	94.4	Very high	41 Å²	41	30.4 Å²	30.4	29%	0.287	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-37.3	175.4	62.2	0	0	0	0	112.4	K600 W633 N634 L635 K642	K600-S637 PolarHBondContact NZ-OG 2.8Å; W633-S637 PolarHBondContact O-N 3.32Å; N634-S637 WeakPolarHBondContact O-CB 3.12Å; N634-S637 PolarHBondContact O-N 3.26Å; N634-S637 PolarHBondContact O-OG 2.86Å; L635-S637 PolarHBondContact O-N 3.47Å; L635-S637 VanDerWaalsContact O-N 3.16Å; S637-K642 WeakPolarHBondContact O-CE 3.38Å; S637-K642 PolarHBondContact O-NZ 3.28Å
638	A	88.4	Confident	94.3	Very high	5 Å²	5	30 Å²	30	4%	0.041	16%	0.162	C	C	.	.	S	Bend	trans	-86.2	132.1	-175	0	0	0	0	0	111.7	K600 L635 S636 M640 L641	K600-A638 HydrophobicContact CD-CB 3.76Å; L635-A638 PolarHBondContact O-N 2.85Å; S636-A638 VanDerWaalsContact C-N 3.33Å; A638-M640 HydrophobicContact CB-SD 3.65Å; A638-M640 PolarHBondContact O-N 2.92Å; A638-L641 HydrophobicContact CB-CD1 4.3Å; A638-L641 PolarHBondContact O-N 2.87Å
639	D	85.4	Confident	94.2	Very high	81 Å²	81	30 Å²	30	43%	0.433	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-62.6	-40.3	-167	-74.5	-53.7	0	0	0	114.2	F482 L641 K642 P643	F482-D639 WeakPolarHBondContact CE1-OD2 3.37Å; D639-L641 PolarHBondContact O-N 3.32Å; D639-K642 WeakPolarHBondContact O-CB 3.48Å; D639-K642 PolarHBondContact O-N 2.95Å; D639-K642 VanDerWaalsContact O-N 3.09Å; D639-K642 WeakPolarHBondContact OD1-CE 3.3Å; D639-K642 IonicContact OD1-NZ 2.74Å; D639-K642 PolarHBondContact OD1-NZ 2.87Å; D639-P643 WeakPolarHBondContact O-CD 3.37Å
640	M	88	Confident	94.1	Very high	100 Å²	100	30.3 Å²	30.3	49%	0.493	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-66.4	-22.2	-177.2	72.1	-61.2	-90.8	0	0	113.8	A638	A638-M640 HydrophobicContact CB-SD 3.65Å; A638-M640 PolarHBondContact O-N 2.92Å
641	L	91.5	Very high	93.9	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-84.8	-17.7	174.4	-78.5	86.5	0	0	0	113.3	K600 M604 V609 L635 A638 D639 V644 I645	K600-L641 HydrophobicContact CB-CD1 4.04Å; K600-L641 HydrophobicContact CB-CD2 4.31Å; M604-L641 HydrophobicContact CB-CD2 4.35Å; M604-L641 HydrophobicContact CB-CG 4.27Å; M604-L641 HydrophobicContact CG-CG 4.42Å; M604-L641 HydrophobicContact SD-CD1 4.4Å; M604-L641 HydrophobicContact SD-CG 4.07Å; V609-L641 HydrophobicContact CG2-CD2 3.85Å; L635-L641 HydrophobicContact CB-CD2 3.77Å; L635-L641 HydrophobicContact CD2-CD2 3.57Å; L635-L641 HydrophobicContact CG-CD2 4.19Å; A638-L641 HydrophobicContact CB-CD1 4.3Å; A638-L641 PolarHBondContact O-N 2.87Å; D639-L641 PolarHBondContact O-N 3.32Å; L641-V644 PolarHBondContact O-N 3.03Å; L641-I645 HydrophobicContact CB-CD1 3.98Å; L641-I645 VanDerWaalsContact O-CG1 3.31Å; L641-I645 WeakPolarHBondContact O-CG1 3.33Å; L641-I645 PolarHBondContact O-N 3.27Å
642	K	91.4	Very high	93.8	Very high	12 Å²	12	36.6 Å²	36.6	5%	0.052	19%	0.192	C	C	.	.	H	α-helix	trans	-60.4	-38.4	-174.1	-66.2	173.4	-171.6	165.4	0	113.8	S636 S637 D639 L646 A691	S636-K642 WeakPolarHBondContact O-CE 3.33Å; S637-K642 WeakPolarHBondContact O-CE 3.38Å; S637-K642 PolarHBondContact O-NZ 3.28Å; D639-K642 WeakPolarHBondContact O-CB 3.48Å; D639-K642 PolarHBondContact O-N 2.95Å; D639-K642 VanDerWaalsContact O-N 3.09Å; D639-K642 WeakPolarHBondContact OD1-CE 3.3Å; D639-K642 IonicContact OD1-NZ 2.74Å; D639-K642 PolarHBondContact OD1-NZ 2.87Å; K642-L646 WeakPolarHBondContact O-CB 3.4Å; K642-L646 PolarHBondContact O-N 3.23Å; K642-A691 HydrophobicContact CB-CB 3.7Å; K642-A691 HydrophobicContact CD-CB 3.91Å; K642-A691 HydrophobicContact CG-CB 4.37Å
643	P	91.2	Very high	93.7	Very high	73 Å²	73	36.6 Å²	36.6	47%	0.474	19%	0.192	S	C	.	.	H	α-helix	trans	-62.7	-46.7	173.1	-23	34.8	0	0	0	112.8	D639 I645 L646 E647	D639-P643 WeakPolarHBondContact O-CD 3.37Å; P643-I645 VanDerWaalsContact C-N 3.31Å; P643-I645 PolarHBondContact O-N 2.87Å; P643-L646 VanDerWaalsContact O-CB 3.31Å; P643-L646 WeakPolarHBondContact O-CB 3.41Å; P643-L646 PolarHBondContact O-N 3.48Å; P643-L646 VanDerWaalsContact O-N 3.17Å; P643-E647 WeakPolarHBondContact O-CG 3.12Å; P643-E647 PolarHBondContact O-N 3.15Å
644	V	92.9	Very high	93.5	Very high	53 Å²	53	33.9 Å²	33.9	32%	0.321	18%	0.182	S	C	.	.	H	α-helix	trans	-64.7	-37.3	-178.5	-170.7	0	0	0	0	111.4	M604 V609 L641 S648	M604-V644 HydrophobicContact SD-CG2 4.21Å; V609-V644 HydrophobicContact CB-CG1 4.02Å; V609-V644 HydrophobicContact CG1-CB 4.32Å; V609-V644 HydrophobicContact CG1-CG1 3.81Å; L641-V644 PolarHBondContact O-N 3.03Å; V644-S648 WeakPolarHBondContact O-CB 3.03Å; V644-S648 PolarHBondContact O-N 2.88Å; V644-S648 PolarHBondContact O-OG 3.28Å
645	I	96.2	Very high	93.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-70.7	-38.6	175.6	-62.9	167.5	0	0	0	111.2	V609 L635 L641 P643 E647 A649 T650 V684 V688	V609-I645 HydrophobicContact CG1-CB 4.44Å; V609-I645 HydrophobicContact CG1-CG1 3.58Å; V609-I645 HydrophobicContact CG2-CG1 4.49Å; L635-I645 HydrophobicContact CB-CD1 4.12Å; L641-I645 HydrophobicContact CB-CD1 3.98Å; L641-I645 VanDerWaalsContact O-CG1 3.31Å; L641-I645 WeakPolarHBondContact O-CG1 3.33Å; L641-I645 PolarHBondContact O-N 3.27Å; P643-I645 VanDerWaalsContact C-N 3.31Å; P643-I645 PolarHBondContact O-N 2.87Å; I645-E647 PolarHBondContact O-N 3.07Å; I645-A649 HydrophobicContact CG2-CB 4.22Å; I645-A649 PolarHBondContact O-N 3.05Å; I645-T650 PolarHBondContact O-N 2.88Å; I645-V684 HydrophobicContact CG2-CG1 3.67Å; I645-V688 HydrophobicContact CB-CG2 4.14Å; I645-V688 HydrophobicContact CG2-CG2 3.72Å
646	L	94.8	Very high	92.8	Very high	12 Å²	12	39.5 Å²	39.5	6%	0.063	21%	0.207	C	C	.	.	H	α-helix	trans	-53.5	-44	174.4	177.6	64.2	0	0	0	111.3	K642 P643 T650 V688 A695 R698 L699	K642-L646 WeakPolarHBondContact O-CB 3.4Å; K642-L646 PolarHBondContact O-N 3.23Å; P643-L646 VanDerWaalsContact O-CB 3.31Å; P643-L646 WeakPolarHBondContact O-CB 3.41Å; P643-L646 PolarHBondContact O-N 3.48Å; P643-L646 VanDerWaalsContact O-N 3.17Å; L646-T650 HydrophobicContact CD1-CG2 4.25Å; L646-T650 PolarHBondContact O-OG1 3.18Å; L646-V688 HydrophobicContact CB-CG1 3.76Å; L646-V688 HydrophobicContact CD1-CG1 3.76Å; L646-V688 HydrophobicContact CG-CG1 4.3Å; L646-A695 HydrophobicContact CD1-CB 4.2Å; L646-A695 HydrophobicContact CD2-CB 3.81Å; L646-R698 HydrophobicContact CD1-CB 4.24Å; L646-L699 HydrophobicContact CD1-CG 4.37Å
647	E	92.8	Very high	92.5	Very high	129 Å²	129	40.4 Å²	40.4	60%	0.603	21%	0.213	S	C	*	.	H	α-helix	trans	-83.9	-42.1	-177.4	-57.5	-161.7	135.2	0	0	113.2	P643 I645 R698	P643-E647 WeakPolarHBondContact O-CG 3.12Å; P643-E647 PolarHBondContact O-N 3.15Å; I645-E647 PolarHBondContact O-N 3.07Å; E647-R698 IonicContact OE1-CZ 3.57Å; E647-R698 IonicContact OE1-NH1 2.91Å; E647-R698 PolarHBondContact OE1-NH1 2.92Å; E647-R698 IonicContact OE1-NH2 2.65Å
648	S	93.5	Very high	92.4	Very high	24 Å²	24	38.4 Å²	38.4	17%	0.168	20%	0.199	C	C	.	.	H	α-helix	trans	-77.6	-37.2	-173.5	-59.1	0	0	0	0	113.5	A613 V644 I652	A613-S648 WeakPolarHBondContact CB-O 3.34Å; V644-S648 WeakPolarHBondContact O-CB 3.03Å; V644-S648 PolarHBondContact O-N 2.88Å; V644-S648 PolarHBondContact O-OG 3.28Å; S648-I652 VanDerWaalsContact O-CD1 3.26Å; S648-I652 WeakPolarHBondContact O-CD1 3.38Å
649	A	96.2	Very high	92.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.7	-28.6	-158.6	0	0	0	0	0	116.3	A613 L632 I645 E651 I652 L653	A613-A649 HydrophobicContact CB-CB 4Å; L632-A649 HydrophobicContact CD1-CB 3.58Å; I645-A649 HydrophobicContact CG2-CB 4.22Å; I645-A649 PolarHBondContact O-N 3.05Å; A649-E651 VanDerWaalsContact C-N 3.35Å; A649-E651 PolarHBondContact O-N 3.15Å; A649-I652 WeakPolarHBondContact O-CB 3.36Å; A649-I652 PolarHBondContact O-N 3.13Å; A649-I652 VanDerWaalsContact O-N 3.1Å; A649-L653 HydrophobicContact CB-CD1 4.32Å; A649-L653 WeakPolarHBondContact O-CG 3.48Å; A649-L653 PolarHBondContact O-N 2.98Å
650	T	95.7	Very high	92.6	Very high	7 Å²	7	37.8 Å²	37.8	4%	0.043	20%	0.2	C	C	.	.	H	α-helix	trans	-64.2	-36.6	-167.2	61.8	0	0	0	0	113.9	I645 L646 S654 L685 V688 L699	I645-T650 PolarHBondContact O-N 2.88Å; L646-T650 HydrophobicContact CD1-CG2 4.25Å; L646-T650 PolarHBondContact O-OG1 3.18Å; T650-S654 VanDerWaalsContact O-CB 3.27Å; T650-S654 WeakPolarHBondContact O-CB 3.34Å; T650-S654 PolarHBondContact O-N 3.18Å; T650-S654 PolarHBondContact O-OG 3.01Å; T650-L685 HydrophobicContact CG2-CD2 3.58Å; T650-V688 HydrophobicContact CG2-CB 4.45Å; T650-V688 HydrophobicContact CG2-CG1 4.02Å; T650-L699 HydrophobicContact CG2-CD2 4.03Å
651	E	94.3	Very high	92.3	Very high	131 Å²	131	33.2 Å²	33.2	61%	0.612	18%	0.177	S	C	*	.	H	α-helix	trans	-67.5	-39.4	174.6	-173.1	174.7	-163.1	0	0	111.9	A649 S654 Q655	A649-E651 VanDerWaalsContact C-N 3.35Å; A649-E651 PolarHBondContact O-N 3.15Å; E651-S654 PolarHBondContact O-N 3.48Å; E651-Q655 HydrophobicContact CG-CG 4.11Å; E651-Q655 WeakPolarHBondContact O-CB 3.5Å; E651-Q655 WeakPolarHBondContact O-CG 3.45Å; E651-Q655 PolarHBondContact O-N 2.74Å
652	I	94.9	Very high	91.9	Very high	12 Å²	12	35.8 Å²	35.8	6%	0.062	19%	0.191	C	C	.	.	H	α-helix	trans	-62.5	-51.1	177.9	-44.4	172.7	0	0	0	110.1	A613 L616 R617 S648 A649 S654 Q655 Q656	A613-I652 HydrophobicContact CB-CD1 3.81Å; A613-I652 WeakPolarHBondContact O-CD1 3.18Å; L616-I652 HydrophobicContact CB-CG2 4.28Å; R617-I652 HydrophobicContact CB-CD1 4.22Å; R617-I652 HydrophobicContact CB-CG2 4.28Å; S648-I652 VanDerWaalsContact O-CD1 3.26Å; S648-I652 WeakPolarHBondContact O-CD1 3.38Å; A649-I652 WeakPolarHBondContact O-CB 3.36Å; A649-I652 PolarHBondContact O-N 3.13Å; A649-I652 VanDerWaalsContact O-N 3.1Å; I652-S654 VanDerWaalsContact C-N 3.28Å; I652-S654 PolarHBondContact O-N 2.77Å; I652-Q655 PolarHBondContact O-N 2.9Å; I652-Q656 HydrophobicContact CG2-CG 4.13Å; I652-Q656 VanDerWaalsContact O-CB 3.26Å; I652-Q656 WeakPolarHBondContact O-CB 3.44Å; I652-Q656 PolarHBondContact O-N 3.12Å
653	L	95.8	Very high	91	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-60.8	-40.6	178.8	-65.9	170.3	0	0	0	110.7	L616 A629 L632 A649 V657 I658 V684	L616-L653 HydrophobicContact CD1-CD2 3.95Å; L616-L653 HydrophobicContact CD2-CD2 4.46Å; A629-L653 HydrophobicContact CB-CD2 4.41Å; L632-L653 HydrophobicContact CD1-CD1 4.33Å; A649-L653 HydrophobicContact CB-CD1 4.32Å; A649-L653 WeakPolarHBondContact O-CG 3.48Å; A649-L653 PolarHBondContact O-N 2.98Å; L653-V657 VanDerWaalsContact O-CB 3.29Å; L653-V657 WeakPolarHBondContact O-CB 3.31Å; L653-V657 PolarHBondContact O-N 3.05Å; L653-I658 PolarHBondContact O-N 3.33Å; L653-I658 VanDerWaalsContact O-N 3.15Å; L653-V684 HydrophobicContact CD1-CB 3.79Å; L653-V684 HydrophobicContact CD1-CG1 3.59Å; L653-V684 HydrophobicContact CD1-CG2 4.07Å
654	S	94.2	Very high	89.3	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.229	C	C	.	.	I	π-helix	trans	-67.7	-53.1	178.1	-57.6	0	0	0	0	112.3	T650 E651 I652 I658 A659	T650-S654 VanDerWaalsContact O-CB 3.27Å; T650-S654 WeakPolarHBondContact O-CB 3.34Å; T650-S654 PolarHBondContact O-N 3.18Å; T650-S654 PolarHBondContact O-OG 3.01Å; E651-S654 PolarHBondContact O-N 3.48Å; I652-S654 VanDerWaalsContact C-N 3.28Å; I652-S654 PolarHBondContact O-N 2.77Å; S654-I658 PolarHBondContact O-N 3.21Å; S654-A659 WeakPolarHBondContact O-CB 3.42Å; S654-A659 PolarHBondContact O-N 3.17Å
655	Q	91	Very high	87.3	Confident	64 Å²	64	42.4 Å²	42.4	30%	0.299	25%	0.251	S	S	.	.	I	π-helix	trans	-81.1	-30.4	-172.7	-62.1	-55.4	-29.6	0	0	114	E651 I652 P660 I702 P703	E651-Q655 HydrophobicContact CG-CG 4.11Å; E651-Q655 WeakPolarHBondContact O-CB 3.5Å; E651-Q655 WeakPolarHBondContact O-CG 3.45Å; E651-Q655 PolarHBondContact O-N 2.74Å; I652-Q655 PolarHBondContact O-N 2.9Å; Q655-P660 WeakPolarHBondContact O-CD 3.35Å; Q655-P660 VanDerWaalsContact O-CG 3.29Å; Q655-P660 WeakPolarHBondContact O-CG 3.37Å; Q655-I702 VanDerWaalsContact NE2-CG2 3.31Å; Q655-P703 PolarHBondContact NE2-O 2.68Å
656	Q	90.3	Very high	84.9	Confident	84 Å²	84	46 Å²	46	39%	0.393	27%	0.273	S	S	.	.	I	π-helix	trans	-93.4	-21.2	179.3	-60.3	-160.4	6.3	0	0	114.6	L616 R617 I652	L616-Q656 PolarHBondContact O-OE1 3.05Å; L616-Q656 VanDerWaalsContact O-OE1 3.14Å; R617-Q656 PolarHBondContact O-NE2 2.82Å; R617-Q656 VanDerWaalsContact O-NE2 3.14Å; I652-Q656 HydrophobicContact CG2-CG 4.13Å; I652-Q656 VanDerWaalsContact O-CB 3.26Å; I652-Q656 WeakPolarHBondContact O-CB 3.44Å; I652-Q656 PolarHBondContact O-N 3.12Å
657	V	90.4	Very high	82.7	Confident	19 Å²	19	50.4 Å²	50.4	12%	0.115	31%	0.305	C	S	.	.	I	π-helix	trans	-117.7	-49.3	-177.6	-174.1	0	0	0	0	112.7	L653 L677 F678	L653-V657 VanDerWaalsContact O-CB 3.29Å; L653-V657 WeakPolarHBondContact O-CB 3.31Å; L653-V657 PolarHBondContact O-N 3.05Å; V657-L677 HydrophobicContact CG1-CD2 4.36Å; V657-L677 HydrophobicContact CG1-CG 3.79Å; V657-L677 HydrophobicContact CG2-CD1 4.09Å; V657-L677 HydrophobicContact CG2-CD2 4.02Å; V657-L677 HydrophobicContact CG2-CG 3.89Å; V657-F678 HydrophobicContact CG1-CB 4.24Å; V657-F678 HydrophobicContact CG1-CD2 4.31Å
658	I	91.8	Very high	80.8	Confident	0 Å²	0	48 Å²	48	0%	0	30%	0.296	C	S	.	.	I	π-helix	trans	-88	-53.6	-167.6	-61.2	168	0	0	0	112.2	L653 S654 P660 V661 F678 T682 L685 L705 A708	L653-I658 PolarHBondContact O-N 3.33Å; L653-I658 VanDerWaalsContact O-N 3.15Å; S654-I658 PolarHBondContact O-N 3.21Å; I658-P660 VanDerWaalsContact C-CD 3.44Å; I658-V661 VanDerWaalsContact O-CB 3.25Å; I658-V661 WeakPolarHBondContact O-CB 3.19Å; I658-V661 WeakPolarHBondContact O-CG2 3.37Å; I658-V661 PolarHBondContact O-N 3.3Å; I658-F678 HydrophobicContact CB-CE2 4.17Å; I658-F678 HydrophobicContact CG1-CD2 4.24Å; I658-F678 HydrophobicContact CG1-CE2 4.07Å; I658-F678 HydrophobicContact CG2-CE2 3.97Å; I658-F678 HydrophobicContact CG2-CZ 4.31Å; I658-T682 HydrophobicContact CD1-CG2 3.97Å; I658-T682 HydrophobicContact CG1-CG2 4.39Å; I658-L685 HydrophobicContact CD1-CD1 3.52Å; I658-L685 HydrophobicContact CD1-CG 4.37Å; I658-L705 HydrophobicContact CB-CD1 4.29Å; I658-L705 HydrophobicContact CD1-CD1 4.1Å; I658-L705 HydrophobicContact CG2-CD1 3.78Å; I658-A708 HydrophobicContact CG2-CB 3.82Å; I658-A708 WeakPolarHBondContact O-CB 3.32Å
659	A	89.4	Confident	78.9	Confident	11 Å²	11	48.4 Å²	48.4	9%	0.091	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-59.7	-35.2	-179.6	0	0	0	0	0	115.4	S654 V661 L662 N704	S654-A659 WeakPolarHBondContact O-CB 3.42Å; S654-A659 PolarHBondContact O-N 3.17Å; A659-V661 PolarHBondContact O-N 3.47Å; A659-L662 PolarHBondContact O-N 3.18Å; A659-N704 HydrophobicContact CB-CB 3.96Å
660	P	88	Confident	77	Confident	62 Å²	62	50.3 Å²	50.3	40%	0.403	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-59	-16.7	178.9	-28.4	38	0	0	0	115.3	Q655 I658 L662 A663	Q655-P660 WeakPolarHBondContact O-CD 3.35Å; Q655-P660 VanDerWaalsContact O-CG 3.29Å; Q655-P660 WeakPolarHBondContact O-CG 3.37Å; I658-P660 VanDerWaalsContact C-CD 3.44Å; P660-L662 PolarHBondContact O-N 2.87Å; P660-L662 VanDerWaalsContact O-N 3.15Å; P660-A663 WeakPolarHBondContact O-CB 3.44Å; P660-A663 PolarHBondContact O-N 3.12Å
661	V	82.6	Confident	75.4	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.024	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-48.3	-33.8	166.8	155.3	0	0	0	0	113.4	I658 A659 A663 F673 F678 A708 H711	I658-V661 VanDerWaalsContact O-CB 3.25Å; I658-V661 WeakPolarHBondContact O-CB 3.19Å; I658-V661 WeakPolarHBondContact O-CG2 3.37Å; I658-V661 PolarHBondContact O-N 3.3Å; A659-V661 PolarHBondContact O-N 3.47Å; V661-A663 VanDerWaalsContact C-N 3.3Å; V661-A663 PolarHBondContact O-N 3.24Å; V661-F673 HydrophobicContact CB-CE1 4.1Å; V661-F673 HydrophobicContact CG1-CE1 3.37Å; V661-F673 HydrophobicContact CG1-CZ 3.6Å; V661-F673 HydrophobicContact CG2-CD1 3.98Å; V661-F673 HydrophobicContact CG2-CE1 3.54Å; V661-F673 HydrophobicContact CG2-CZ 4.43Å; V661-F678 HydrophobicContact CG2-CD2 4.3Å; V661-F678 HydrophobicContact CG2-CE2 3.69Å; V661-F678 HydrophobicContact CG2-CZ 4.46Å; V661-A708 HydrophobicContact CB-CB 4.48Å; V661-H711 HydrophobicContact CG1-CB 4.49Å; V661-H711 WeakPolarHBondContact CG1-ND1 3.49Å
662	L	81.8	Confident	74.2	Confident	54 Å²	54	57.8 Å²	57.8	28%	0.283	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-83.3	-3.1	-176.9	-59	179.9	0	0	0	113.4	A659 P660 V664 N704 E707 A708 H711	A659-L662 PolarHBondContact O-N 3.18Å; P660-L662 PolarHBondContact O-N 2.87Å; P660-L662 VanDerWaalsContact O-N 3.15Å; L662-V664 PolarHBondContact O-N 3.21Å; L662-N704 HydrophobicContact CD1-CB 3.86Å; L662-E707 HydrophobicContact CD1-CB 3.62Å; L662-A708 HydrophobicContact CD1-CB 4.28Å; L662-A708 HydrophobicContact CG-CB 4.12Å; L662-H711 HydrophobicContact CD2-CB 3.67Å
663	A	73.7	Confident	73	Confident	47 Å²	47	57.8 Å²	57.8	39%	0.388	34%	0.336	S	S	.	.			trans	-71.8	91.7	-176.1	0	0	0	0	0	112	P660 V661 G665 T666	P660-A663 WeakPolarHBondContact O-CB 3.44Å; P660-A663 PolarHBondContact O-N 3.12Å; V661-A663 VanDerWaalsContact C-N 3.3Å; V661-A663 PolarHBondContact O-N 3.24Å; A663-G665 PolarHBondContact O-N 3.38Å; A663-T666 PolarHBondContact O-OG1 2.73Å
664	V	54.1	Low	71.5	Confident	153 Å²	153	61.3 Å²	61.3	93%	0.927	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	97.8	175.5	-176.5	0	0	0	0	110.2	L662	L662-V664 PolarHBondContact O-N 3.21Å
665	G	51.5	Low	71.1	Confident	77 Å²	77	62.7 Å²	62.7	79%	0.794	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	151.7	-16.5	176	0	0	0	0	0	115.2	A663	A663-G665 PolarHBondContact O-N 3.38Å
666	T	46	Very low	71.1	Confident	74 Å²	74	62.7 Å²	62.7	45%	0.454	39%	0.386	S	S	.	.	S	Bend	trans	-69.6	152.1	171	54.7	0	0	0	0	111	A663 D668	A663-T666 PolarHBondContact O-OG1 2.73Å; T666-D668 PolarHBondContact O-N 2.81Å
667	S	48.2	Very low	71.2	Confident	105 Å²	105	59.8 Å²	59.8	73%	0.734	37%	0.373	S	S	*	.	S	Bend	trans	-73	89.8	179.9	58.8	0	0	0	0	110.7
668	D	54.4	Low	71.4	Confident	79 Å²	79	58.9 Å²	58.9	42%	0.422	37%	0.368	S	S	.	.			trans	65.9	87.9	-174.2	-172.6	10.3	0	0	0	114	T666 T670 R671	T666-D668 PolarHBondContact O-N 2.81Å; D668-T670 VanDerWaalsContact CG-OG1 3.3Å; D668-T670 PolarHBondContact O-N 3.15Å; D668-T670 VanDerWaalsContact O-N 3.08Å; D668-T670 VanDerWaalsContact OD1-CB 3.25Å; D668-T670 WeakPolarHBondContact OD1-CB 3.38Å; D668-T670 WeakPolarHBondContact OD1-CG2 3.44Å; D668-T670 PolarHBondContact OD1-N 3.03Å; D668-T670 PolarHBondContact OD1-OG1 3.49Å; D668-T670 PolarHBondContact OD2-OG1 2.91Å; D668-R671 HydrophobicContact CB-CG 4.16Å; D668-R671 WeakPolarHBondContact O-CB 3.36Å; D668-R671 WeakPolarHBondContact O-CG 3.28Å; D668-R671 PolarHBondContact O-N 3.43Å
669	P	53.3	Low	71.5	Confident	33 Å²	33	60.9 Å²	60.9	21%	0.214	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-62.9	-14.8	176.8	26.5	-35	0	0	0	113.1	R671 H672	P669-R671 PolarHBondContact O-N 2.89Å; P669-H672 PolarHBondContact O-N 3.22Å
670	T	56.5	Low	71.9	Confident	40 Å²	40	60.7 Å²	60.7	25%	0.245	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-74.2	-17.7	-178.1	79.8	0	0	0	0	112.6	D668 H672 F673 H715	D668-T670 VanDerWaalsContact CG-OG1 3.3Å; D668-T670 PolarHBondContact O-N 3.15Å; D668-T670 VanDerWaalsContact O-N 3.08Å; D668-T670 VanDerWaalsContact OD1-CB 3.25Å; D668-T670 WeakPolarHBondContact OD1-CB 3.38Å; D668-T670 WeakPolarHBondContact OD1-CG2 3.44Å; D668-T670 PolarHBondContact OD1-N 3.03Å; D668-T670 PolarHBondContact OD1-OG1 3.49Å; D668-T670 PolarHBondContact OD2-OG1 2.91Å; T670-H672 PolarHBondContact O-N 3.24Å; T670-H672 VanDerWaalsContact O-N 3.12Å; T670-F673 HydrophobicContact CG2-CD2 4.36Å; T670-F673 HydrophobicContact CG2-CE2 4.08Å; T670-F673 WeakPolarHBondContact O-CB 3.45Å; T670-F673 PolarHBondContact O-N 2.85Å; T670-F673 VanDerWaalsContact O-N 3.14Å; T670-H715 WeakPolarHBondContact CG2-CE1 3.4Å
671	R	62.3	Low	72.3	Confident	187 Å²	187	57.8 Å²	57.8	71%	0.706	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-54	-28.5	173.1	-73.6	-179.2	166.2	-149.1	-4.3	114.2	D668 P669	D668-R671 HydrophobicContact CB-CG 4.16Å; D668-R671 WeakPolarHBondContact O-CB 3.36Å; D668-R671 WeakPolarHBondContact O-CG 3.28Å; D668-R671 PolarHBondContact O-N 3.43Å; P669-R671 PolarHBondContact O-N 2.89Å
672	H	67.4	Low	73	Confident	108 Å²	108	57.6 Å²	57.6	50%	0.5	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-84.8	-19.6	-177.3	-63.9	-77.9	0	0	0	113.7	P669 T670 G674 S675	P669-H672 PolarHBondContact O-N 3.22Å; T670-H672 PolarHBondContact O-N 3.24Å; T670-H672 VanDerWaalsContact O-N 3.12Å; H672-G674 VanDerWaalsContact C-N 3.34Å; H672-G674 PolarHBondContact O-N 2.96Å; H672-S675 WeakPolarHBondContact O-CB 3.13Å; H672-S675 PolarHBondContact O-N 2.7Å; H672-S675 VanDerWaalsContact O-N 3.11Å; H672-S675 PolarHBondContact O-OG 2.73Å
673	F	70.8	Confident	73.7	Confident	12 Å²	12	55 Å²	55	5%	0.053	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-34.1	-177.5	-67.3	-40.3	0	0	0	113.9	V661 T670 S675 F678 H711 F712 H715	V661-F673 HydrophobicContact CB-CE1 4.1Å; V661-F673 HydrophobicContact CG1-CE1 3.37Å; V661-F673 HydrophobicContact CG1-CZ 3.6Å; V661-F673 HydrophobicContact CG2-CD1 3.98Å; V661-F673 HydrophobicContact CG2-CE1 3.54Å; V661-F673 HydrophobicContact CG2-CZ 4.43Å; T670-F673 HydrophobicContact CG2-CD2 4.36Å; T670-F673 HydrophobicContact CG2-CE2 4.08Å; T670-F673 WeakPolarHBondContact O-CB 3.45Å; T670-F673 PolarHBondContact O-N 2.85Å; T670-F673 VanDerWaalsContact O-N 3.14Å; F673-S675 VanDerWaalsContact C-N 3.29Å; F673-S675 PolarHBondContact O-N 2.88Å; F673-F678 HydrophobicContact CD1-CZ 4.39Å; F673-H711 AromaticContact CZ-ND1 3.85Å; F673-F712 HydrophobicContact CB-CD2 3.95Å; F673-F712 HydrophobicContact CB-CE2 4.05Å; F673-F712 HydrophobicContact CD1-CB 4Å; F673-F712 AromaticContact CD1-CD2 3.39Å; F673-F712 HydrophobicContact CD1-CD2 3.39Å; F673-F712 HydrophobicContact CD1-CE2 4.3Å; F673-F712 HydrophobicContact CD1-CG 4.06Å; F673-F712 HydrophobicContact CD2-CD2 4.38Å; F673-F712 HydrophobicContact CE1-CB 3.58Å; F673-F712 AromaticContact CE1-CD2 3.82Å; F673-F712 HydrophobicContact CE1-CD2 3.82Å; F673-F712 HydrophobicContact CE1-CG 4.14Å; F673-F712 AromaticContact CG-CD2 3.69Å; F673-F712 HydrophobicContact CG-CD2 3.69Å; F673-F712 HydrophobicContact CG-CE2 4.29Å; F673-F712 HydrophobicContact CZ-CB 4.22Å; F673-F712 HydrophobicContact CZ-CD2 4.49Å; F673-H715 HydrophobicContact CD2-CB 4.15Å; F673-H715 AromaticContact CD2-CD2 3.49Å; F673-H715 VanDerWaalsContact CD2-CD2 3.49Å; F673-H715 WeakPolarHBondContact CD2-CD2 3.06Å; F673-H715 AromaticContact CD2-CG 3.8Å; F673-H715 HydrophobicContact CE2-CB 3.56Å; F673-H715 AromaticContact CE2-CD2 3.7Å; F673-H715 AromaticContact CE2-CG 3.48Å; F673-H715 VanDerWaalsContact CE2-CG 3.48Å; F673-H715 HydrophobicContact CZ-CB 4.18Å
674	G	64.3	Low	74.9	Confident	75 Å²	75	52.8 Å²	52.8	77%	0.773	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	2.1	175.7	0	0	0	0	0	114.5	H672	H672-G674 VanDerWaalsContact C-N 3.34Å; H672-G674 PolarHBondContact O-N 2.96Å
675	S	86.3	Confident	77	Confident	28 Å²	28	45.5 Å²	45.5	20%	0.196	28%	0.278	C	S	.	.			trans	-76.6	142.1	-175.1	69.4	0	0	0	0	112.7	H672 F673 L677 F678 K679	H672-S675 WeakPolarHBondContact O-CB 3.13Å; H672-S675 PolarHBondContact O-N 2.7Å; H672-S675 VanDerWaalsContact O-N 3.11Å; H672-S675 PolarHBondContact O-OG 2.73Å; F673-S675 VanDerWaalsContact C-N 3.29Å; F673-S675 PolarHBondContact O-N 2.88Å; S675-L677 PolarHBondContact O-N 3.27Å; S675-F678 PolarHBondContact O-N 3.47Å; S675-F678 VanDerWaalsContact OG-CB 3.27Å; S675-F678 WeakPolarHBondContact OG-CB 3.46Å; S675-F678 PolarHBondContact OG-N 2.83Å; S675-F678 VanDerWaalsContact OG-N 3.17Å; S675-K679 PolarHBondContact O-N 3.48Å; S675-K679 VanDerWaalsContact O-N 3.13Å
676	T	90.8	Very high	79.1	Confident	64 Å²	64	43.1 Å²	43.1	39%	0.393	25%	0.245	S	C	.	.	H	α-helix	trans	-60.6	-35.7	173.6	-57.2	0	0	0	0	110.4	E626 F678 K679 N680	E626-T676 WeakPolarHBondContact OE1-CB 3.34Å; E626-T676 PolarHBondContact OE1-N 2.94Å; T676-F678 PolarHBondContact O-N 3.3Å; T676-K679 PolarHBondContact O-N 3.28Å; T676-N680 WeakPolarHBondContact O-CB 3.47Å; T676-N680 PolarHBondContact O-N 3.22Å; T676-N680 PolarHBondContact O-ND2 3.27Å; T676-N680 PolarHBondContact O-OD1 3.35Å
677	L	92.6	Very high	81.6	Confident	24 Å²	24	40.8 Å²	40.8	13%	0.126	23%	0.23	C	C	.	.	H	α-helix	trans	-57.5	-47.7	174.9	-175.8	52.3	0	0	0	112.6	L616 K625 E626 A629 V657 S675 S681	L616-L677 HydrophobicContact CD2-CD1 4.48Å; K625-L677 HydrophobicContact CB-CD1 3.81Å; K625-L677 HydrophobicContact CB-CD2 3.8Å; K625-L677 HydrophobicContact CB-CG 4.46Å; K625-L677 HydrophobicContact CD-CD2 4.36Å; K625-L677 WeakPolarHBondContact O-CD1 3.4Å; E626-L677 HydrophobicContact CG-CB 3.72Å; E626-L677 PolarHBondContact OE1-N 2.88Å; A629-L677 HydrophobicContact CB-CD1 3.75Å; V657-L677 HydrophobicContact CG1-CD2 4.36Å; V657-L677 HydrophobicContact CG1-CG 3.79Å; V657-L677 HydrophobicContact CG2-CD1 4.09Å; V657-L677 HydrophobicContact CG2-CD2 4.02Å; V657-L677 HydrophobicContact CG2-CG 3.89Å; S675-L677 PolarHBondContact O-N 3.27Å; L677-S681 VanDerWaalsContact O-CB 3.3Å; L677-S681 WeakPolarHBondContact O-CB 3.11Å; L677-S681 PolarHBondContact O-N 3.37Å; L677-S681 PolarHBondContact O-OG 3.27Å
678	F	93.4	Very high	83.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-67	-44.1	179.1	-172.7	-85.6	0	0	0	111.4	V657 I658 V661 F673 S675 T676 N680 S681 T682 F712 T726	V657-F678 HydrophobicContact CG1-CB 4.24Å; V657-F678 HydrophobicContact CG1-CD2 4.31Å; I658-F678 HydrophobicContact CB-CE2 4.17Å; I658-F678 HydrophobicContact CG1-CD2 4.24Å; I658-F678 HydrophobicContact CG1-CE2 4.07Å; I658-F678 HydrophobicContact CG2-CE2 3.97Å; I658-F678 HydrophobicContact CG2-CZ 4.31Å; V661-F678 HydrophobicContact CG2-CD2 4.3Å; V661-F678 HydrophobicContact CG2-CE2 3.69Å; V661-F678 HydrophobicContact CG2-CZ 4.46Å; F673-F678 HydrophobicContact CD1-CZ 4.39Å; S675-F678 PolarHBondContact O-N 3.47Å; S675-F678 VanDerWaalsContact OG-CB 3.27Å; S675-F678 WeakPolarHBondContact OG-CB 3.46Å; S675-F678 PolarHBondContact OG-N 2.83Å; S675-F678 VanDerWaalsContact OG-N 3.17Å; T676-F678 PolarHBondContact O-N 3.3Å; F678-N680 PolarHBondContact O-N 3.49Å; F678-S681 PolarHBondContact O-N 2.71Å; F678-T682 HydrophobicContact CD1-CG2 4.18Å; F678-T682 HydrophobicContact CE1-CG2 3.85Å; F678-T682 HydrophobicContact CZ-CG2 4.23Å; F678-T682 PolarHBondContact O-N 3.07Å; F678-T682 PolarHBondContact O-OG1 3.37Å; F678-F712 HydrophobicContact CE1-CB 4.48Å; F678-F712 HydrophobicContact CE1-CD1 4.02Å; F678-F712 HydrophobicContact CE1-CD2 4.22Å; F678-F712 HydrophobicContact CE1-CE1 4.36Å; F678-F712 AromaticContact CE1-CG 3.94Å; F678-F712 HydrophobicContact CE1-CG 3.94Å; F678-F712 HydrophobicContact CZ-CB 4.15Å; F678-F712 HydrophobicContact CZ-CD1 4.41Å; F678-F712 HydrophobicContact CZ-CG 4.11Å; F678-T726 HydrophobicContact CD1-CG2 3.51Å; F678-T726 HydrophobicContact CE1-CG2 3.72Å
679	K	95	Very high	85.7	Confident	41 Å²	41	32 Å²	32	18%	0.178	18%	0.175	C	C	.	.	H	α-helix	trans	-56.2	-47.7	174.6	-176.8	-168.4	64.8	166.1	0	112.6	W633 S675 T676 T682 G683 P725 N729	W633-K679 HydrophobicContact CH2-CG 4.42Å; W633-K679 HydrophobicContact CZ3-CD 4.44Å; W633-K679 HydrophobicContact CZ3-CG 4.29Å; S675-K679 PolarHBondContact O-N 3.48Å; S675-K679 VanDerWaalsContact O-N 3.13Å; T676-K679 PolarHBondContact O-N 3.28Å; K679-T682 PolarHBondContact O-OG1 3Å; K679-T682 VanDerWaalsContact O-OG1 3.07Å; K679-G683 PolarHBondContact O-N 3.36Å; K679-G683 VanDerWaalsContact O-N 3.08Å; K679-P725 HydrophobicContact CD-CB 4.43Å; K679-N729 PolarHBondContact O-ND2 3.49Å; K679-N729 VanDerWaalsContact O-ND2 3.12Å
680	N	96.6	Very high	87.3	Confident	8 Å²	8	32.9 Å²	32.9	4%	0.043	18%	0.184	C	C	.	.	H	α-helix	trans	-67.9	-40.2	-179.3	-63.5	-3	0	0	0	110.6	E626 A629 A630 W633 T676 F678 G683 V684	E626-N680 PolarHBondContact O-ND2 3.04Å; A629-N680 HydrophobicContact CB-CB 3.84Å; A630-N680 WeakPolarHBondContact CB-ND2 3.37Å; W633-N680 HydrophobicContact CE3-CB 4.13Å; T676-N680 WeakPolarHBondContact O-CB 3.47Å; T676-N680 PolarHBondContact O-N 3.22Å; T676-N680 PolarHBondContact O-ND2 3.27Å; T676-N680 PolarHBondContact O-OD1 3.35Å; F678-N680 PolarHBondContact O-N 3.49Å; N680-G683 WeakPolarHBondContact O-CA 3.33Å; N680-G683 PolarHBondContact O-N 3.1Å; N680-V684 WeakPolarHBondContact O-CG2 3.26Å; N680-V684 PolarHBondContact O-N 2.87Å
681	S	97.1	Very high	88.4	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.3	-45.5	177.6	-58.3	0	0	0	0	112.2	L677 F678 G683 V684 L685	L677-S681 VanDerWaalsContact O-CB 3.3Å; L677-S681 WeakPolarHBondContact O-CB 3.11Å; L677-S681 PolarHBondContact O-N 3.37Å; L677-S681 PolarHBondContact O-OG 3.27Å; F678-S681 PolarHBondContact O-N 2.71Å; S681-G683 VanDerWaalsContact C-N 3.28Å; S681-G683 PolarHBondContact O-N 3.47Å; S681-V684 PolarHBondContact O-N 3.47Å; S681-L685 WeakPolarHBondContact O-CG 3.42Å; S681-L685 PolarHBondContact O-N 3.46Å; S681-L685 VanDerWaalsContact O-N 3.17Å
682	T	96.6	Very high	89.4	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66.9	-30.3	175	57.5	0	0	0	0	112.2	I658 F678 K679 L685 R686 L709 N729	I658-T682 HydrophobicContact CD1-CG2 3.97Å; I658-T682 HydrophobicContact CG1-CG2 4.39Å; F678-T682 HydrophobicContact CD1-CG2 4.18Å; F678-T682 HydrophobicContact CE1-CG2 3.85Å; F678-T682 HydrophobicContact CZ-CG2 4.23Å; F678-T682 PolarHBondContact O-N 3.07Å; F678-T682 PolarHBondContact O-OG1 3.37Å; K679-T682 PolarHBondContact O-OG1 3Å; K679-T682 VanDerWaalsContact O-OG1 3.07Å; T682-L685 PolarHBondContact O-N 3.48Å; T682-R686 WeakPolarHBondContact O-CB 3.47Å; T682-R686 PolarHBondContact O-N 2.99Å; T682-L709 HydrophobicContact CG2-CD2 3.92Å; T682-N729 WeakPolarHBondContact OG1-CB 3.5Å
683	G	97.2	Very high	90.1	Very high	0 Å²	0	23 Å²	23	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.5	-46.1	172.2	0	0	0	0	0	114.1	W633 K679 N680 S681 L685 R686 N687 N729	W633-G683 VanDerWaalsContact CD1-C 3.42Å; K679-G683 PolarHBondContact O-N 3.36Å; K679-G683 VanDerWaalsContact O-N 3.08Å; N680-G683 WeakPolarHBondContact O-CA 3.33Å; N680-G683 PolarHBondContact O-N 3.1Å; S681-G683 VanDerWaalsContact C-N 3.28Å; S681-G683 PolarHBondContact O-N 3.47Å; G683-L685 VanDerWaalsContact C-N 3.34Å; G683-L685 PolarHBondContact O-N 2.83Å; G683-R686 WeakPolarHBondContact O-CB 3.28Å; G683-R686 PolarHBondContact O-N 2.8Å; G683-N687 PolarHBondContact O-N 2.93Å; G683-N687 VanDerWaalsContact O-N 3.15Å; G683-N729 VanDerWaalsContact CA-ND2 3.3Å; G683-N729 WeakPolarHBondContact CA-ND2 2.82Å; G683-N729 PolarHBondContact N-ND2 2.88Å
684	V	98.1	Very high	90.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-57.1	-49.2	172.3	176.6	0	0	0	0	110.5	L632 W633 I645 L653 N680 S681 N687 V688	L632-V684 HydrophobicContact CB-CG2 3.78Å; W633-V684 HydrophobicContact CB-CG2 3.94Å; I645-V684 HydrophobicContact CG2-CG1 3.67Å; L653-V684 HydrophobicContact CD1-CB 3.79Å; L653-V684 HydrophobicContact CD1-CG1 3.59Å; L653-V684 HydrophobicContact CD1-CG2 4.07Å; N680-V684 WeakPolarHBondContact O-CG2 3.26Å; N680-V684 PolarHBondContact O-N 2.87Å; S681-V684 PolarHBondContact O-N 3.47Å; V684-N687 PolarHBondContact O-N 2.8Å; V684-V688 HydrophobicContact CG1-CG2 4.31Å; V684-V688 WeakPolarHBondContact O-CG2 3.4Å; V684-V688 PolarHBondContact O-N 3.03Å
685	L	98.1	Very high	91.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67.3	-38	-177.8	-62.3	-168	0	0	0	112.4	T650 I658 S681 T682 G683 N687 V688 S689 L699 L705 L733	T650-L685 HydrophobicContact CG2-CD2 3.58Å; I658-L685 HydrophobicContact CD1-CD1 3.52Å; I658-L685 HydrophobicContact CD1-CG 4.37Å; S681-L685 WeakPolarHBondContact O-CG 3.42Å; S681-L685 PolarHBondContact O-N 3.46Å; S681-L685 VanDerWaalsContact O-N 3.17Å; T682-L685 PolarHBondContact O-N 3.48Å; G683-L685 VanDerWaalsContact C-N 3.34Å; G683-L685 PolarHBondContact O-N 2.83Å; L685-N687 VanDerWaalsContact C-N 3.33Å; L685-N687 PolarHBondContact O-N 3.33Å; L685-V688 PolarHBondContact O-N 3.34Å; L685-S689 VanDerWaalsContact O-CB 3.23Å; L685-S689 WeakPolarHBondContact O-CB 3.43Å; L685-S689 PolarHBondContact O-N 3.49Å; L685-S689 PolarHBondContact O-OG 3.48Å; L685-L699 HydrophobicContact CD2-CD2 4Å; L685-L705 HydrophobicContact CD1-CD1 3.72Å; L685-L705 HydrophobicContact CD1-CD2 3.95Å; L685-L733 HydrophobicContact CB-CD1 4.13Å; L685-L733 HydrophobicContact CB-CD2 3.58Å; L685-L733 HydrophobicContact CD1-CD2 4.26Å
686	R	97.2	Very high	92.2	Very high	28 Å²	28	24.2 Å²	24.2	11%	0.106	14%	0.136	C	C	.	.	H	α-helix	trans	-51.1	-54.1	170.4	174.7	-171.1	-172	171.7	-0	110	T682 G683 S689 E728 N729 C732 N736 E815	T682-R686 WeakPolarHBondContact O-CB 3.47Å; T682-R686 PolarHBondContact O-N 2.99Å; G683-R686 WeakPolarHBondContact O-CB 3.28Å; G683-R686 PolarHBondContact O-N 2.8Å; R686-S689 PolarHBondContact O-N 2.77Å; R686-S689 PolarHBondContact O-OG 2.89Å; R686-E728 IonicContact CZ-OE1 3.25Å; R686-E728 VanDerWaalsContact CZ-OE1 3.27Å; R686-E728 IonicContact NH1-OE1 2.68Å; R686-E728 PolarHBondContact NH1-OE1 3.17Å; R686-E728 IonicContact NH2-OE1 3.8Å; R686-E728 PolarHBondContact NH2-OE1 3.35Å; R686-N729 VanDerWaalsContact CD-OD1 3.28Å; R686-N729 WeakPolarHBondContact CD-OD1 3.48Å; R686-N729 PolarHBondContact NH1-OD1 3.42Å; R686-C732 HydrophobicContact CG-CB 3.74Å; R686-C732 VanDerWaalsContact CZ-SG 3.55Å; R686-C732 PolarHBondContact NH2-SG 3.43Å; R686-C732 VanDerWaalsContact NH2-SG 3.44Å; R686-N736 PolarHBondContact O-ND2 3.35Å; R686-E815 IonicContact NH2-OE2 2.89Å; R686-E815 PolarHBondContact NH2-OE2 3.05Å
687	N	96.5	Very high	92.1	Very high	25 Å²	25	24 Å²	24	13%	0.134	13%	0.128	C	C	.	.	H	α-helix	trans	-66.7	-44.5	-175.9	-71.9	-4.1	0	0	0	112.7	S636 G683 V684 L685 S689 A690	S636-N687 WeakPolarHBondContact O-CB 3.41Å; S636-N687 WeakPolarHBondContact OG-CB 3.23Å; S636-N687 PolarHBondContact OG-ND2 2.79Å; S636-N687 VanDerWaalsContact OG-ND2 3.08Å; G683-N687 PolarHBondContact O-N 2.93Å; G683-N687 VanDerWaalsContact O-N 3.15Å; V684-N687 PolarHBondContact O-N 2.8Å; L685-N687 VanDerWaalsContact C-N 3.33Å; L685-N687 PolarHBondContact O-N 3.33Å; N687-S689 PolarHBondContact O-N 2.9Å; N687-A690 WeakPolarHBondContact O-CB 3.4Å; N687-A690 PolarHBondContact O-N 3.28Å
688	V	95.5	Very high	92.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-66.8	-35.8	178.3	174.6	0	0	0	0	111.9	I645 L646 T650 V684 L685 A690 A691 A695	I645-V688 HydrophobicContact CB-CG2 4.14Å; I645-V688 HydrophobicContact CG2-CG2 3.72Å; L646-V688 HydrophobicContact CB-CG1 3.76Å; L646-V688 HydrophobicContact CD1-CG1 3.76Å; L646-V688 HydrophobicContact CG-CG1 4.3Å; T650-V688 HydrophobicContact CG2-CB 4.45Å; T650-V688 HydrophobicContact CG2-CG1 4.02Å; V684-V688 HydrophobicContact CG1-CG2 4.31Å; V684-V688 WeakPolarHBondContact O-CG2 3.4Å; V684-V688 PolarHBondContact O-N 3.03Å; L685-V688 PolarHBondContact O-N 3.34Å; V688-A690 PolarHBondContact O-N 2.85Å; V688-A690 VanDerWaalsContact O-N 3.16Å; V688-A691 VanDerWaalsContact O-CB 3.27Å; V688-A691 WeakPolarHBondContact O-CB 3.38Å; V688-A691 PolarHBondContact O-N 2.88Å; V688-A695 WeakPolarHBondContact O-CB 3.35Å
689	S	94.3	Very high	92.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.3	-18.1	177.9	71.9	0	0	0	0	114.4	L685 R686 N687 R696 N736	L685-S689 VanDerWaalsContact O-CB 3.23Å; L685-S689 WeakPolarHBondContact O-CB 3.43Å; L685-S689 PolarHBondContact O-N 3.49Å; L685-S689 PolarHBondContact O-OG 3.48Å; R686-S689 PolarHBondContact O-N 2.77Å; R686-S689 PolarHBondContact O-OG 2.89Å; N687-S689 PolarHBondContact O-N 2.9Å; S689-R696 WeakPolarHBondContact O-CG 3.32Å; S689-R696 PolarHBondContact O-NH1 3.3Å; S689-N736 VanDerWaalsContact OG-CB 3.24Å; S689-N736 WeakPolarHBondContact OG-CB 3.44Å; S689-N736 PolarHBondContact OG-ND2 2.87Å
690	A	87.8	Confident	92	Very high	50 Å²	50	25.6 Å²	25.6	41%	0.413	13%	0.131	S	C	.	.	H	α-helix	trans	-75.3	-28.9	173	0	0	0	0	0	112.7	N687 V688 S692 R696	N687-A690 WeakPolarHBondContact O-CB 3.4Å; N687-A690 PolarHBondContact O-N 3.28Å; V688-A690 PolarHBondContact O-N 2.85Å; V688-A690 VanDerWaalsContact O-N 3.16Å; A690-S692 PolarHBondContact O-N 2.83Å; A690-R696 PolarHBondContact O-NH1 3.2Å
691	A	79.4	Confident	91.8	Very high	39 Å²	39	30.1 Å²	30.1	32%	0.322	16%	0.155	S	C	.	.	S	Bend	trans	-60.5	-43	-162.1	0	0	0	0	0	115.7	K642 V688 A695	K642-A691 HydrophobicContact CB-CB 3.7Å; K642-A691 HydrophobicContact CD-CB 3.91Å; K642-A691 HydrophobicContact CG-CB 4.37Å; V688-A691 VanDerWaalsContact O-CB 3.27Å; V688-A691 WeakPolarHBondContact O-CB 3.38Å; V688-A691 PolarHBondContact O-N 2.88Å; A691-A695 HydrophobicContact CB-CB 4.34Å
692	S	82.3	Confident	91.6	Very high	36 Å²	36	31 Å²	31	25%	0.252	16%	0.16	S	C	.	.			trans	-163.2	167.4	-178.7	74.4	0	0	0	0	113.2	A690 Q694 A695 R696	A690-S692 PolarHBondContact O-N 2.83Å; S692-Q694 PolarHBondContact O-N 2.96Å; S692-Q694 PolarHBondContact OG-N 3.02Å; S692-A695 PolarHBondContact O-N 3.36Å; S692-A695 PolarHBondContact OG-N 3.35Å; S692-R696 VanDerWaalsContact C-NH2 3.33Å; S692-R696 VanDerWaalsContact O-CZ 3.25Å; S692-R696 PolarHBondContact O-N 2.84Å; S692-R696 VanDerWaalsContact O-N 3.1Å; S692-R696 PolarHBondContact O-NE 2.93Å; S692-R696 PolarHBondContact O-NH1 2.79Å
693	Q	83.2	Confident	91.3	Very high	54 Å²	54	34.8 Å²	34.8	25%	0.252	19%	0.185	S	C	.	.	H	α-helix	trans	-58.8	-34.6	170.7	-163.9	-161	26.1	0	0	111.8	R696 R697 E743	Q693-R696 VanDerWaalsContact N-NH2 3.19Å; Q693-R696 PolarHBondContact O-N 2.96Å; Q693-R697 WeakPolarHBondContact O-CG 3.41Å; Q693-R697 PolarHBondContact O-N 2.79Å; Q693-E743 PolarHBondContact NE2-OE2 3.38Å
694	Q	83.7	Confident	91	Very high	123 Å²	123	38.3 Å²	38.3	58%	0.575	20%	0.203	S	C	*	.	H	α-helix	trans	-69.8	-39.2	177.1	-169.6	-175.2	11.4	0	0	112.2	S692 R696 R697 R698	S692-Q694 PolarHBondContact O-N 2.96Å; S692-Q694 PolarHBondContact OG-N 3.02Å; Q694-R696 VanDerWaalsContact C-N 3.35Å; Q694-R697 PolarHBondContact O-N 3.3Å; Q694-R698 PolarHBondContact O-N 3.33Å
695	A	88.2	Confident	90.9	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.008	20%	0.203	C	C	.	.	H	α-helix	trans	-61.2	-44.7	172.7	0	0	0	0	0	111.2	L646 V688 A691 S692 R697 R698 L699	L646-A695 HydrophobicContact CD1-CB 4.2Å; L646-A695 HydrophobicContact CD2-CB 3.81Å; V688-A695 WeakPolarHBondContact O-CB 3.35Å; A691-A695 HydrophobicContact CB-CB 4.34Å; S692-A695 PolarHBondContact O-N 3.36Å; S692-A695 PolarHBondContact OG-N 3.35Å; A695-R697 VanDerWaalsContact C-N 3.32Å; A695-R697 PolarHBondContact O-N 3.36Å; A695-R698 PolarHBondContact O-N 2.86Å; A695-L699 WeakPolarHBondContact O-CB 3.21Å; A695-L699 VanDerWaalsContact O-CG 3.29Å; A695-L699 WeakPolarHBondContact O-CG 3.39Å; A695-L699 PolarHBondContact O-N 2.76Å
696	R	93	Very high	90.8	Very high	15 Å²	15	38.3 Å²	38.3	6%	0.057	20%	0.204	C	C	.	.	H	α-helix	trans	-62.4	-35.6	174.7	-68.5	179.2	-78	-86.3	10.1	112.8	S689 A690 S692 Q693 Q694 R700 N736 E1011	S689-R696 WeakPolarHBondContact O-CG 3.32Å; S689-R696 PolarHBondContact O-NH1 3.3Å; A690-R696 PolarHBondContact O-NH1 3.2Å; S692-R696 VanDerWaalsContact C-NH2 3.33Å; S692-R696 VanDerWaalsContact O-CZ 3.25Å; S692-R696 PolarHBondContact O-N 2.84Å; S692-R696 VanDerWaalsContact O-N 3.1Å; S692-R696 PolarHBondContact O-NE 2.93Å; S692-R696 PolarHBondContact O-NH1 2.79Å; Q693-R696 VanDerWaalsContact N-NH2 3.19Å; Q693-R696 PolarHBondContact O-N 2.96Å; Q694-R696 VanDerWaalsContact C-N 3.35Å; R696-R700 WeakPolarHBondContact O-CB 3.14Å; R696-R700 VanDerWaalsContact O-CD 3.27Å; R696-R700 WeakPolarHBondContact O-CD 3.3Å; R696-R700 WeakPolarHBondContact O-CG 3.29Å; R696-R700 PolarHBondContact O-N 3.1Å; R696-N736 WeakPolarHBondContact CD-O 3.48Å; R696-E1011 IonicContact NH2-OE1 3.74Å; R696-E1011 IonicContact NH2-OE2 3.32Å; R696-E1011 PolarHBondContact NH2-OE2 2.64Å
697	R	89.4	Confident	90.6	Very high	61 Å²	61	38.3 Å²	38.3	23%	0.23	21%	0.205	C	C	.	.	H	α-helix	trans	-65.1	-61.4	172.2	-79.4	169.5	171.3	-177.6	-8.1	111.1	Q693 Q694 A695 L699 R700 D701 E743 V744	Q693-R697 WeakPolarHBondContact O-CG 3.41Å; Q693-R697 PolarHBondContact O-N 2.79Å; Q694-R697 PolarHBondContact O-N 3.3Å; A695-R697 VanDerWaalsContact C-N 3.32Å; A695-R697 PolarHBondContact O-N 3.36Å; R697-L699 VanDerWaalsContact C-N 3.29Å; R697-L699 PolarHBondContact O-N 3.21Å; R697-L699 VanDerWaalsContact O-N 3.15Å; R697-R700 WeakPolarHBondContact O-CA 3.24Å; R697-R700 VanDerWaalsContact O-CB 3.28Å; R697-R700 WeakPolarHBondContact O-CB 3.36Å; R697-R700 PolarHBondContact O-N 2.6Å; R697-D701 VanDerWaalsContact O-CG 3.26Å; R697-D701 PolarHBondContact O-N 3.06Å; R697-D701 VanDerWaalsContact O-N 3.17Å; R697-D701 VanDerWaalsContact O-OD2 3.05Å; R697-E743 PolarHBondContact NH2-O 2.73Å; R697-V744 HydrophobicContact CG-CG2 3.6Å
698	R	91.2	Very high	90.5	Very high	95 Å²	95	37.1 Å²	37.1	36%	0.358	20%	0.198	S	C	.	.	H	α-helix	trans	-52.4	-44.6	-178.9	-70.2	175.8	84.4	161.7	1.6	112.4	L646 E647 Q694 A695 R700 D701 I702	L646-R698 HydrophobicContact CD1-CB 4.24Å; E647-R698 IonicContact OE1-CZ 3.57Å; E647-R698 IonicContact OE1-NH1 2.91Å; E647-R698 PolarHBondContact OE1-NH1 2.92Å; E647-R698 IonicContact OE1-NH2 2.65Å; Q694-R698 PolarHBondContact O-N 3.33Å; A695-R698 PolarHBondContact O-N 2.86Å; R698-R700 PolarHBondContact O-N 2.98Å; R698-D701 PolarHBondContact O-N 3.19Å; R698-I702 WeakPolarHBondContact O-CG1 3.48Å; R698-I702 PolarHBondContact O-N 3.24Å
699	L	94.4	Very high	90.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-68.1	-28.8	177.7	-67	175.6	0	0	0	114.3	L646 T650 L685 A695 R697 D701 I702 L705 L737	L646-L699 HydrophobicContact CD1-CG 4.37Å; T650-L699 HydrophobicContact CG2-CD2 4.03Å; L685-L699 HydrophobicContact CD2-CD2 4Å; A695-L699 WeakPolarHBondContact O-CB 3.21Å; A695-L699 VanDerWaalsContact O-CG 3.29Å; A695-L699 WeakPolarHBondContact O-CG 3.39Å; A695-L699 PolarHBondContact O-N 2.76Å; R697-L699 VanDerWaalsContact C-N 3.29Å; R697-L699 PolarHBondContact O-N 3.21Å; R697-L699 VanDerWaalsContact O-N 3.15Å; L699-D701 VanDerWaalsContact C-N 3.29Å; L699-I702 HydrophobicContact CD2-CD1 3.81Å; L699-L705 HydrophobicContact CD2-CD2 4.41Å; L699-L737 HydrophobicContact CB-CD2 3.64Å; L699-L737 HydrophobicContact CD1-CD2 4.37Å
700	R	93.2	Very high	90.5	Very high	3 Å²	3	37.5 Å²	37.5	1%	0.011	20%	0.201	C	C	.	.	H	α-helix	trans	-67.9	-31.8	172.1	-84.9	167.3	-168.9	157.4	7.4	112.3	R696 R697 R698 L737 Y739 V744 P792	R696-R700 WeakPolarHBondContact O-CB 3.14Å; R696-R700 VanDerWaalsContact O-CD 3.27Å; R696-R700 WeakPolarHBondContact O-CD 3.3Å; R696-R700 WeakPolarHBondContact O-CG 3.29Å; R696-R700 PolarHBondContact O-N 3.1Å; R697-R700 WeakPolarHBondContact O-CA 3.24Å; R697-R700 VanDerWaalsContact O-CB 3.28Å; R697-R700 WeakPolarHBondContact O-CB 3.36Å; R697-R700 PolarHBondContact O-N 2.6Å; R698-R700 PolarHBondContact O-N 2.98Å; R700-L737 HydrophobicContact CG-CD2 4.34Å; R700-L737 PolarHBondContact NE-O 3.12Å; R700-L737 PolarHBondContact NH2-O 3.47Å; R700-Y739 PolarHBondContact NH2-O 2.79Å; R700-V744 VanDerWaalsContact NH1-CG2 3.26Å; R700-P792 HydrophobicContact CB-CG 3.85Å; R700-P792 HydrophobicContact CG-CB 4.46Å; R700-P792 HydrophobicContact CG-CG 4.33Å
701	D	91.4	Very high	90.8	Very high	102 Å²	102	38.7 Å²	38.7	55%	0.545	20%	0.197	S	C	.	.	H	α-helix	trans	-88	-12.2	-173.6	-54.5	-33.3	0	0	0	112.6	R697 R698 L699 P703	R697-D701 VanDerWaalsContact O-CG 3.26Å; R697-D701 PolarHBondContact O-N 3.06Å; R697-D701 VanDerWaalsContact O-N 3.17Å; R697-D701 VanDerWaalsContact O-OD2 3.05Å; R698-D701 PolarHBondContact O-N 3.19Å; L699-D701 VanDerWaalsContact C-N 3.29Å; D701-P703 WeakPolarHBondContact O-CD 3.49Å
702	I	92.6	Very high	91.5	Very high	19 Å²	19	37.1 Å²	37.1	10%	0.097	18%	0.184	C	C	.	.	S	Bend	trans	-64.2	119.8	173.8	-63.4	-179.4	0	0	0	110	Q655 R698 L699 N704 L705	Q655-I702 VanDerWaalsContact NE2-CG2 3.31Å; R698-I702 WeakPolarHBondContact O-CG1 3.48Å; R698-I702 PolarHBondContact O-N 3.24Å; L699-I702 HydrophobicContact CD2-CD1 3.81Å; I702-N704 PolarHBondContact O-N 3.25Å; I702-L705 HydrophobicContact CB-CB 4.24Å; I702-L705 HydrophobicContact CB-CD2 4.37Å; I702-L705 HydrophobicContact CD1-CD2 4.4Å; I702-L705 HydrophobicContact CG2-CB 4.12Å; I702-L705 PolarHBondContact O-N 2.87Å
703	P	91.3	Very high	92.1	Very high	80 Å²	80	35.5 Å²	35.5	52%	0.519	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	137.4	-179	-26.5	35.2	0	0	0	113	Q655 D701 L705	Q655-P703 PolarHBondContact NE2-O 2.68Å; D701-P703 WeakPolarHBondContact O-CD 3.49Å; P703-L705 PolarHBondContact O-N 3.48Å; P703-L705 VanDerWaalsContact O-N 3.11Å
704	N	91.3	Very high	92.6	Very high	73 Å²	73	34.2 Å²	34.2	39%	0.39	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	-1.4	174.9	-57.3	-61.5	0	0	0	117	A659 L662 I702 E707 A708	A659-N704 HydrophobicContact CB-CB 3.96Å; L662-N704 HydrophobicContact CD1-CB 3.86Å; I702-N704 PolarHBondContact O-N 3.25Å; N704-E707 VanDerWaalsContact CA-OE2 3.29Å; N704-E707 WeakPolarHBondContact CA-OE2 3.33Å; N704-A708 VanDerWaalsContact O-CB 3.24Å; N704-A708 WeakPolarHBondContact O-CB 3.33Å; N704-A708 PolarHBondContact O-N 3.09Å
705	L	94.8	Very high	93	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.8	-48.2	-177.3	175.8	58.9	0	0	0	111.8	I658 L685 L699 I702 P703 A708 L709	I658-L705 HydrophobicContact CB-CD1 4.29Å; I658-L705 HydrophobicContact CD1-CD1 4.1Å; I658-L705 HydrophobicContact CG2-CD1 3.78Å; L685-L705 HydrophobicContact CD1-CD1 3.72Å; L685-L705 HydrophobicContact CD1-CD2 3.95Å; L699-L705 HydrophobicContact CD2-CD2 4.41Å; I702-L705 HydrophobicContact CB-CB 4.24Å; I702-L705 HydrophobicContact CB-CD2 4.37Å; I702-L705 HydrophobicContact CD1-CD2 4.4Å; I702-L705 HydrophobicContact CG2-CB 4.12Å; I702-L705 PolarHBondContact O-N 2.87Å; P703-L705 PolarHBondContact O-N 3.48Å; P703-L705 VanDerWaalsContact O-N 3.11Å; L705-A708 PolarHBondContact O-N 2.85Å; L705-L709 HydrophobicContact CD1-CD1 4.01Å; L705-L709 HydrophobicContact CD1-CG 4.33Å; L705-L709 HydrophobicContact CG-CD1 4.12Å; L705-L709 WeakPolarHBondContact O-CD1 3.48Å; L705-L709 VanDerWaalsContact O-CG 3.25Å; L705-L709 WeakPolarHBondContact O-CG 3.41Å; L705-L709 PolarHBondContact O-N 3.29Å; L705-L709 VanDerWaalsContact O-N 3.12Å
706	I	95.6	Very high	93.2	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-68.9	-41.2	-177.5	-63.5	172.8	0	0	0	110.2	L709 V710 L734 L737 V794 L795	I706-L709 PolarHBondContact O-N 3.44Å; I706-V710 WeakPolarHBondContact O-CB 3.4Å; I706-V710 WeakPolarHBondContact O-CG2 3.38Å; I706-V710 PolarHBondContact O-N 2.91Å; I706-L734 HydrophobicContact CG2-CD2 4.12Å; I706-L737 HydrophobicContact CG1-CD1 4.09Å; I706-V794 HydrophobicContact CG2-CB 3.89Å; I706-V794 HydrophobicContact CG2-CG1 4.02Å; I706-L795 HydrophobicContact CD1-CD1 4.17Å; I706-L795 HydrophobicContact CD1-CD2 4.45Å; I706-L795 HydrophobicContact CD1-CG 4.2Å; I706-L795 HydrophobicContact CG2-CD2 3.73Å; I706-L795 HydrophobicContact CG2-CG 4.01Å
707	E	94.1	Very high	93.2	Very high	27 Å²	27	30.2 Å²	30.2	13%	0.126	15%	0.15	C	C	.	.	H	α-helix	trans	-60	-44.7	175.7	-65.7	89.5	152.5	0	0	111.9	L662 N704 V710 H711 T790 G791 V794	L662-E707 HydrophobicContact CD1-CB 3.62Å; N704-E707 VanDerWaalsContact CA-OE2 3.29Å; N704-E707 WeakPolarHBondContact CA-OE2 3.33Å; E707-V710 PolarHBondContact O-N 2.7Å; E707-H711 VanDerWaalsContact O-CB 3.26Å; E707-H711 WeakPolarHBondContact O-CB 3.41Å; E707-H711 PolarHBondContact O-N 3.32Å; E707-T790 WeakPolarHBondContact OE1-CA 3.44Å; E707-T790 VanDerWaalsContact OE1-CB 3.24Å; E707-T790 WeakPolarHBondContact OE1-CB 3.43Å; E707-G791 PolarHBondContact OE1-N 2.87Å; E707-V794 HydrophobicContact CG-CG2 4.16Å
708	A	93.4	Very high	93.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66.6	-40.3	178.7	0	0	0	0	0	112.4	I658 V661 L662 N704 L705 H711 F712	I658-A708 HydrophobicContact CG2-CB 3.82Å; I658-A708 WeakPolarHBondContact O-CB 3.32Å; V661-A708 HydrophobicContact CB-CB 4.48Å; L662-A708 HydrophobicContact CD1-CB 4.28Å; L662-A708 HydrophobicContact CG-CB 4.12Å; N704-A708 VanDerWaalsContact O-CB 3.24Å; N704-A708 WeakPolarHBondContact O-CB 3.33Å; N704-A708 PolarHBondContact O-N 3.09Å; L705-A708 PolarHBondContact O-N 2.85Å; A708-H711 PolarHBondContact O-N 3.03Å; A708-F712 WeakPolarHBondContact O-CB 3.5Å; A708-F712 PolarHBondContact O-N 3.29Å
709	L	95.8	Very high	93.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.1	-44.5	174.1	-67.6	165.3	0	0	0	111.6	T682 L705 I706 F712 L713 A730 L733 L734	T682-L709 HydrophobicContact CG2-CD2 3.92Å; L705-L709 HydrophobicContact CD1-CD1 4.01Å; L705-L709 HydrophobicContact CD1-CG 4.33Å; L705-L709 HydrophobicContact CG-CD1 4.12Å; L705-L709 WeakPolarHBondContact O-CD1 3.48Å; L705-L709 VanDerWaalsContact O-CG 3.25Å; L705-L709 WeakPolarHBondContact O-CG 3.41Å; L705-L709 PolarHBondContact O-N 3.29Å; L705-L709 VanDerWaalsContact O-N 3.12Å; I706-L709 PolarHBondContact O-N 3.44Å; L709-F712 PolarHBondContact O-N 3.48Å; L709-L713 WeakPolarHBondContact O-CG 3.31Å; L709-L713 PolarHBondContact O-N 2.85Å; L709-A730 HydrophobicContact CD2-CB 3.86Å; L709-L733 HydrophobicContact CD1-CD2 3.54Å; L709-L733 HydrophobicContact CD1-CG 3.93Å; L709-L733 HydrophobicContact CD2-CD2 4.08Å; L709-L733 HydrophobicContact CG-CD2 4.47Å; L709-L734 HydrophobicContact CB-CD1 4.2Å; L709-L734 HydrophobicContact CB-CD2 4.05Å; L709-L734 HydrophobicContact CB-CG 4.23Å; L709-L734 HydrophobicContact CD1-CD2 3.96Å; L709-L734 HydrophobicContact CD1-CG 4.35Å
710	V	95.4	Very high	93.2	Very high	9 Å²	9	40.2 Å²	40.2	6%	0.055	21%	0.213	C	C	.	.	H	α-helix	trans	-66.4	-38.4	177.1	164.9	0	0	0	0	111.9	I706 E707 T714 L734 V794 V800 L803	I706-V710 WeakPolarHBondContact O-CB 3.4Å; I706-V710 WeakPolarHBondContact O-CG2 3.38Å; I706-V710 PolarHBondContact O-N 2.91Å; E707-V710 PolarHBondContact O-N 2.7Å; V710-T714 WeakPolarHBondContact O-CB 3.23Å; V710-T714 PolarHBondContact O-N 2.76Å; V710-T714 PolarHBondContact O-OG1 3.04Å; V710-L734 HydrophobicContact CG2-CD1 4.13Å; V710-V794 HydrophobicContact CB-CG1 4.4Å; V710-V794 HydrophobicContact CG1-CG1 4.4Å; V710-V794 HydrophobicContact CG2-CG1 4.02Å; V710-V800 HydrophobicContact CG1-CG2 3.73Å; V710-V800 HydrophobicContact CG2-CG1 4.1Å; V710-V800 HydrophobicContact CG2-CG2 3.93Å; V710-L803 HydrophobicContact CG1-CD1 3.94Å
711	H	92.9	Very high	93.1	Very high	74 Å²	74	45.7 Å²	45.7	34%	0.343	24%	0.239	S	C	.	.	H	α-helix	trans	-65	-43.5	173.9	-177.6	-120.3	0	0	0	111.6	V661 L662 F673 E707 A708 T714 H715	V661-H711 HydrophobicContact CG1-CB 4.49Å; V661-H711 WeakPolarHBondContact CG1-ND1 3.49Å; L662-H711 HydrophobicContact CD2-CB 3.67Å; F673-H711 AromaticContact CZ-ND1 3.85Å; E707-H711 VanDerWaalsContact O-CB 3.26Å; E707-H711 WeakPolarHBondContact O-CB 3.41Å; E707-H711 PolarHBondContact O-N 3.32Å; A708-H711 PolarHBondContact O-N 3.03Å; H711-T714 PolarHBondContact O-N 2.98Å; H711-H715 PolarHBondContact O-N 2.79Å
712	F	93.6	Very high	93.2	Very high	7 Å²	7	41.2 Å²	41.2	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-58.5	-51.7	173.2	165.4	-116.5	0	0	0	112.2	F673 F678 A708 L709 T714 H715 A716 T726 V727 A730	F673-F712 HydrophobicContact CB-CD2 3.95Å; F673-F712 HydrophobicContact CB-CE2 4.05Å; F673-F712 HydrophobicContact CD1-CB 4Å; F673-F712 AromaticContact CD1-CD2 3.39Å; F673-F712 HydrophobicContact CD1-CD2 3.39Å; F673-F712 HydrophobicContact CD1-CE2 4.3Å; F673-F712 HydrophobicContact CD1-CG 4.06Å; F673-F712 HydrophobicContact CD2-CD2 4.38Å; F673-F712 HydrophobicContact CE1-CB 3.58Å; F673-F712 AromaticContact CE1-CD2 3.82Å; F673-F712 HydrophobicContact CE1-CD2 3.82Å; F673-F712 HydrophobicContact CE1-CG 4.14Å; F673-F712 AromaticContact CG-CD2 3.69Å; F673-F712 HydrophobicContact CG-CD2 3.69Å; F673-F712 HydrophobicContact CG-CE2 4.29Å; F673-F712 HydrophobicContact CZ-CB 4.22Å; F673-F712 HydrophobicContact CZ-CD2 4.49Å; F678-F712 HydrophobicContact CE1-CB 4.48Å; F678-F712 HydrophobicContact CE1-CD1 4.02Å; F678-F712 HydrophobicContact CE1-CD2 4.22Å; F678-F712 HydrophobicContact CE1-CE1 4.36Å; F678-F712 AromaticContact CE1-CG 3.94Å; F678-F712 HydrophobicContact CE1-CG 3.94Å; F678-F712 HydrophobicContact CZ-CB 4.15Å; F678-F712 HydrophobicContact CZ-CD1 4.41Å; F678-F712 HydrophobicContact CZ-CG 4.11Å; A708-F712 WeakPolarHBondContact O-CB 3.5Å; A708-F712 PolarHBondContact O-N 3.29Å; L709-F712 PolarHBondContact O-N 3.48Å; F712-T714 VanDerWaalsContact C-N 3.3Å; F712-T714 PolarHBondContact O-N 3.39Å; F712-H715 WeakPolarHBondContact O-CA 3.31Å; F712-H715 WeakPolarHBondContact O-CB 3.46Å; F712-H715 PolarHBondContact O-N 3.15Å; F712-A716 HydrophobicContact CE2-CB 4.26Å; F712-A716 HydrophobicContact CZ-CB 4.39Å; F712-A716 PolarHBondContact O-N 2.77Å; F712-T726 HydrophobicContact CE1-CG2 3.71Å; F712-T726 WeakPolarHBondContact CE1-O 2.94Å; F712-T726 HydrophobicContact CE2-CG2 4.08Å; F712-T726 HydrophobicContact CZ-CG2 3.4Å; F712-T726 VanDerWaalsContact CZ-CG2 3.4Å; F712-V727 HydrophobicContact CE1-CG2 3.98Å; F712-V727 HydrophobicContact CZ-CG2 3.74Å; F712-A730 HydrophobicContact CD1-CB 3.8Å; F712-A730 HydrophobicContact CE1-CB 3.82Å
713	L	95.1	Very high	93.2	Very high	2 Å²	2	43 Å²	43	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-39.3	178.7	-69.1	-176.2	0	0	0	112.1	L709 H715 A716 I717 V727 A730 V731 L734 L803 L807	L709-L713 WeakPolarHBondContact O-CG 3.31Å; L709-L713 PolarHBondContact O-N 2.85Å; L713-H715 VanDerWaalsContact C-N 3.29Å; L713-H715 PolarHBondContact O-N 3.13Å; L713-A716 PolarHBondContact O-N 2.96Å; L713-I717 WeakPolarHBondContact O-CB 3.33Å; L713-I717 WeakPolarHBondContact O-CD1 3.24Å; L713-I717 VanDerWaalsContact O-CG1 3.32Å; L713-I717 WeakPolarHBondContact O-CG1 3.27Å; L713-I717 PolarHBondContact O-N 3.26Å; L713-V727 HydrophobicContact CD2-CB 4.15Å; L713-V727 HydrophobicContact CD2-CG1 3.76Å; L713-V727 HydrophobicContact CD2-CG2 4Å; L713-A730 HydrophobicContact CD2-CB 4Å; L713-A730 HydrophobicContact CG-CB 4.32Å; L713-V731 HydrophobicContact CD1-CG2 3.75Å; L713-V731 HydrophobicContact CD2-CG2 3.82Å; L713-V731 HydrophobicContact CG-CG2 4.47Å; L713-L734 HydrophobicContact CD1-CD1 3.59Å; L713-L803 HydrophobicContact CB-CD1 4.45Å; L713-L807 HydrophobicContact CD1-CD1 4.5Å
714	T	94.3	Very high	93.3	Very high	26 Å²	26	40.9 Å²	40.9	16%	0.16	21%	0.212	C	C	.	.	H	α-helix	trans	-59.3	-41.2	173.4	-59.2	0	0	0	0	111.4	V710 H711 F712 Q718 H799 L803	V710-T714 WeakPolarHBondContact O-CB 3.23Å; V710-T714 PolarHBondContact O-N 2.76Å; V710-T714 PolarHBondContact O-OG1 3.04Å; H711-T714 PolarHBondContact O-N 2.98Å; F712-T714 VanDerWaalsContact C-N 3.3Å; F712-T714 PolarHBondContact O-N 3.39Å; T714-Q718 WeakPolarHBondContact O-CB 3.36Å; T714-Q718 WeakPolarHBondContact O-CG 3.5Å; T714-Q718 PolarHBondContact O-N 2.78Å; T714-Q718 VanDerWaalsContact O-N 3.14Å; T714-H799 PolarHBondContact OG1-CE1 3.45Å; T714-L803 WeakPolarHBondContact OG1-CD1 3.46Å
715	H	91.8	Very high	93.3	Very high	27 Å²	27	40.2 Å²	40.2	13%	0.125	21%	0.212	C	C	.	.	H	α-helix	trans	-69.2	-45.9	176	-171.4	81.4	0	0	0	112.7	T670 F673 H711 F712 L713 I717 Q718 K719	T670-H715 WeakPolarHBondContact CG2-CE1 3.4Å; F673-H715 HydrophobicContact CD2-CB 4.15Å; F673-H715 AromaticContact CD2-CD2 3.49Å; F673-H715 VanDerWaalsContact CD2-CD2 3.49Å; F673-H715 WeakPolarHBondContact CD2-CD2 3.06Å; F673-H715 AromaticContact CD2-CG 3.8Å; F673-H715 HydrophobicContact CE2-CB 3.56Å; F673-H715 AromaticContact CE2-CD2 3.7Å; F673-H715 AromaticContact CE2-CG 3.48Å; F673-H715 VanDerWaalsContact CE2-CG 3.48Å; F673-H715 HydrophobicContact CZ-CB 4.18Å; H711-H715 PolarHBondContact O-N 2.79Å; F712-H715 WeakPolarHBondContact O-CA 3.31Å; F712-H715 WeakPolarHBondContact O-CB 3.46Å; F712-H715 PolarHBondContact O-N 3.15Å; L713-H715 VanDerWaalsContact C-N 3.29Å; L713-H715 PolarHBondContact O-N 3.13Å; H715-I717 VanDerWaalsContact C-N 3.32Å; H715-I717 PolarHBondContact O-N 3.01Å; H715-Q718 CarbonylContact O-C 3.57Å; H715-Q718 WeakPolarHBondContact O-CB 3.44Å; H715-Q718 PolarHBondContact O-N 2.75Å; H715-Q718 VanDerWaalsContact O-N 3.09Å; H715-K719 WeakPolarHBondContact CE1-CE 3.42Å; H715-K719 VanDerWaalsContact NE2-CE 3.26Å; H715-K719 WeakPolarHBondContact NE2-CE 3.24Å; H715-K719 WeakPolarHBondContact NE2-CG 3.43Å; H715-K719 WeakPolarHBondContact O-CG 3.31Å; H715-K719 PolarHBondContact O-N 2.6Å
716	A	92.2	Very high	93.3	Very high	2 Å²	2	40.8 Å²	40.8	2%	0.017	22%	0.216	C	C	.	.	H	α-helix	trans	-58.9	-43.3	179.8	0	0	0	0	0	111.6	F712 L713 K719 S720 Q721 V727	F712-A716 HydrophobicContact CE2-CB 4.26Å; F712-A716 HydrophobicContact CZ-CB 4.39Å; F712-A716 PolarHBondContact O-N 2.77Å; L713-A716 PolarHBondContact O-N 2.96Å; A716-K719 CarbonylContact O-C 3.5Å; A716-K719 PolarHBondContact O-N 3.47Å; A716-K719 VanDerWaalsContact O-N 3.16Å; A716-S720 PolarHBondContact O-N 3.44Å; A716-Q721 PolarHBondContact O-N 3.3Å; A716-V727 HydrophobicContact CB-CG2 3.5Å; A716-V727 VanDerWaalsContact CB-CG2 3.5Å
717	I	94.3	Very high	93.3	Very high	26 Å²	26	40.8 Å²	40.8	13%	0.133	22%	0.215	C	C	.	.	H	α-helix	trans	-64.3	-41.5	174.1	-66.9	160.4	0	0	0	111.2	L713 H715 K719 S720 V722 L803 K806 L807	L713-I717 WeakPolarHBondContact O-CB 3.33Å; L713-I717 WeakPolarHBondContact O-CD1 3.24Å; L713-I717 VanDerWaalsContact O-CG1 3.32Å; L713-I717 WeakPolarHBondContact O-CG1 3.27Å; L713-I717 PolarHBondContact O-N 3.26Å; H715-I717 VanDerWaalsContact C-N 3.32Å; H715-I717 PolarHBondContact O-N 3.01Å; I717-K719 PolarHBondContact O-N 3.32Å; I717-S720 PolarHBondContact O-N 3.07Å; I717-S720 VanDerWaalsContact O-N 3.16Å; I717-V722 HydrophobicContact CB-CG1 4.47Å; I717-V722 HydrophobicContact CG1-CG1 3.86Å; I717-L803 HydrophobicContact CD1-CB 4.18Å; I717-L803 HydrophobicContact CD1-CD2 3.83Å; I717-K806 HydrophobicContact CG2-CG 3.72Å; I717-L807 HydrophobicContact CD1-CD2 4.05Å; I717-L807 HydrophobicContact CD1-CG 3.96Å; I717-L807 HydrophobicContact CG1-CD2 3.95Å; I717-L807 HydrophobicContact CG1-CG 4.39Å
718	Q	92.3	Very high	93.4	Very high	145 Å²	145	39.9 Å²	39.9	68%	0.678	21%	0.211	S	C	*	.	H	α-helix	trans	-64.7	-18.6	174.6	-74.9	172.5	13.4	0	0	114	T714 H715	T714-Q718 WeakPolarHBondContact O-CB 3.36Å; T714-Q718 WeakPolarHBondContact O-CG 3.5Å; T714-Q718 PolarHBondContact O-N 2.78Å; T714-Q718 VanDerWaalsContact O-N 3.14Å; H715-Q718 CarbonylContact O-C 3.57Å; H715-Q718 WeakPolarHBondContact O-CB 3.44Å; H715-Q718 PolarHBondContact O-N 2.75Å; H715-Q718 VanDerWaalsContact O-N 3.09Å
719	K	90.3	Very high	93.6	Very high	119 Å²	119	40 Å²	40	52%	0.517	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-0.3	176	-65.9	-65.9	-172.3	169.5	0	113.7	H715 A716 I717 Q721	H715-K719 WeakPolarHBondContact CE1-CE 3.42Å; H715-K719 VanDerWaalsContact NE2-CE 3.26Å; H715-K719 WeakPolarHBondContact NE2-CE 3.24Å; H715-K719 WeakPolarHBondContact NE2-CG 3.43Å; H715-K719 WeakPolarHBondContact O-CG 3.31Å; H715-K719 PolarHBondContact O-N 2.6Å; A716-K719 CarbonylContact O-C 3.5Å; A716-K719 PolarHBondContact O-N 3.47Å; A716-K719 VanDerWaalsContact O-N 3.16Å; I717-K719 PolarHBondContact O-N 3.32Å; K719-Q721 HydrophobicContact CB-CB 4.39Å; K719-Q721 HydrophobicContact CB-CG 3.96Å; K719-Q721 PolarHBondContact O-N 3.48Å
720	S	91.9	Very high	93.7	Very high	103 Å²	103	40 Å²	40	72%	0.72	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	29.8	-169.9	-51.6	0	0	0	0	114.2	A716 I717 V722	A716-S720 PolarHBondContact O-N 3.44Å; I717-S720 PolarHBondContact O-N 3.07Å; I717-S720 VanDerWaalsContact O-N 3.16Å; S720-V722 VanDerWaalsContact C-N 3.34Å; S720-V722 PolarHBondContact O-N 3.16Å
721	Q	90.9	Very high	93.8	Very high	117 Å²	117	39.6 Å²	39.6	55%	0.547	21%	0.209	S	C	.	.			trans	-98.3	39.1	180	-68.9	-178.8	-23.9	0	0	112.3	A716 K719 D723 S724	A716-Q721 PolarHBondContact O-N 3.3Å; K719-Q721 HydrophobicContact CB-CB 4.39Å; K719-Q721 HydrophobicContact CB-CG 3.96Å; K719-Q721 PolarHBondContact O-N 3.48Å; Q721-D723 PolarHBondContact O-N 2.99Å; Q721-S724 PolarHBondContact O-OG 3.21Å
722	V	92.9	Very high	94	Very high	8 Å²	8	36.1 Å²	36.1	5%	0.048	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-27.3	-170.1	-65.7	0	0	0	0	114.3	I717 S720 V727 L807 D810	I717-V722 HydrophobicContact CB-CG1 4.47Å; I717-V722 HydrophobicContact CG1-CG1 3.86Å; S720-V722 VanDerWaalsContact C-N 3.34Å; S720-V722 PolarHBondContact O-N 3.16Å; V722-V727 WeakPolarHBondContact O-CB 3.39Å; V722-V727 WeakPolarHBondContact O-CG1 3.46Å; V722-L807 HydrophobicContact CB-CD2 4Å; V722-L807 HydrophobicContact CG1-CD2 3.93Å; V722-D810 HydrophobicContact CG1-CB 4.36Å; V722-D810 HydrophobicContact CG2-CB 4.14Å; V722-D810 WeakPolarHBondContact CG2-O 3.43Å
723	D	93.5	Very high	94.2	Very high	57 Å²	57	35.8 Å²	35.8	31%	0.305	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	10.8	-177	-67	-34	0	0	0	114.2	Q721 S811 S812 N813	Q721-D723 PolarHBondContact O-N 2.99Å; D723-S811 WeakPolarHBondContact OD1-CA 3.31Å; D723-S811 WeakPolarHBondContact OD1-CB 3.27Å; D723-S811 PolarHBondContact OD1-OG 3.11Å; D723-S812 VanDerWaalsContact CG-N 3.28Å; D723-S812 VanDerWaalsContact CG-OG 3.31Å; D723-S812 PolarHBondContact OD1-N 3.28Å; D723-S812 WeakPolarHBondContact OD2-CB 3.21Å; D723-S812 PolarHBondContact OD2-N 3.11Å; D723-S812 PolarHBondContact OD2-OG 2.97Å; D723-N813 HydrophobicContact CB-CB 4.17Å; D723-N813 WeakPolarHBondContact OD1-CB 3.47Å; D723-N813 PolarHBondContact OD1-N 2.76Å
724	S	92.3	Very high	94.3	Very high	35 Å²	35	35.7 Å²	35.7	25%	0.245	19%	0.192	C	C	.	.	S	Bend	trans	-70	142.5	177.7	64.7	0	0	0	0	112.1	Q721 T726 V727 E728	Q721-S724 PolarHBondContact O-OG 3.21Å; S724-T726 PolarHBondContact O-N 3.37Å; S724-V727 WeakPolarHBondContact O-CA 3.31Å; S724-V727 WeakPolarHBondContact O-CB 3.41Å; S724-V727 PolarHBondContact O-N 3.11Å; S724-V727 WeakPolarHBondContact OG-CG2 3.43Å; S724-V727 PolarHBondContact OG-N 3.19Å; S724-E728 PolarHBondContact O-N 3.29Å; S724-E728 VanDerWaalsContact O-N 3.13Å
725	P	92.4	Very high	94.5	Very high	59 Å²	59	37.5 Å²	37.5	38%	0.383	20%	0.195	S	C	.	.	H	α-helix	trans	-58.5	-21.9	176.3	-27.4	35.4	0	0	0	114.1	K679 N729	K679-P725 HydrophobicContact CD-CB 4.43Å; P725-N729 WeakPolarHBondContact O-CB 3.17Å; P725-N729 PolarHBondContact O-N 2.94Å
726	T	94.2	Very high	94.7	Very high	13 Å²	13	37 Å²	37	8%	0.08	19%	0.194	C	C	.	.	H	α-helix	trans	-70.3	-38.9	172.7	-47.5	0	0	0	0	111.8	F678 F712 S724 A730	F678-T726 HydrophobicContact CD1-CG2 3.51Å; F678-T726 HydrophobicContact CE1-CG2 3.72Å; F712-T726 HydrophobicContact CE1-CG2 3.71Å; F712-T726 WeakPolarHBondContact CE1-O 2.94Å; F712-T726 HydrophobicContact CE2-CG2 4.08Å; F712-T726 HydrophobicContact CZ-CG2 3.4Å; F712-T726 VanDerWaalsContact CZ-CG2 3.4Å; S724-T726 PolarHBondContact O-N 3.37Å; T726-A730 WeakPolarHBondContact O-CB 3.31Å; T726-A730 PolarHBondContact O-N 3.37Å
727	V	96.2	Very high	94.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.8	-50.1	171.6	166.8	0	0	0	0	109.8	F712 L713 A716 V722 S724 N729 A730 V731 L807 T816	F712-V727 HydrophobicContact CE1-CG2 3.98Å; F712-V727 HydrophobicContact CZ-CG2 3.74Å; L713-V727 HydrophobicContact CD2-CB 4.15Å; L713-V727 HydrophobicContact CD2-CG1 3.76Å; L713-V727 HydrophobicContact CD2-CG2 4Å; A716-V727 HydrophobicContact CB-CG2 3.5Å; A716-V727 VanDerWaalsContact CB-CG2 3.5Å; V722-V727 WeakPolarHBondContact O-CB 3.39Å; V722-V727 WeakPolarHBondContact O-CG1 3.46Å; S724-V727 WeakPolarHBondContact O-CA 3.31Å; S724-V727 WeakPolarHBondContact O-CB 3.41Å; S724-V727 PolarHBondContact O-N 3.11Å; S724-V727 WeakPolarHBondContact OG-CG2 3.43Å; S724-V727 PolarHBondContact OG-N 3.19Å; V727-N729 PolarHBondContact O-N 3.36Å; V727-A730 PolarHBondContact O-N 3.03Å; V727-A730 VanDerWaalsContact O-N 3.07Å; V727-V731 HydrophobicContact CG1-CG2 3.92Å; V727-V731 VanDerWaalsContact O-CG2 3.28Å; V727-V731 WeakPolarHBondContact O-CG2 3.31Å; V727-V731 PolarHBondContact O-N 3.16Å; V727-L807 HydrophobicContact CG1-CD2 3.91Å; V727-T816 HydrophobicContact CG1-CG2 4.07Å
728	E	96.4	Very high	94.8	Very high	9 Å²	9	35.7 Å²	35.7	4%	0.042	19%	0.187	C	C	.	.	H	α-helix	trans	-50.9	-54.3	175.8	-171.6	-163.7	121.9	0	0	111.4	R686 S724 A730 V731 C732 N813 E815	R686-E728 IonicContact CZ-OE1 3.25Å; R686-E728 VanDerWaalsContact CZ-OE1 3.27Å; R686-E728 IonicContact NH1-OE1 2.68Å; R686-E728 PolarHBondContact NH1-OE1 3.17Å; R686-E728 IonicContact NH2-OE1 3.8Å; R686-E728 PolarHBondContact NH2-OE1 3.35Å; S724-E728 PolarHBondContact O-N 3.29Å; S724-E728 VanDerWaalsContact O-N 3.13Å; E728-A730 VanDerWaalsContact C-N 3.33Å; E728-A730 PolarHBondContact O-N 3.18Å; E728-V731 PolarHBondContact O-N 2.71Å; E728-C732 WeakPolarHBondContact O-CB 3.36Å; E728-C732 PolarHBondContact O-N 2.95Å; E728-C732 PolarHBondContact O-SG 3.34Å; E728-N813 PolarHBondContact OE2-ND2 2.99Å; E728-E815 HydrophobicContact CG-CB 3.55Å
729	N	96.9	Very high	94.8	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.011	17%	0.166	C	C	.	.	H	α-helix	trans	-56	-43.7	176.7	-83	-14.6	0	0	0	113	W633 K679 T682 G683 R686 P725 V727 L733	W633-N729 WeakPolarHBondContact CH2-ND2 3.45Å; W633-N729 VanDerWaalsContact CZ2-ND2 3.34Å; W633-N729 WeakPolarHBondContact CZ2-ND2 3.28Å; K679-N729 PolarHBondContact O-ND2 3.49Å; K679-N729 VanDerWaalsContact O-ND2 3.12Å; T682-N729 WeakPolarHBondContact OG1-CB 3.5Å; G683-N729 VanDerWaalsContact CA-ND2 3.3Å; G683-N729 WeakPolarHBondContact CA-ND2 2.82Å; G683-N729 PolarHBondContact N-ND2 2.88Å; R686-N729 VanDerWaalsContact CD-OD1 3.28Å; R686-N729 WeakPolarHBondContact CD-OD1 3.48Å; R686-N729 PolarHBondContact NH1-OD1 3.42Å; P725-N729 WeakPolarHBondContact O-CB 3.17Å; P725-N729 PolarHBondContact O-N 2.94Å; V727-N729 PolarHBondContact O-N 3.36Å; N729-L733 VanDerWaalsContact O-CB 3.26Å; N729-L733 WeakPolarHBondContact O-CB 3.47Å; N729-L733 PolarHBondContact O-N 3Å
730	A	97.4	Very high	94.4	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-69	-40	-179.8	0	0	0	0	0	112.8	L709 F712 L713 T726 V727 E728 L734	L709-A730 HydrophobicContact CD2-CB 3.86Å; F712-A730 HydrophobicContact CD1-CB 3.8Å; F712-A730 HydrophobicContact CE1-CB 3.82Å; L713-A730 HydrophobicContact CD2-CB 4Å; L713-A730 HydrophobicContact CG-CB 4.32Å; T726-A730 WeakPolarHBondContact O-CB 3.31Å; T726-A730 PolarHBondContact O-N 3.37Å; V727-A730 PolarHBondContact O-N 3.03Å; V727-A730 VanDerWaalsContact O-N 3.07Å; E728-A730 VanDerWaalsContact C-N 3.33Å; E728-A730 PolarHBondContact O-N 3.18Å; A730-L734 VanDerWaalsContact O-CG 3.32Å; A730-L734 WeakPolarHBondContact O-CG 3.42Å; A730-L734 PolarHBondContact O-N 3.38Å
731	V	97.8	Very high	94.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-70.8	-44	177.6	-176	0	0	0	0	110.3	L713 V727 E728 L733 L734 R735 Y804 L807 A819	L713-V731 HydrophobicContact CD1-CG2 3.75Å; L713-V731 HydrophobicContact CD2-CG2 3.82Å; L713-V731 HydrophobicContact CG-CG2 4.47Å; V727-V731 HydrophobicContact CG1-CG2 3.92Å; V727-V731 VanDerWaalsContact O-CG2 3.28Å; V727-V731 WeakPolarHBondContact O-CG2 3.31Å; V727-V731 PolarHBondContact O-N 3.16Å; E728-V731 PolarHBondContact O-N 2.71Å; V731-L733 VanDerWaalsContact C-N 3.3Å; V731-L733 PolarHBondContact O-N 3.21Å; V731-L734 PolarHBondContact O-N 2.73Å; V731-R735 VanDerWaalsContact O-CB 3.31Å; V731-R735 WeakPolarHBondContact O-CB 3.33Å; V731-R735 PolarHBondContact O-N 3.02Å; V731-Y804 HydrophobicContact CG1-CD1 4.49Å; V731-L807 HydrophobicContact CG2-CD1 3.55Å; V731-A819 HydrophobicContact CB-CB 4.14Å; V731-A819 HydrophobicContact CG1-CB 3.57Å
732	C	97.5	Very high	93.3	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.014	9%	0.089	C	C	.	.	H	α-helix	trans	-58.8	-41.1	174.4	-66.6	0	0	0	0	112	R686 E728 R735 N736 A819	R686-C732 HydrophobicContact CG-CB 3.74Å; R686-C732 VanDerWaalsContact CZ-SG 3.55Å; R686-C732 PolarHBondContact NH2-SG 3.43Å; R686-C732 VanDerWaalsContact NH2-SG 3.44Å; E728-C732 WeakPolarHBondContact O-CB 3.36Å; E728-C732 PolarHBondContact O-N 2.95Å; E728-C732 PolarHBondContact O-SG 3.34Å; C732-R735 PolarHBondContact O-N 3.15Å; C732-N736 VanDerWaalsContact O-CG 3.29Å; C732-N736 PolarHBondContact O-N 3.02Å; C732-A819 HydrophobicContact CB-CB 4.39Å
733	L	98.1	Very high	92.2	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-62	-50.2	173.6	176.9	53.4	0	0	0	111.4	L685 L709 N729 V731 R735 N736 L737	L685-L733 HydrophobicContact CB-CD1 4.13Å; L685-L733 HydrophobicContact CB-CD2 3.58Å; L685-L733 HydrophobicContact CD1-CD2 4.26Å; L709-L733 HydrophobicContact CD1-CD2 3.54Å; L709-L733 HydrophobicContact CD1-CG 3.93Å; L709-L733 HydrophobicContact CD2-CD2 4.08Å; L709-L733 HydrophobicContact CG-CD2 4.47Å; N729-L733 VanDerWaalsContact O-CB 3.26Å; N729-L733 WeakPolarHBondContact O-CB 3.47Å; N729-L733 PolarHBondContact O-N 3Å; V731-L733 VanDerWaalsContact C-N 3.3Å; V731-L733 PolarHBondContact O-N 3.21Å; L733-R735 VanDerWaalsContact C-N 3.31Å; L733-R735 PolarHBondContact O-N 3.4Å; L733-N736 PolarHBondContact O-N 2.78Å; L733-L737 HydrophobicContact CD1-CD1 3.99Å; L733-L737 HydrophobicContact CD1-CD2 4.41Å; L733-L737 HydrophobicContact CD1-CG 3.97Å; L733-L737 HydrophobicContact CG-CD1 4.16Å; L733-L737 HydrophobicContact CG-CG 4.49Å; L733-L737 WeakPolarHBondContact O-CG 3.24Å; L733-L737 PolarHBondContact O-N 3.34Å
734	L	97.9	Very high	90.8	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63.8	-32.7	176.9	-67.8	175.1	0	0	0	113	I706 L709 V710 L713 A730 V731 L737 S738 L795 Y804	I706-L734 HydrophobicContact CG2-CD2 4.12Å; L709-L734 HydrophobicContact CB-CD1 4.2Å; L709-L734 HydrophobicContact CB-CD2 4.05Å; L709-L734 HydrophobicContact CB-CG 4.23Å; L709-L734 HydrophobicContact CD1-CD2 3.96Å; L709-L734 HydrophobicContact CD1-CG 4.35Å; V710-L734 HydrophobicContact CG2-CD1 4.13Å; L713-L734 HydrophobicContact CD1-CD1 3.59Å; A730-L734 VanDerWaalsContact O-CG 3.32Å; A730-L734 WeakPolarHBondContact O-CG 3.42Å; A730-L734 PolarHBondContact O-N 3.38Å; V731-L734 PolarHBondContact O-N 2.73Å; L734-L737 PolarHBondContact O-N 3.46Å; L734-S738 VanDerWaalsContact O-CB 3.3Å; L734-S738 WeakPolarHBondContact O-CB 3.26Å; L734-S738 PolarHBondContact O-N 3.43Å; L734-S738 PolarHBondContact O-OG 3.21Å; L734-L795 HydrophobicContact CD2-CD2 3.66Å; L734-Y804 HydrophobicContact CB-CE1 4.43Å; L734-Y804 HydrophobicContact CD1-CE1 4.49Å
735	R	97.3	Very high	89.4	Confident	63 Å²	63	19.5 Å²	19.5	24%	0.238	10%	0.098	C	C	.	.	H	α-helix	trans	-62.2	-44.4	172.6	179.9	-97.8	-95.3	165.9	-9.7	111.3	V731 C732 L733 S738 Y739 E818 A819 A823 N826	V731-R735 VanDerWaalsContact O-CB 3.31Å; V731-R735 WeakPolarHBondContact O-CB 3.33Å; V731-R735 PolarHBondContact O-N 3.02Å; C732-R735 PolarHBondContact O-N 3.15Å; L733-R735 VanDerWaalsContact C-N 3.31Å; L733-R735 PolarHBondContact O-N 3.4Å; R735-S738 PolarHBondContact O-N 3.19Å; R735-Y739 PolarHBondContact O-N 2.86Å; R735-E818 IonicContact CZ-OE1 3.69Å; R735-E818 IonicContact CZ-OE2 2.78Å; R735-E818 VanDerWaalsContact CZ-OE2 3.29Å; R735-E818 IonicContact NE-OE1 3.85Å; R735-E818 IonicContact NE-OE2 2.68Å; R735-E818 PolarHBondContact NE-OE2 3.44Å; R735-E818 VanDerWaalsContact NE-OE2 3.07Å; R735-E818 VanDerWaalsContact NH2-CD 3.28Å; R735-E818 IonicContact NH2-OE1 2.67Å; R735-E818 PolarHBondContact NH2-OE1 2.85Å; R735-E818 IonicContact NH2-OE2 3.64Å; R735-E818 PolarHBondContact NH2-OE2 3.47Å; R735-A819 HydrophobicContact CB-CB 4.31Å; R735-A819 WeakPolarHBondContact CB-O 3.45Å; R735-A819 WeakPolarHBondContact CG-O 3.46Å; R735-A823 HydrophobicContact CB-CB 4.2Å; R735-N826 PolarHBondContact O-ND2 3.47Å
736	N	96.3	Very high	87.8	Confident	17 Å²	17	19 Å²	19	9%	0.091	9%	0.093	C	C	.	.	H	α-helix	trans	-69.1	-43.6	175.3	-69.5	-10.6	0	0	0	112.1	R686 S689 R696 C732 L733 S738 Y739	R686-N736 PolarHBondContact O-ND2 3.35Å; S689-N736 VanDerWaalsContact OG-CB 3.24Å; S689-N736 WeakPolarHBondContact OG-CB 3.44Å; S689-N736 PolarHBondContact OG-ND2 2.87Å; R696-N736 WeakPolarHBondContact CD-O 3.48Å; C732-N736 VanDerWaalsContact O-CG 3.29Å; C732-N736 PolarHBondContact O-N 3.02Å; L733-N736 PolarHBondContact O-N 2.78Å; N736-S738 PolarHBondContact O-N 3.49Å; N736-Y739 WeakPolarHBondContact O-CB 3.43Å; N736-Y739 PolarHBondContact O-N 3.21Å
737	L	95.2	Very high	86	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-66.1	-20.2	174.6	-62.9	-179.3	0	0	0	112.6	L699 R700 I706 L733 L734 L795	L699-L737 HydrophobicContact CB-CD2 3.64Å; L699-L737 HydrophobicContact CD1-CD2 4.37Å; R700-L737 HydrophobicContact CG-CD2 4.34Å; R700-L737 PolarHBondContact NE-O 3.12Å; R700-L737 PolarHBondContact NH2-O 3.47Å; I706-L737 HydrophobicContact CG1-CD1 4.09Å; L733-L737 HydrophobicContact CD1-CD1 3.99Å; L733-L737 HydrophobicContact CD1-CD2 4.41Å; L733-L737 HydrophobicContact CD1-CG 3.97Å; L733-L737 HydrophobicContact CG-CD1 4.16Å; L733-L737 HydrophobicContact CG-CG 4.49Å; L733-L737 WeakPolarHBondContact O-CG 3.24Å; L733-L737 PolarHBondContact O-N 3.34Å; L734-L737 PolarHBondContact O-N 3.46Å; L737-L795 HydrophobicContact CB-CD1 4.29Å; L737-L795 WeakPolarHBondContact O-CD1 3.3Å
738	S	93.8	Very high	83.8	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-81.2	-18.2	171.8	-60.7	0	0	0	0	114	L734 R735 N736 R740 I741	L734-S738 VanDerWaalsContact O-CB 3.3Å; L734-S738 WeakPolarHBondContact O-CB 3.26Å; L734-S738 PolarHBondContact O-N 3.43Å; L734-S738 PolarHBondContact O-OG 3.21Å; R735-S738 PolarHBondContact O-N 3.19Å; N736-S738 PolarHBondContact O-N 3.49Å; S738-R740 PolarHBondContact O-N 3.05Å; S738-I741 PolarHBondContact O-N 2.86Å
739	Y	91.1	Very high	81.8	Confident	63 Å²	63	31.9 Å²	31.9	25%	0.247	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	119.1	-175.6	-179.7	-100.9	0	0	0	112.1	R700 R735 N736 I741	R700-Y739 PolarHBondContact NH2-O 2.79Å; R735-Y739 PolarHBondContact O-N 2.86Å; N736-Y739 WeakPolarHBondContact O-CB 3.43Å; N736-Y739 PolarHBondContact O-N 3.21Å; Y739-I741 VanDerWaalsContact C-N 3.3Å; Y739-I741 PolarHBondContact O-N 2.68Å
740	R	83	Confident	79.8	Confident	39 Å²	39	35.6 Å²	35.6	15%	0.147	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	42.9	-174.6	-63.2	170.3	171.4	-127.2	19.9	113.3	S738 Q742 E743 G1009	S738-R740 PolarHBondContact O-N 3.05Å; R740-Q742 VanDerWaalsContact C-OE1 3.3Å; R740-Q742 PolarHBondContact O-N 3.07Å; R740-E743 HydrophobicContact CB-CG 4.29Å; R740-E743 WeakPolarHBondContact CD-OE1 3.27Å; R740-E743 WeakPolarHBondContact CD-OE2 3.42Å; R740-E743 IonicContact CZ-OE1 3.07Å; R740-E743 IonicContact NE-OE1 2.68Å; R740-E743 IonicContact NH1-OE1 2.87Å; R740-E743 PolarHBondContact NH1-OE1 3.09Å; R740-E743 IonicContact NH1-OE2 3.77Å; R740-E743 PolarHBondContact O-N 3.35Å; R740-G1009 PolarHBondContact NH2-O 3.32Å
741	I	84.3	Confident	77.3	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.015	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-32	179.8	-173.6	58.5	0	0	0	113.2	S738 Y739 E743 V744 V745 P792 L795 W796 L827	S738-I741 PolarHBondContact O-N 2.86Å; Y739-I741 VanDerWaalsContact C-N 3.3Å; Y739-I741 PolarHBondContact O-N 2.68Å; I741-E743 VanDerWaalsContact C-N 3.29Å; I741-E743 PolarHBondContact O-N 3.17Å; I741-V744 PolarHBondContact O-N 3.49Å; I741-V745 HydrophobicContact CD1-CG2 4.37Å; I741-V745 HydrophobicContact CG1-CG2 4.31Å; I741-V745 WeakPolarHBondContact O-CG2 3.46Å; I741-P792 HydrophobicContact CD1-CB 3.99Å; I741-L795 HydrophobicContact CD1-CD1 3.85Å; I741-L795 HydrophobicContact CG1-CD1 4.35Å; I741-W796 HydrophobicContact CD1-CZ3 4.26Å; I741-W796 HydrophobicContact CG1-CE3 3.98Å; I741-W796 HydrophobicContact CG1-CZ3 3.65Å; I741-L827 HydrophobicContact CG2-CD2 4.13Å
742	Q	75.7	Confident	74.5	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-63.3	-30.1	-177.4	74.2	-68.9	-16	0	0	113.5	R740 V744 V745 D746 Y749 F832	R740-Q742 VanDerWaalsContact C-OE1 3.3Å; R740-Q742 PolarHBondContact O-N 3.07Å; Q742-V744 PolarHBondContact O-N 3.34Å; Q742-V745 PolarHBondContact O-N 3.33Å; Q742-D746 PolarHBondContact O-N 3.27Å; Q742-Y749 HydrophobicContact CB-CD2 4.34Å; Q742-Y749 HydrophobicContact CB-CG 4.35Å; Q742-Y749 HydrophobicContact CG-CD1 3.51Å; Q742-Y749 HydrophobicContact CG-CD2 3.73Å; Q742-Y749 HydrophobicContact CG-CE1 3.59Å; Q742-Y749 HydrophobicContact CG-CE2 3.81Å; Q742-Y749 HydrophobicContact CG-CG 3.6Å; Q742-F832 HydrophobicContact CB-CB 4.06Å; Q742-F832 HydrophobicContact CB-CD1 3.68Å; Q742-F832 HydrophobicContact CB-CD2 3.95Å; Q742-F832 HydrophobicContact CB-CE1 4.01Å; Q742-F832 HydrophobicContact CB-CE2 4.29Å; Q742-F832 HydrophobicContact CB-CG 3.66Å; Q742-F832 HydrophobicContact CB-CZ 4.32Å
743	E	68.7	Low	71.9	Confident	31 Å²	31	43.6 Å²	43.6	15%	0.145	25%	0.246	C	C	.	.	H	α-helix	trans	-72.9	5	-179.4	-61.5	170.4	-175.4	0	0	114.6	Q693 R697 R740 I741 Y749	Q693-E743 PolarHBondContact NE2-OE2 3.38Å; R697-E743 PolarHBondContact NH2-O 2.73Å; R740-E743 HydrophobicContact CB-CG 4.29Å; R740-E743 WeakPolarHBondContact CD-OE1 3.27Å; R740-E743 WeakPolarHBondContact CD-OE2 3.42Å; R740-E743 IonicContact CZ-OE1 3.07Å; R740-E743 IonicContact NE-OE1 2.68Å; R740-E743 IonicContact NH1-OE1 2.87Å; R740-E743 PolarHBondContact NH1-OE1 3.09Å; R740-E743 IonicContact NH1-OE2 3.77Å; R740-E743 PolarHBondContact O-N 3.35Å; I741-E743 VanDerWaalsContact C-N 3.29Å; I741-E743 PolarHBondContact O-N 3.17Å; E743-Y749 HydrophobicContact CG-CD1 4.28Å
744	V	64.9	Low	69.3	Low	44 Å²	44	44.4 Å²	44.4	27%	0.267	25%	0.253	S	S	.	.	H	α-helix	trans	-121	-26.6	174.7	-180	0	0	0	0	111.2	R697 R700 I741 Q742	R697-V744 HydrophobicContact CG-CG2 3.6Å; R700-V744 VanDerWaalsContact NH1-CG2 3.26Å; I741-V744 PolarHBondContact O-N 3.49Å; Q742-V744 PolarHBondContact O-N 3.34Å
745	V	62.9	Low	66.4	Low	62 Å²	62	48.2 Å²	48.2	38%	0.376	27%	0.271	S	S	.	.	H	α-helix	trans	-96.8	-28.7	-174.7	-176.1	0	0	0	0	111.6	I741 Q742 W796 F832	I741-V745 HydrophobicContact CD1-CG2 4.37Å; I741-V745 HydrophobicContact CG1-CG2 4.31Å; I741-V745 WeakPolarHBondContact O-CG2 3.46Å; Q742-V745 PolarHBondContact O-N 3.33Å; V745-W796 HydrophobicContact CB-CH2 4.25Å; V745-W796 HydrophobicContact CG1-CH2 3.74Å; V745-W796 HydrophobicContact CG1-CZ2 4.29Å; V745-W796 HydrophobicContact CG2-CH2 3.57Å; V745-W796 HydrophobicContact CG2-CZ3 3.81Å; V745-F832 HydrophobicContact CB-CZ 3.93Å; V745-F832 HydrophobicContact CG1-CZ 3.81Å
746	D	59	Low	63.3	Low	50 Å²	50	49.6 Å²	49.6	27%	0.267	29%	0.29	S	S	.	.			trans	-127.2	95	173.3	-177.7	6.4	0	0	0	109.5	Q742 N748 Y749 F832	Q742-D746 PolarHBondContact O-N 3.27Å; D746-N748 PolarHBondContact O-N 3.16Å; D746-N748 VanDerWaalsContact O-N 3.12Å; D746-N748 WeakPolarHBondContact OD1-CA 3.41Å; D746-N748 WeakPolarHBondContact OD1-CB 3.36Å; D746-N748 PolarHBondContact OD1-N 2.75Å; D746-Y749 VanDerWaalsContact O-CB 3.23Å; D746-Y749 WeakPolarHBondContact O-CB 3.25Å; D746-Y749 PolarHBondContact O-N 3.01Å; D746-Y749 PolarHBondContact OD1-N 3.25Å; D746-F832 HydrophobicContact CB-CD2 4.5Å; D746-F832 HydrophobicContact CB-CE2 4.01Å
747	P	56.7	Low	60.2	Low	117 Å²	117	52.7 Å²	52.7	76%	0.76	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.6	174.3	-24.8	35.4	0	0	0	113.9
748	N	49.2	Very low	57.2	Low	142 Å²	142	57.5 Å²	57.5	76%	0.759	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	11.1	177.8	-48.7	-81.9	0	0	0	112.3	D746 D750	D746-N748 PolarHBondContact O-N 3.16Å; D746-N748 VanDerWaalsContact O-N 3.12Å; D746-N748 WeakPolarHBondContact OD1-CA 3.41Å; D746-N748 WeakPolarHBondContact OD1-CB 3.36Å; D746-N748 PolarHBondContact OD1-N 2.75Å; N748-D750 VanDerWaalsContact C-N 3.33Å; N748-D750 PolarHBondContact O-N 3.19Å
749	Y	55.1	Low	54.3	Low	32 Å²	32	62.2 Å²	62.2	13%	0.125	38%	0.38	C	S	.	.			trans	-66.2	88.9	175.8	177.8	-99.6	0	0	0	110.9	Q742 E743 D746 P751 C830 S1006	Q742-Y749 HydrophobicContact CB-CD2 4.34Å; Q742-Y749 HydrophobicContact CB-CG 4.35Å; Q742-Y749 HydrophobicContact CG-CD1 3.51Å; Q742-Y749 HydrophobicContact CG-CD2 3.73Å; Q742-Y749 HydrophobicContact CG-CE1 3.59Å; Q742-Y749 HydrophobicContact CG-CE2 3.81Å; Q742-Y749 HydrophobicContact CG-CG 3.6Å; E743-Y749 HydrophobicContact CG-CD1 4.28Å; D746-Y749 VanDerWaalsContact O-CB 3.23Å; D746-Y749 WeakPolarHBondContact O-CB 3.25Å; D746-Y749 PolarHBondContact O-N 3.01Å; D746-Y749 PolarHBondContact OD1-N 3.25Å; Y749-P751 HydrophobicContact CD1-CG 4.49Å; Y749-P751 HydrophobicContact CE1-CG 4.15Å; Y749-P751 VanDerWaalsContact O-CD 3.31Å; Y749-P751 WeakPolarHBondContact O-CD 3.41Å; Y749-C830 HydrophobicContact CE2-CB 4.17Å; Y749-C830 WeakPolarHBondContact OH-CB 3.35Å; Y749-S1006 PolarHBondContact OH-OG 3.3Å
750	D	53.2	Low	51.4	Low	81 Å²	81	68.5 Å²	68.5	43%	0.433	41%	0.408	S	S	.	.			trans	-78.8	116.5	171.6	174.7	23.6	0	0	0	111.1	N748 A752 A753	N748-D750 VanDerWaalsContact C-N 3.33Å; N748-D750 PolarHBondContact O-N 3.19Å; D750-A752 PolarHBondContact O-N 3.36Å; D750-A752 VanDerWaalsContact OD1-CB 3.3Å; D750-A752 WeakPolarHBondContact OD1-CB 3.44Å; D750-A752 PolarHBondContact OD1-N 3.27Å; D750-A753 HydrophobicContact CB-CB 3.98Å; D750-A753 VanDerWaalsContact OD2-CB 3.28Å; D750-A753 WeakPolarHBondContact OD2-CB 3.26Å; D750-A753 PolarHBondContact OD2-N 2.66Å
751	P	45.3	Very low	48.8	Very low	60 Å²	60	74 Å²	74	39%	0.39	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-21.5	174.2	-18.2	33	0	0	0	113.6	Y749 H755	Y749-P751 HydrophobicContact CD1-CG 4.49Å; Y749-P751 HydrophobicContact CE1-CG 4.15Å; Y749-P751 VanDerWaalsContact O-CD 3.31Å; Y749-P751 WeakPolarHBondContact O-CD 3.41Å; P751-H755 PolarHBondContact O-CE1 3.46Å; P751-H755 VanDerWaalsContact O-CE1 3.3Å; P751-H755 PolarHBondContact O-ND1 3.05Å; P751-H755 VanDerWaalsContact O-ND1 3.1Å
752	A	39.1	Very low	46	Very low	62 Å²	62	83.3 Å²	83.3	51%	0.512	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-41.6	179.8	0	0	0	0	0	112.2	D750 A754 H755	D750-A752 PolarHBondContact O-N 3.36Å; D750-A752 VanDerWaalsContact OD1-CB 3.3Å; D750-A752 WeakPolarHBondContact OD1-CB 3.44Å; D750-A752 PolarHBondContact OD1-N 3.27Å; A752-A754 PolarHBondContact O-N 3.13Å; A752-A754 VanDerWaalsContact O-N 3.08Å; A752-H755 VanDerWaalsContact O-CB 3.28Å; A752-H755 WeakPolarHBondContact O-CB 3.43Å; A752-H755 PolarHBondContact O-N 3.33Å; A752-H755 PolarHBondContact O-ND1 2.69Å
753	A	44	Very low	43.7	Very low	47 Å²	47	92.1 Å²	92.1	39%	0.388	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-52.5	-31.9	175.8	0	0	0	0	0	113.5	D750 H755 S756	D750-A753 HydrophobicContact CB-CB 3.98Å; D750-A753 VanDerWaalsContact OD2-CB 3.28Å; D750-A753 WeakPolarHBondContact OD2-CB 3.26Å; D750-A753 PolarHBondContact OD2-N 2.66Å; A753-H755 PolarHBondContact O-N 3.16Å; A753-S756 PolarHBondContact O-N 3.25Å; A753-S756 PolarHBondContact O-OG 3.01Å; A753-S756 VanDerWaalsContact O-OG 3.1Å
754	A	42.8	Very low	41.9	Very low	17 Å²	17	99.8 Å²	99.8	14%	0.14	56%	0.56	C	S	.	*	G	3₁₀ helix	trans	-58.9	-13.8	173.1	0	0	0	0	0	114.6	A752 Q831 P1004	A752-A754 PolarHBondContact O-N 3.13Å; A752-A754 VanDerWaalsContact O-N 3.08Å; A754-Q831 PolarHBondContact O-NE2 3.28Å; A754-P1004 HydrophobicContact CB-CG 4.39Å
755	H	37.6	Very low	39.9	Very low	81 Å²	81	104.5 Å²	104.5	38%	0.375	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-96.3	-20.2	177.6	-59	70.9	0	0	0	113.1	P751 A752 A753 S758	P751-H755 PolarHBondContact O-CE1 3.46Å; P751-H755 VanDerWaalsContact O-CE1 3.3Å; P751-H755 PolarHBondContact O-ND1 3.05Å; P751-H755 VanDerWaalsContact O-ND1 3.1Å; A752-H755 VanDerWaalsContact O-CB 3.28Å; A752-H755 WeakPolarHBondContact O-CB 3.43Å; A752-H755 PolarHBondContact O-N 3.33Å; A752-H755 PolarHBondContact O-ND1 2.69Å; A753-H755 PolarHBondContact O-N 3.16Å; H755-S758 PolarHBondContact O-OG 3.49Å
756	S	31.9	Very low	38.2	Very low	91 Å²	91	105.7 Å²	105.7	64%	0.636	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-21.2	-172.4	70.5	0	0	0	0	114.8	A753 S758	A753-S756 PolarHBondContact O-N 3.25Å; A753-S756 PolarHBondContact O-OG 3.01Å; A753-S756 VanDerWaalsContact O-OG 3.1Å; S756-S758 PolarHBondContact O-N 2.98Å
757	S	30.4	Very low	36.6	Very low	82 Å²	82	108.8 Å²	108.8	57%	0.573	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	7.6	-177.4	61.1	0	0	0	0	115.3	S759	S757-S759 PolarHBondContact O-N 2.85Å
758	S	32.9	Very low	35.3	Very low	102 Å²	102	109.2 Å²	109.2	71%	0.713	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	13.6	-175.3	60.6	0	0	0	0	114.9	H755 S756	H755-S758 PolarHBondContact O-OG 3.49Å; S756-S758 PolarHBondContact O-N 2.98Å
759	S	31.7	Very low	34.1	Very low	99 Å²	99	111.5 Å²	111.5	69%	0.692	64%	0.636	S	S	*	*	S	Bend	trans	-155.8	148.9	169.1	-95.8	0	0	0	0	114.4	S757	S757-S759 PolarHBondContact O-N 2.85Å
760	K	32	Very low	32.9	Very low	195 Å²	195	116.1 Å²	116.1	85%	0.848	67%	0.67	S	S	*	*	S	Bend	trans	66.6	65.4	173.3	-53.7	170.8	-173.6	169.3	0	116.6
761	N	27.9	Very low	31.7	Very low	154 Å²	154	121.4 Å²	121.4	82%	0.824	69%	0.692	S	S	*	*				-175.9	80.3	117.2	-92.4	-27.7	0	0	0	113.7
762	M	25.3	Very low	30.9	Very low	199 Å²	199	128.3 Å²	128.3	98%	0.98	72%	0.716	S	S	*	*			trans	-116.3	94.3	152.1	-77.6	-169.7	72.6	0	0	109.1
763	K	26.7	Very low	30.9	Very low	186 Å²	186	135.4 Å²	135.4	81%	0.809	74%	0.736	S	S	*	*			trans	-107.6	135.4	159	-79.7	-173.5	174.8	-179.7	0	108.2	V765	K763-V765 PolarHBondContact O-N 2.93Å
764	H	30.8	Very low	30.1	Very low	192 Å²	192	143.2 Å²	143.2	89%	0.889	76%	0.761	S	S	*	*			trans	-23.1	118	-173.7	-59.1	-83.3	0	0	0	117.3
765	V	24.4	Very low	29.9	Very low	144 Å²	144	151.4 Å²	151.4	87%	0.873	79%	0.793	S	S	*	*			trans	-107	121.2	142.6	179	0	0	0	0	106.3	K763	K763-V765 PolarHBondContact O-N 2.93Å
766	A	26	Very low	29.6	Very low	86 Å²	86	154.3 Å²	154.3	71%	0.711	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-78.7	150.3	-176.7	0	0	0	0	0	111.9	P768	A766-P768 WeakPolarHBondContact O-CD 3.49Å
767	S	25	Very low	29.8	Very low	115 Å²	115	158.7 Å²	158.7	80%	0.804	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-62.8	125	-176.7	-44.5	0	0	0	0	112.8	K769	S767-K769 PolarHBondContact O-N 3.12Å
768	P	29.4	Very low	29.8	Very low	126 Å²	126	163.7 Å²	163.7	82%	0.818	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-69.2	127.3	168.3	-16.8	31.3	0	0	0	110.7	A766	A766-P768 WeakPolarHBondContact O-CD 3.49Å
769	K	25.1	Very low	29.9	Very low	191 Å²	191	168.3 Å²	168.3	83%	0.83	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-76.5	152.5	165.3	-76.4	-177.8	177.4	177.8	0	110.1	S767 E771	S767-K769 PolarHBondContact O-N 3.12Å; K769-E771 PolarHBondContact O-N 2.96Å
770	P	30.2	Very low	29.9	Very low	128 Å²	128	172.8 Å²	172.8	83%	0.831	85%	0.848	S	S	*	*			trans	-77.6	115.1	-179.2	30.4	-34	0	0	0	111.8
771	E	28	Very low	29.8	Very low	192 Å²	192	172.8 Å²	172.8	90%	0.897	85%	0.847	S	S	*	*			trans	-106.7	163.3	169.4	-70	-143.2	123.3	0	0	113.1	K769	K769-E771 PolarHBondContact O-N 2.96Å
772	K	28.4	Very low	30.2	Very low	206 Å²	206	173.6 Å²	173.6	90%	0.896	85%	0.852	S	S	*	*			trans	-92.8	148.5	-158.6	-65.9	172.6	-178.2	171.3	0	113
773	K	39	Very low	30.9	Very low	211 Å²	211	172.9 Å²	172.9	92%	0.917	84%	0.843	S	S	*	*			trans	-51.7	136	174.4	-62.4	175.9	-179.7	175.4	0	112.6
774	K	27.3	Very low	31.2	Very low	211 Å²	211	170.8 Å²	170.8	92%	0.917	84%	0.841	S	S	*	*			trans	-140.8	154.7	136.8	-116.7	178.6	-178.7	-178.7	0	110.3
775	K	37.3	Very low	31.5	Very low	188 Å²	188	166.6 Å²	166.6	82%	0.817	83%	0.831	S	S	*	*			trans	-86.7	153.6	178.9	-53.3	171.7	178	172.4	0	108.6
776	D	31.8	Very low	32.4	Very low	143 Å²	143	169.1 Å²	169.1	77%	0.765	83%	0.83	S	S	*	*				-156.6	177.8	94.4	-118.5	-49.7	0	0	0	113.4
777	K	37.3	Very low	33.5	Very low	183 Å²	183	171.5 Å²	171.5	80%	0.796	83%	0.831	S	S	*	*			trans	-90.6	145.7	-162.8	-53.4	150.2	-173.6	158.4	0	112.8
778	E	29.3	Very low	35.4	Very low	186 Å²	186	173.1 Å²	173.1	87%	0.869	83%	0.829	S	S	*	*			trans	-136.7	143.4	136.4	-147.9	177.7	-137.5	0	0	110.5
779	K	35.5	Very low	37.7	Very low	199 Å²	199	169.9 Å²	169.9	87%	0.865	81%	0.806	S	S	*	*			trans	-98.5	114.7	-178.4	-73.5	-179.6	176.3	179.2	0	110.2
780	K	31.8	Very low	40.4	Very low	194 Å²	194	164.5 Å²	164.5	84%	0.843	79%	0.79	S	S	*	*			trans	-110.3	152.8	148.2	-82.4	180	177.3	172	0	109.6	D782	K780-D782 PolarHBondContact O-N 3.26Å
781	K	29.4	Very low	43.1	Very low	194 Å²	194	159.4 Å²	159.4	84%	0.843	76%	0.76	S	S	*	*			trans	-82.8	116.2	-162.8	-64.5	169.8	-179.5	170.9	0	110.8	K783	K781-K783 PolarHBondContact O-N 2.99Å
782	D	36.3	Very low	45.9	Very low	171 Å²	171	151.6 Å²	151.6	91%	0.914	73%	0.726	S	S	*	*			trans	-67.6	85.6	155.8	-75.7	-46.2	0	0	0	109.3	K780	K780-D782 PolarHBondContact O-N 3.26Å
783	K	40.2	Very low	48.9	Very low	185 Å²	185	143.6 Å²	143.6	80%	0.804	70%	0.696	S	S	*	*			trans	-145	57.4	166.6	-79	-152	173.4	-164.2	0	110.5	K781	K781-K783 PolarHBondContact O-N 2.99Å
784	N	31.9	Very low	51.4	Low	141 Å²	141	134.1 Å²	134.1	75%	0.754	66%	0.656	S	S	*	*	S	Bend	trans	-102.9	138	142.9	-120.6	17.7	0	0	0	106.8
785	P	38.5	Very low	54.5	Low	104 Å²	104	124 Å²	124	68%	0.675	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-60	154.9	165.5	29.2	-33.6	0	0	0	108.9	N787	P785-N787 PolarHBondContact O-N 3.25Å
786	K	43.9	Very low	57.1	Low	198 Å²	198	116.3 Å²	116.3	86%	0.861	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-55.9	125.7	170.8	-61.7	176.3	-178.3	177.8	0	107.6	I788	K786-I788 PolarHBondContact O-N 3.05Å
787	N	48.2	Very low	60	Low	136 Å²	136	112.1 Å²	112.1	73%	0.727	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-56.2	117.8	166.6	-80.7	7.8	0	0	0	107	P785 V789	P785-N787 PolarHBondContact O-N 3.25Å; N787-V789 PolarHBondContact O-N 2.86Å; N787-V789 VanDerWaalsContact O-N 3.15Å
788	I	64.1	Low	62.6	Low	148 Å²	148	106.6 Å²	106.6	76%	0.759	54%	0.537	S	S	*	.			trans	-72.6	109.8	174.7	-57.6	178.8	0	0	0	105.2	K786 T790	K786-I788 PolarHBondContact O-N 3.05Å; I788-T790 HydrophobicContact CG2-CG2 4.04Å; I788-T790 PolarHBondContact O-N 3.48Å
789	V	78.1	Confident	65.7	Low	58 Å²	58	102.4 Å²	102.4	35%	0.352	52%	0.517	S	S	.	.			trans	-71.4	125.8	177.6	-177.5	0	0	0	0	107.6	N787 S793 V794 Q797	N787-V789 PolarHBondContact O-N 2.86Å; N787-V789 VanDerWaalsContact O-N 3.15Å; V789-S793 WeakPolarHBondContact CG1-OG 3.28Å; V789-V794 HydrophobicContact CG1-CG2 4.1Å; V789-V794 WeakPolarHBondContact O-CG2 3.44Å; V789-Q797 HydrophobicContact CB-CG 4.46Å; V789-Q797 HydrophobicContact CG1-CG 3.9Å
790	T	83.1	Confident	68.5	Low	79 Å²	79	93 Å²	93	49%	0.485	48%	0.476	S	S	.	.			trans	-133.5	165.6	-174.9	52.3	0	0	0	0	112	E707 I788 S793	E707-T790 WeakPolarHBondContact OE1-CA 3.44Å; E707-T790 VanDerWaalsContact OE1-CB 3.24Å; E707-T790 WeakPolarHBondContact OE1-CB 3.43Å; I788-T790 HydrophobicContact CG2-CG2 4.04Å; I788-T790 PolarHBondContact O-N 3.48Å; T790-S793 PolarHBondContact O-OG 2.89Å
791	G	84.9	Confident	71.6	Confident	20 Å²	20	83.7 Å²	83.7	21%	0.206	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	61.4	-148.2	179.4	0	0	0	0	0	112.9	E707 S793 V794	E707-G791 PolarHBondContact OE1-N 2.87Å; G791-S793 PolarHBondContact O-N 3.5Å; G791-V794 WeakPolarHBondContact O-CB 3.46Å; G791-V794 WeakPolarHBondContact O-CG2 3.46Å; G791-V794 PolarHBondContact O-N 3.11Å; G791-V794 VanDerWaalsContact O-N 3.13Å
792	P	88.7	Confident	74.8	Confident	29 Å²	29	79.1 Å²	79.1	19%	0.188	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-60.1	-24	-172.8	-25.2	36.1	0	0	0	114.2	R700 I741 V794 L795 W796	R700-P792 HydrophobicContact CB-CG 3.85Å; R700-P792 HydrophobicContact CG-CB 4.46Å; R700-P792 HydrophobicContact CG-CG 4.33Å; I741-P792 HydrophobicContact CD1-CB 3.99Å; P792-V794 PolarHBondContact O-N 2.94Å; P792-L795 WeakPolarHBondContact O-CB 3.44Å; P792-L795 WeakPolarHBondContact O-CG 3.45Å; P792-L795 PolarHBondContact O-N 3.46Å; P792-W796 VanDerWaalsContact O-CZ3 3.27Å; P792-W796 WeakPolarHBondContact O-CZ3 3.21Å
793	S	89.4	Confident	77.7	Confident	37 Å²	37	71.6 Å²	71.6	26%	0.259	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-66.9	-13	180	72.9	0	0	0	0	115.3	V789 T790 G791 W796 Q797	V789-S793 WeakPolarHBondContact CG1-OG 3.28Å; T790-S793 PolarHBondContact O-OG 2.89Å; G791-S793 PolarHBondContact O-N 3.5Å; S793-W796 VanDerWaalsContact CA-CH2 3.4Å; S793-Q797 WeakPolarHBondContact O-CG 3.48Å; S793-Q797 PolarHBondContact O-NE2 3.1Å
794	V	92.7	Very high	80.4	Confident	12 Å²	12	62.9 Å²	62.9	7%	0.073	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-68	-35.1	172.9	176.7	0	0	0	0	111.6	I706 E707 V710 V789 G791 P792 W796 Q797 V800	I706-V794 HydrophobicContact CG2-CB 3.89Å; I706-V794 HydrophobicContact CG2-CG1 4.02Å; E707-V794 HydrophobicContact CG-CG2 4.16Å; V710-V794 HydrophobicContact CB-CG1 4.4Å; V710-V794 HydrophobicContact CG1-CG1 4.4Å; V710-V794 HydrophobicContact CG2-CG1 4.02Å; V789-V794 HydrophobicContact CG1-CG2 4.1Å; V789-V794 WeakPolarHBondContact O-CG2 3.44Å; G791-V794 WeakPolarHBondContact O-CB 3.46Å; G791-V794 WeakPolarHBondContact O-CG2 3.46Å; G791-V794 PolarHBondContact O-N 3.11Å; G791-V794 VanDerWaalsContact O-N 3.13Å; P792-V794 PolarHBondContact O-N 2.94Å; V794-W796 VanDerWaalsContact C-N 3.27Å; V794-W796 PolarHBondContact O-N 2.84Å; V794-W796 VanDerWaalsContact O-N 3.15Å; V794-Q797 WeakPolarHBondContact O-CB 3.39Å; V794-Q797 WeakPolarHBondContact O-CG 3.4Å; V794-Q797 PolarHBondContact O-N 3.44Å; V794-Q797 VanDerWaalsContact O-N 3.12Å; V794-V800 HydrophobicContact CG1-CG2 4.08Å; V794-V800 VanDerWaalsContact O-CG2 3.3Å; V794-V800 WeakPolarHBondContact O-CG2 3.24Å
795	L	93.1	Very high	83.6	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-34.7	-171.2	-67.9	170.9	0	0	0	114.2	I706 L734 L737 I741 P792 L827	I706-L795 HydrophobicContact CD1-CD1 4.17Å; I706-L795 HydrophobicContact CD1-CD2 4.45Å; I706-L795 HydrophobicContact CD1-CG 4.2Å; I706-L795 HydrophobicContact CG2-CD2 3.73Å; I706-L795 HydrophobicContact CG2-CG 4.01Å; L734-L795 HydrophobicContact CD2-CD2 3.66Å; L737-L795 HydrophobicContact CB-CD1 4.29Å; L737-L795 WeakPolarHBondContact O-CD1 3.3Å; I741-L795 HydrophobicContact CD1-CD1 3.85Å; I741-L795 HydrophobicContact CG1-CD1 4.35Å; P792-L795 WeakPolarHBondContact O-CB 3.44Å; P792-L795 WeakPolarHBondContact O-CG 3.45Å; P792-L795 PolarHBondContact O-N 3.46Å; L795-L827 HydrophobicContact CB-CD2 4.39Å; L795-L827 WeakPolarHBondContact O-CD1 3.34Å
796	W	91.1	Very high	86.4	Confident	26 Å²	26	55 Å²	55	10%	0.098	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	5.4	-176.8	63.1	81.1	0	0	0	114.4	I741 V745 P792 S793 V794 L827 P834 V838	I741-W796 HydrophobicContact CD1-CZ3 4.26Å; I741-W796 HydrophobicContact CG1-CE3 3.98Å; I741-W796 HydrophobicContact CG1-CZ3 3.65Å; V745-W796 HydrophobicContact CB-CH2 4.25Å; V745-W796 HydrophobicContact CG1-CH2 3.74Å; V745-W796 HydrophobicContact CG1-CZ2 4.29Å; V745-W796 HydrophobicContact CG2-CH2 3.57Å; V745-W796 HydrophobicContact CG2-CZ3 3.81Å; P792-W796 VanDerWaalsContact O-CZ3 3.27Å; P792-W796 WeakPolarHBondContact O-CZ3 3.21Å; S793-W796 VanDerWaalsContact CA-CH2 3.4Å; V794-W796 VanDerWaalsContact C-N 3.27Å; V794-W796 PolarHBondContact O-N 2.84Å; V794-W796 VanDerWaalsContact O-N 3.15Å; W796-L827 HydrophobicContact CB-CD2 4.27Å; W796-P834 HydrophobicContact CB-CB 4.39Å; W796-P834 HydrophobicContact CD2-CB 4.07Å; W796-P834 HydrophobicContact CG-CB 3.82Å; W796-P834 HydrophobicContact CZ2-CG 4.34Å; W796-V838 HydrophobicContact CB-CG2 3.8Å
797	Q	92.7	Very high	89	Confident	55 Å²	55	45.5 Å²	45.5	26%	0.257	25%	0.245	S	C	.	.	S	Bend	trans	-63.8	142.5	179.5	-65.5	-55.9	-52.6	0	0	111.1	V789 S793 V794 H799 V800 V801	V789-Q797 HydrophobicContact CB-CG 4.46Å; V789-Q797 HydrophobicContact CG1-CG 3.9Å; S793-Q797 WeakPolarHBondContact O-CG 3.48Å; S793-Q797 PolarHBondContact O-NE2 3.1Å; V794-Q797 WeakPolarHBondContact O-CB 3.39Å; V794-Q797 WeakPolarHBondContact O-CG 3.4Å; V794-Q797 PolarHBondContact O-N 3.44Å; V794-Q797 VanDerWaalsContact O-N 3.12Å; Q797-H799 PolarHBondContact O-N 3.42Å; Q797-V800 HydrophobicContact CB-CG2 4.38Å; Q797-V800 PolarHBondContact O-N 2.73Å; Q797-V801 PolarHBondContact O-N 3.42Å
798	P	92.1	Very high	91.4	Very high	67 Å²	67	39.3 Å²	39.3	44%	0.435	21%	0.211	S	C	.	.	H	α-helix	trans	-55	-31.3	-179.4	-28.6	35.5	0	0	0	114.1	K802 A841	P798-K802 WeakPolarHBondContact O-CB 3.26Å; P798-K802 PolarHBondContact O-N 2.8Å; P798-A841 HydrophobicContact CB-CB 4.24Å
799	H	93.4	Very high	92.9	Very high	97 Å²	97	37 Å²	37	45%	0.449	20%	0.197	S	C	.	.	H	α-helix	trans	-59.5	-45	170.7	161.7	25.2	0	0	0	112.7	T714 Q797 K802 L803	T714-H799 PolarHBondContact OG1-CE1 3.45Å; Q797-H799 PolarHBondContact O-N 3.42Å; H799-K802 WeakPolarHBondContact O-CB 3.39Å; H799-K802 PolarHBondContact O-N 3.33Å; H799-L803 WeakPolarHBondContact O-CG 3.25Å; H799-L803 PolarHBondContact O-N 3.49Å; H799-L803 VanDerWaalsContact O-N 3.13Å
800	V	95.8	Very high	93.8	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-74.9	-37.5	-177.8	-178.7	0	0	0	0	110.6	V710 V794 Q797 K802 L803 Y804	V710-V800 HydrophobicContact CG1-CG2 3.73Å; V710-V800 HydrophobicContact CG2-CG1 4.1Å; V710-V800 HydrophobicContact CG2-CG2 3.93Å; V794-V800 HydrophobicContact CG1-CG2 4.08Å; V794-V800 VanDerWaalsContact O-CG2 3.3Å; V794-V800 WeakPolarHBondContact O-CG2 3.24Å; Q797-V800 HydrophobicContact CB-CG2 4.38Å; Q797-V800 PolarHBondContact O-N 2.73Å; V800-K802 PolarHBondContact O-N 3.36Å; V800-L803 WeakPolarHBondContact O-CB 3.24Å; V800-L803 PolarHBondContact O-N 2.69Å; V800-Y804 HydrophobicContact CG1-CE2 3.73Å; V800-Y804 WeakPolarHBondContact O-CD2 3.07Å; V800-Y804 PolarHBondContact O-N 3.4Å; V800-Y804 VanDerWaalsContact O-N 3.16Å
801	V	95.8	Very high	94.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-55.7	-41.3	168.3	179.1	0	0	0	0	111.3	Q797 L803 Y804 L805 V838 A841 V842	Q797-V801 PolarHBondContact O-N 3.42Å; V801-L803 VanDerWaalsContact C-N 3.34Å; V801-L803 PolarHBondContact O-N 2.98Å; V801-Y804 PolarHBondContact O-N 3.12Å; V801-L805 HydrophobicContact CG1-CD1 4.36Å; V801-L805 WeakPolarHBondContact O-CG 3.45Å; V801-L805 PolarHBondContact O-N 2.94Å; V801-L805 VanDerWaalsContact O-N 3.07Å; V801-V838 HydrophobicContact CG2-CB 4.43Å; V801-V838 HydrophobicContact CG2-CG1 4.07Å; V801-V838 HydrophobicContact CG2-CG2 3.95Å; V801-A841 HydrophobicContact CB-CB 4.37Å; V801-A841 HydrophobicContact CG1-CB 4.12Å; V801-A841 HydrophobicContact CG2-CB 4.49Å; V801-V842 HydrophobicContact CG1-CG2 3.49Å; V801-V842 VanDerWaalsContact CG1-CG2 3.49Å
802	K	96.1	Very high	94.9	Very high	97 Å²	97	37.8 Å²	37.8	42%	0.422	20%	0.2	S	C	.	.	H	α-helix	trans	-65.6	-31.1	174.6	-167.7	-165	-170.4	78.4	0	112.9	P798 H799 V800 K806 E845	P798-K802 WeakPolarHBondContact O-CB 3.26Å; P798-K802 PolarHBondContact O-N 2.8Å; H799-K802 WeakPolarHBondContact O-CB 3.39Å; H799-K802 PolarHBondContact O-N 3.33Å; V800-K802 PolarHBondContact O-N 3.36Å; K802-K806 WeakPolarHBondContact O-CB 3.47Å; K802-K806 PolarHBondContact O-N 2.93Å; K802-E845 HydrophobicContact CB-CG 4.29Å; K802-E845 WeakPolarHBondContact CD-OE1 3.44Å; K802-E845 HydrophobicContact CG-CG 4.26Å; K802-E845 IonicContact NZ-OE1 2.82Å; K802-E845 PolarHBondContact NZ-OE1 3.14Å; K802-E845 IonicContact NZ-OE2 2.65Å; K802-E845 PolarHBondContact NZ-OE2 2.82Å
803	L	97.4	Very high	95.2	Very high	14 Å²	14	37.9 Å²	37.9	7%	0.073	20%	0.199	C	C	.	.	H	α-helix	trans	-65.9	-50.1	173.9	-60.6	176.9	0	0	0	110.9	V710 L713 T714 I717 H799 V800 V801 L805 K806 L807	V710-L803 HydrophobicContact CG1-CD1 3.94Å; L713-L803 HydrophobicContact CB-CD1 4.45Å; T714-L803 WeakPolarHBondContact OG1-CD1 3.46Å; I717-L803 HydrophobicContact CD1-CB 4.18Å; I717-L803 HydrophobicContact CD1-CD2 3.83Å; H799-L803 WeakPolarHBondContact O-CG 3.25Å; H799-L803 PolarHBondContact O-N 3.49Å; H799-L803 VanDerWaalsContact O-N 3.13Å; V800-L803 WeakPolarHBondContact O-CB 3.24Å; V800-L803 PolarHBondContact O-N 2.69Å; V801-L803 VanDerWaalsContact C-N 3.34Å; V801-L803 PolarHBondContact O-N 2.98Å; L803-L805 VanDerWaalsContact C-N 3.3Å; L803-L805 PolarHBondContact O-N 3.39Å; L803-K806 PolarHBondContact O-N 3.4Å; L803-L807 WeakPolarHBondContact O-CG 3.38Å; L803-L807 PolarHBondContact O-N 2.96Å
804	Y	98.4	Very high	95.5	Very high	1 Å²	1	39.5 Å²	39.5	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-58.2	-43.2	176.4	-56	-48.9	0	0	0	111.6	V731 L734 V800 V801 K806 L807 L808 A823 I824 L827	V731-Y804 HydrophobicContact CG1-CD1 4.49Å; L734-Y804 HydrophobicContact CB-CE1 4.43Å; L734-Y804 HydrophobicContact CD1-CE1 4.49Å; V800-Y804 HydrophobicContact CG1-CE2 3.73Å; V800-Y804 WeakPolarHBondContact O-CD2 3.07Å; V800-Y804 PolarHBondContact O-N 3.4Å; V800-Y804 VanDerWaalsContact O-N 3.16Å; V801-Y804 PolarHBondContact O-N 3.12Å; Y804-K806 VanDerWaalsContact C-N 3.26Å; Y804-K806 PolarHBondContact O-N 3.01Å; Y804-L807 PolarHBondContact O-N 3.01Å; Y804-L808 WeakPolarHBondContact O-CB 3.4Å; Y804-L808 WeakPolarHBondContact O-CD1 3.19Å; Y804-L808 VanDerWaalsContact O-CG 3.24Å; Y804-L808 WeakPolarHBondContact O-CG 2.91Å; Y804-L808 PolarHBondContact O-N 3.3Å; Y804-A823 HydrophobicContact CD1-CB 4.07Å; Y804-A823 HydrophobicContact CD2-CB 4.1Å; Y804-A823 HydrophobicContact CE1-CB 3.85Å; Y804-A823 HydrophobicContact CE2-CB 3.88Å; Y804-A823 HydrophobicContact CG-CB 4.21Å; Y804-I824 HydrophobicContact CD2-CG1 4.26Å; Y804-L827 HydrophobicContact CE2-CD1 3.89Å
805	L	97.9	Very high	95.6	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-65.4	-25.9	175.8	-71.5	178.8	0	0	0	114	V801 L803 L808 Q809 I824 V842 E845	V801-L805 HydrophobicContact CG1-CD1 4.36Å; V801-L805 WeakPolarHBondContact O-CG 3.45Å; V801-L805 PolarHBondContact O-N 2.94Å; V801-L805 VanDerWaalsContact O-N 3.07Å; L803-L805 VanDerWaalsContact C-N 3.3Å; L803-L805 PolarHBondContact O-N 3.39Å; L805-L808 HydrophobicContact CD2-CD1 4.24Å; L805-Q809 WeakPolarHBondContact O-CG 3.37Å; L805-Q809 PolarHBondContact O-N 3.37Å; L805-I824 HydrophobicContact CD2-CD1 3.63Å; L805-I824 HydrophobicContact CG-CD1 4.05Å; L805-V842 HydrophobicContact CD1-CB 4.48Å; L805-V842 HydrophobicContact CD1-CG1 4.41Å; L805-V842 HydrophobicContact CD1-CG2 4.35Å; L805-V842 HydrophobicContact CD2-CG1 4.41Å; L805-E845 HydrophobicContact CD1-CB 3.8Å
806	K	97.7	Very high	95.7	Very high	75 Å²	75	41.9 Å²	41.9	33%	0.326	22%	0.215	S	C	.	.	H	α-helix	trans	-82.2	-35.9	176.8	-168.1	48.8	168.1	147.4	0	111.9	I717 K802 L803 Y804 L808 Q809 D810	I717-K806 HydrophobicContact CG2-CG 3.72Å; K802-K806 WeakPolarHBondContact O-CB 3.47Å; K802-K806 PolarHBondContact O-N 2.93Å; L803-K806 PolarHBondContact O-N 3.4Å; Y804-K806 VanDerWaalsContact C-N 3.26Å; Y804-K806 PolarHBondContact O-N 3.01Å; K806-L808 VanDerWaalsContact C-N 3.34Å; K806-Q809 HydrophobicContact CD-CB 4.43Å; K806-Q809 PolarHBondContact O-N 3.34Å; K806-Q809 VanDerWaalsContact O-N 3.11Å; K806-D810 VanDerWaalsContact CD-OD2 3.28Å; K806-D810 WeakPolarHBondContact CD-OD2 3.29Å; K806-D810 WeakPolarHBondContact CE-OD2 3.37Å; K806-D810 IonicContact NZ-OD1 3.16Å; K806-D810 PolarHBondContact NZ-OD1 3.27Å; K806-D810 IonicContact NZ-OD2 2.73Å; K806-D810 PolarHBondContact NZ-OD2 2.83Å; K806-D810 WeakPolarHBondContact O-CB 3.45Å; K806-D810 PolarHBondContact O-N 3.01Å
807	L	97.9	Very high	96	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.1	-43.5	168.6	-66.5	165	0	0	0	111	L713 I717 V722 V727 V731 L803 Y804 Q809 D810 S811 T816 S820	L713-L807 HydrophobicContact CD1-CD1 4.5Å; I717-L807 HydrophobicContact CD1-CD2 4.05Å; I717-L807 HydrophobicContact CD1-CG 3.96Å; I717-L807 HydrophobicContact CG1-CD2 3.95Å; I717-L807 HydrophobicContact CG1-CG 4.39Å; V722-L807 HydrophobicContact CB-CD2 4Å; V722-L807 HydrophobicContact CG1-CD2 3.93Å; V727-L807 HydrophobicContact CG1-CD2 3.91Å; V731-L807 HydrophobicContact CG2-CD1 3.55Å; L803-L807 WeakPolarHBondContact O-CG 3.38Å; L803-L807 PolarHBondContact O-N 2.96Å; Y804-L807 PolarHBondContact O-N 3.01Å; L807-Q809 PolarHBondContact O-N 2.94Å; L807-Q809 VanDerWaalsContact O-N 3.11Å; L807-D810 PolarHBondContact O-N 3.02Å; L807-S811 WeakPolarHBondContact O-CB 3.44Å; L807-S811 PolarHBondContact O-N 2.96Å; L807-T816 HydrophobicContact CB-CG2 4.25Å; L807-T816 HydrophobicContact CD2-CG2 4.17Å; L807-S820 WeakPolarHBondContact CB-OG 3.44Å
808	L	98	Very high	96.2	Very high	5 Å²	5	40 Å²	40	3%	0.026	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-9.7	173.4	-69.6	164.8	0	0	0	114.9	Y804 L805 K806 L817 A821 I824 V850 L851 L854	Y804-L808 WeakPolarHBondContact O-CB 3.4Å; Y804-L808 WeakPolarHBondContact O-CD1 3.19Å; Y804-L808 VanDerWaalsContact O-CG 3.24Å; Y804-L808 WeakPolarHBondContact O-CG 2.91Å; Y804-L808 PolarHBondContact O-N 3.3Å; L805-L808 HydrophobicContact CD2-CD1 4.24Å; K806-L808 VanDerWaalsContact C-N 3.34Å; L808-L817 HydrophobicContact CD2-CD2 4.13Å; L808-L817 WeakPolarHBondContact CD2-O 3.24Å; L808-A821 HydrophobicContact CD2-CB 4.18Å; L808-I824 HydrophobicContact CD1-CD1 3.69Å; L808-V850 HydrophobicContact CB-CG1 3.96Å; L808-V850 VanDerWaalsContact O-CG1 3.24Å; L808-V850 WeakPolarHBondContact O-CG1 3.16Å; L808-L851 HydrophobicContact CD1-CD2 3.95Å; L808-L854 HydrophobicContact CB-CD1 4.03Å; L808-L854 HydrophobicContact CD2-CD1 3.55Å; L808-L854 HydrophobicContact CG-CD1 4.32Å
809	Q	96.5	Very high	96.5	Very high	99 Å²	99	36.8 Å²	36.8	46%	0.463	19%	0.186	S	C	.	.	H	α-helix	trans	-102.6	-34.6	174.3	-75.4	172.8	-0.2	0	0	113.1	L805 K806 L807 V850	L805-Q809 WeakPolarHBondContact O-CG 3.37Å; L805-Q809 PolarHBondContact O-N 3.37Å; K806-Q809 HydrophobicContact CD-CB 4.43Å; K806-Q809 PolarHBondContact O-N 3.34Å; K806-Q809 VanDerWaalsContact O-N 3.11Å; L807-Q809 PolarHBondContact O-N 2.94Å; L807-Q809 VanDerWaalsContact O-N 3.11Å; Q809-V850 HydrophobicContact CG-CG1 3.86Å; Q809-V850 HydrophobicContact CG-CG2 3.82Å
810	D	96.1	Very high	96.7	Very high	67 Å²	67	32.1 Å²	32.1	36%	0.358	17%	0.165	S	C	.	.	H	α-helix	trans	-109.2	-19.1	-165.6	-65.2	-6.1	0	0	0	113.7	V722 K806 L807	V722-D810 HydrophobicContact CG1-CB 4.36Å; V722-D810 HydrophobicContact CG2-CB 4.14Å; V722-D810 WeakPolarHBondContact CG2-O 3.43Å; K806-D810 VanDerWaalsContact CD-OD2 3.28Å; K806-D810 WeakPolarHBondContact CD-OD2 3.29Å; K806-D810 WeakPolarHBondContact CE-OD2 3.37Å; K806-D810 IonicContact NZ-OD1 3.16Å; K806-D810 PolarHBondContact NZ-OD1 3.27Å; K806-D810 IonicContact NZ-OD2 2.73Å; K806-D810 PolarHBondContact NZ-OD2 2.83Å; K806-D810 WeakPolarHBondContact O-CB 3.45Å; K806-D810 PolarHBondContact O-N 3.01Å; L807-D810 PolarHBondContact O-N 3.02Å
811	S	96.6	Very high	96.8	Very high	13 Å²	13	32.1 Å²	32.1	9%	0.091	17%	0.165	C	C	.	.			trans	-87.3	133.9	-173.5	-169.2	0	0	0	0	111.9	D723 L807 N813 T816	D723-S811 WeakPolarHBondContact OD1-CA 3.31Å; D723-S811 WeakPolarHBondContact OD1-CB 3.27Å; D723-S811 PolarHBondContact OD1-OG 3.11Å; L807-S811 WeakPolarHBondContact O-CB 3.44Å; L807-S811 PolarHBondContact O-N 2.96Å; S811-N813 PolarHBondContact OG-N 3.46Å; S811-T816 WeakPolarHBondContact OG-CB 3.35Å; S811-T816 VanDerWaalsContact OG-CG2 3.25Å; S811-T816 WeakPolarHBondContact OG-CG2 3.25Å
812	S	95.3	Very high	96.8	Very high	94 Å²	94	32.2 Å²	32.2	66%	0.657	17%	0.166	S	C	*	.			trans	-95	-14.6	167.1	67.2	0	0	0	0	113.2	D723 I814	D723-S812 VanDerWaalsContact CG-N 3.28Å; D723-S812 VanDerWaalsContact CG-OG 3.31Å; D723-S812 PolarHBondContact OD1-N 3.28Å; D723-S812 WeakPolarHBondContact OD2-CB 3.21Å; D723-S812 PolarHBondContact OD2-N 3.11Å; D723-S812 PolarHBondContact OD2-OG 2.97Å; S812-I814 PolarHBondContact O-N 2.79Å
813	N	95.7	Very high	96.8	Very high	31 Å²	31	27.6 Å²	27.6	17%	0.166	15%	0.146	C	C	.	.			trans	-71.5	115.3	176	178.6	-34.6	0	0	0	111.1	D723 E728 S811 E815 T816 L817	D723-N813 HydrophobicContact CB-CB 4.17Å; D723-N813 WeakPolarHBondContact OD1-CB 3.47Å; D723-N813 PolarHBondContact OD1-N 2.76Å; E728-N813 PolarHBondContact OE2-ND2 2.99Å; S811-N813 PolarHBondContact OG-N 3.46Å; N813-E815 PolarHBondContact O-N 3.16Å; N813-E815 WeakPolarHBondContact OD1-CA 3.38Å; N813-E815 WeakPolarHBondContact OD1-CB 3.37Å; N813-E815 PolarHBondContact OD1-N 2.88Å; N813-T816 WeakPolarHBondContact O-CB 3.29Å; N813-T816 PolarHBondContact O-N 3.17Å; N813-T816 VanDerWaalsContact O-N 3.13Å; N813-T816 PolarHBondContact OD1-N 3.47Å; N813-T816 VanDerWaalsContact OD1-N 3.09Å; N813-L817 WeakPolarHBondContact O-CG 3.33Å; N813-L817 PolarHBondContact O-N 3.44Å
814	I	94.9	Very high	96.8	Very high	71 Å²	71	26.9 Å²	26.9	36%	0.364	14%	0.142	S	C	.	.	H	α-helix	trans	-62.6	-32.2	-177	61.2	-175.6	0	0	0	114.2	S812 L817 E818 E859 F861 V862	S812-I814 PolarHBondContact O-N 2.79Å; I814-L817 PolarHBondContact O-N 2.97Å; I814-E818 PolarHBondContact O-N 3.4Å; I814-E859 HydrophobicContact CG2-CG 3.96Å; I814-F861 HydrophobicContact CB-CE2 4.4Å; I814-F861 HydrophobicContact CB-CZ 3.98Å; I814-F861 HydrophobicContact CD1-CE1 4.44Å; I814-F861 HydrophobicContact CD1-CZ 3.84Å; I814-F861 HydrophobicContact CG1-CZ 3.87Å; I814-V862 HydrophobicContact CB-CG2 4.36Å
815	E	93.9	Very high	96.6	Very high	62 Å²	62	28.7 Å²	28.7	29%	0.29	15%	0.15	S	C	.	.	H	α-helix	trans	-72	-39.1	173.4	-72.1	-78.6	137.6	0	0	111.1	R686 E728 N813 L817 E818 A819	R686-E815 IonicContact NH2-OE2 2.89Å; R686-E815 PolarHBondContact NH2-OE2 3.05Å; E728-E815 HydrophobicContact CG-CB 3.55Å; N813-E815 PolarHBondContact O-N 3.16Å; N813-E815 WeakPolarHBondContact OD1-CA 3.38Å; N813-E815 WeakPolarHBondContact OD1-CB 3.37Å; N813-E815 PolarHBondContact OD1-N 2.88Å; E815-L817 VanDerWaalsContact C-N 3.31Å; E815-L817 PolarHBondContact O-N 2.92Å; E815-E818 PolarHBondContact O-N 3.02Å; E815-A819 VanDerWaalsContact O-CB 3.25Å; E815-A819 WeakPolarHBondContact O-CB 3.22Å; E815-A819 PolarHBondContact O-N 3.15Å
816	T	96.6	Very high	96.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.2	-36.1	173	-65.8	0	0	0	0	111.6	V727 L807 S811 N813 S820	V727-T816 HydrophobicContact CG1-CG2 4.07Å; L807-T816 HydrophobicContact CB-CG2 4.25Å; L807-T816 HydrophobicContact CD2-CG2 4.17Å; S811-T816 WeakPolarHBondContact OG-CB 3.35Å; S811-T816 VanDerWaalsContact OG-CG2 3.25Å; S811-T816 WeakPolarHBondContact OG-CG2 3.25Å; N813-T816 WeakPolarHBondContact O-CB 3.29Å; N813-T816 PolarHBondContact O-N 3.17Å; N813-T816 VanDerWaalsContact O-N 3.13Å; N813-T816 PolarHBondContact OD1-N 3.47Å; N813-T816 VanDerWaalsContact OD1-N 3.09Å; T816-S820 VanDerWaalsContact O-CB 3.24Å; T816-S820 WeakPolarHBondContact O-CB 3.26Å; T816-S820 PolarHBondContact O-N 3.02Å; T816-S820 PolarHBondContact O-OG 3.21Å
817	L	97.8	Very high	96.2	Very high	11 Å²	11	25.8 Å²	25.8	6%	0.058	14%	0.138	C	C	.	.	H	α-helix	trans	-67.9	-48.2	173.6	-66.6	176.9	0	0	0	112	L808 N813 I814 E815 A819 S820 A821 L854 L857 V862	L808-L817 HydrophobicContact CD2-CD2 4.13Å; L808-L817 WeakPolarHBondContact CD2-O 3.24Å; N813-L817 WeakPolarHBondContact O-CG 3.33Å; N813-L817 PolarHBondContact O-N 3.44Å; I814-L817 PolarHBondContact O-N 2.97Å; E815-L817 VanDerWaalsContact C-N 3.31Å; E815-L817 PolarHBondContact O-N 2.92Å; L817-A819 PolarHBondContact O-N 3.29Å; L817-S820 PolarHBondContact O-N 2.88Å; L817-A821 WeakPolarHBondContact O-CB 3.29Å; L817-A821 PolarHBondContact O-N 2.72Å; L817-L854 HydrophobicContact CD1-CD2 4.42Å; L817-L854 HydrophobicContact CD2-CD2 4.48Å; L817-L857 HydrophobicContact CD1-CD1 4.22Å; L817-V862 HydrophobicContact CB-CG1 4.01Å
818	E	96.8	Very high	95.8	Very high	30 Å²	30	25.8 Å²	25.8	14%	0.14	14%	0.138	C	C	.	.	H	α-helix	trans	-54.4	-53.2	172.6	-173.7	-72.4	152.1	0	0	110.3	R735 I814 E815 S820 A821 G822 F861 A865	R735-E818 IonicContact CZ-OE1 3.69Å; R735-E818 IonicContact CZ-OE2 2.78Å; R735-E818 VanDerWaalsContact CZ-OE2 3.29Å; R735-E818 IonicContact NE-OE1 3.85Å; R735-E818 IonicContact NE-OE2 2.68Å; R735-E818 PolarHBondContact NE-OE2 3.44Å; R735-E818 VanDerWaalsContact NE-OE2 3.07Å; R735-E818 VanDerWaalsContact NH2-CD 3.28Å; R735-E818 IonicContact NH2-OE1 2.67Å; R735-E818 PolarHBondContact NH2-OE1 2.85Å; R735-E818 IonicContact NH2-OE2 3.64Å; R735-E818 PolarHBondContact NH2-OE2 3.47Å; I814-E818 PolarHBondContact O-N 3.4Å; E815-E818 PolarHBondContact O-N 3.02Å; E818-S820 VanDerWaalsContact C-N 3.31Å; E818-S820 PolarHBondContact O-N 3.31Å; E818-A821 CarbonylContact O-C 3.59Å; E818-A821 PolarHBondContact O-N 2.96Å; E818-A821 VanDerWaalsContact O-N 3.15Å; E818-G822 PolarHBondContact O-N 2.69Å; E818-F861 HydrophobicContact CB-CD2 3.94Å; E818-F861 HydrophobicContact CB-CE2 4.07Å; E818-F861 HydrophobicContact CG-CD2 3.98Å; E818-A865 HydrophobicContact CG-CB 4.2Å
819	A	96.9	Very high	95.2	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-68.4	-33.7	-170.6	0	0	0	0	0	111.8	V731 C732 R735 E815 L817 A823	V731-A819 HydrophobicContact CB-CB 4.14Å; V731-A819 HydrophobicContact CG1-CB 3.57Å; C732-A819 HydrophobicContact CB-CB 4.39Å; R735-A819 HydrophobicContact CB-CB 4.31Å; R735-A819 WeakPolarHBondContact CB-O 3.45Å; R735-A819 WeakPolarHBondContact CG-O 3.46Å; E815-A819 VanDerWaalsContact O-CB 3.25Å; E815-A819 WeakPolarHBondContact O-CB 3.22Å; E815-A819 PolarHBondContact O-N 3.15Å; L817-A819 PolarHBondContact O-N 3.29Å; A819-A823 VanDerWaalsContact O-CB 3.31Å; A819-A823 WeakPolarHBondContact O-CB 3.36Å; A819-A823 PolarHBondContact O-N 3.27Å
820	S	98.4	Very high	94.2	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-68.2	-41.4	173.6	-60.3	0	0	0	0	111.9	L807 T816 L817 E818 I824	L807-S820 WeakPolarHBondContact CB-OG 3.44Å; T816-S820 VanDerWaalsContact O-CB 3.24Å; T816-S820 WeakPolarHBondContact O-CB 3.26Å; T816-S820 PolarHBondContact O-N 3.02Å; T816-S820 PolarHBondContact O-OG 3.21Å; L817-S820 PolarHBondContact O-N 2.88Å; E818-S820 VanDerWaalsContact C-N 3.31Å; E818-S820 PolarHBondContact O-N 3.31Å; S820-I824 WeakPolarHBondContact O-CG1 3.4Å; S820-I824 PolarHBondContact O-N 2.83Å
821	A	97.6	Very high	93.2	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.3	-43.5	174.6	0	0	0	0	0	111.6	L808 L817 E818 A823 I824 Q825 A865 V866	L808-A821 HydrophobicContact CD2-CB 4.18Å; L817-A821 WeakPolarHBondContact O-CB 3.29Å; L817-A821 PolarHBondContact O-N 2.72Å; E818-A821 CarbonylContact O-C 3.59Å; E818-A821 PolarHBondContact O-N 2.96Å; E818-A821 VanDerWaalsContact O-N 3.15Å; A821-A823 PolarHBondContact O-N 3.08Å; A821-I824 PolarHBondContact O-N 3.44Å; A821-Q825 WeakPolarHBondContact O-CB 3.32Å; A821-Q825 PolarHBondContact O-N 3.01Å; A821-A865 HydrophobicContact CB-CB 4Å; A821-V866 HydrophobicContact CB-CG2 3.66Å
822	G	95.7	Very high	92.2	Very high	2 Å²	2	23.3 Å²	23.3	2%	0.021	13%	0.125	C	C	.	.	H	α-helix	trans	-62.9	-36.1	176.8	0	0	0	0	0	113.2	E818 Q825 N826	E818-G822 PolarHBondContact O-N 2.69Å; G822-Q825 WeakPolarHBondContact O-CB 3.35Å; G822-N826 WeakPolarHBondContact O-CB 3.49Å; G822-N826 PolarHBondContact O-N 3.09Å; G822-N826 PolarHBondContact O-ND2 3.47Å
823	A	97	Very high	91.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.4	-48.5	171.6	0	0	0	0	0	111.1	R735 Y804 A819 A821 Q825 N826 L827	R735-A823 HydrophobicContact CB-CB 4.2Å; Y804-A823 HydrophobicContact CD1-CB 4.07Å; Y804-A823 HydrophobicContact CD2-CB 4.1Å; Y804-A823 HydrophobicContact CE1-CB 3.85Å; Y804-A823 HydrophobicContact CE2-CB 3.88Å; Y804-A823 HydrophobicContact CG-CB 4.21Å; A819-A823 VanDerWaalsContact O-CB 3.31Å; A819-A823 WeakPolarHBondContact O-CB 3.36Å; A819-A823 PolarHBondContact O-N 3.27Å; A821-A823 PolarHBondContact O-N 3.08Å; A823-Q825 PolarHBondContact O-N 3.24Å; A823-N826 PolarHBondContact O-N 3.42Å; A823-L827 WeakPolarHBondContact O-CB 2.88Å; A823-L827 VanDerWaalsContact O-CG 3.25Å; A823-L827 WeakPolarHBondContact O-CG 3.28Å; A823-L827 PolarHBondContact O-N 2.94Å
824	I	96.6	Very high	91.3	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63	-42.5	176.4	-65.3	174.3	0	0	0	111.2	Y804 L805 L808 S820 A821 N826 L827 A828 V842 L873	Y804-I824 HydrophobicContact CD2-CG1 4.26Å; L805-I824 HydrophobicContact CD2-CD1 3.63Å; L805-I824 HydrophobicContact CG-CD1 4.05Å; L808-I824 HydrophobicContact CD1-CD1 3.69Å; S820-I824 WeakPolarHBondContact O-CG1 3.4Å; S820-I824 PolarHBondContact O-N 2.83Å; A821-I824 PolarHBondContact O-N 3.44Å; I824-N826 PolarHBondContact O-N 2.89Å; I824-L827 PolarHBondContact O-N 3.47Å; I824-A828 WeakPolarHBondContact O-CB 3.22Å; I824-A828 PolarHBondContact O-N 2.98Å; I824-V842 HydrophobicContact CG2-CG2 4.08Å; I824-L873 HydrophobicContact CG2-CD1 3.72Å
825	Q	94.5	Very high	91.1	Very high	38 Å²	38	19 Å²	19	18%	0.178	10%	0.101	C	C	.	.	H	α-helix	trans	-53.1	-52.8	173	163.7	-176.4	-40.9	0	0	111.3	A821 G822 A823 A828 A829 A865 T868 A869 N872	A821-Q825 WeakPolarHBondContact O-CB 3.32Å; A821-Q825 PolarHBondContact O-N 3.01Å; G822-Q825 WeakPolarHBondContact O-CB 3.35Å; A823-Q825 PolarHBondContact O-N 3.24Å; Q825-A828 PolarHBondContact O-N 3.37Å; Q825-A829 WeakPolarHBondContact O-CB 3.3Å; Q825-A829 PolarHBondContact O-N 2.9Å; Q825-A865 PolarHBondContact OE1-O 2.88Å; Q825-T868 VanDerWaalsContact CD-CG2 3.47Å; Q825-T868 HydrophobicContact CG-CG2 3.86Å; Q825-T868 VanDerWaalsContact OE1-CB 3.28Å; Q825-A869 HydrophobicContact CB-CB 3.97Å; Q825-N872 PolarHBondContact O-ND2 2.69Å
826	N	93.4	Very high	90.8	Very high	16 Å²	16	18.2 Å²	18.2	9%	0.086	11%	0.106	C	C	.	.	H	α-helix	trans	-64.2	-47.2	-177.5	-74.9	-17.9	0	0	0	111.4	R735 G822 A823 I824 A828 A829	R735-N826 PolarHBondContact O-ND2 3.47Å; G822-N826 WeakPolarHBondContact O-CB 3.49Å; G822-N826 PolarHBondContact O-N 3.09Å; G822-N826 PolarHBondContact O-ND2 3.47Å; A823-N826 PolarHBondContact O-N 3.42Å; I824-N826 PolarHBondContact O-N 2.89Å; N826-A828 VanDerWaalsContact C-N 3.28Å; N826-A828 PolarHBondContact O-N 3.13Å; N826-A829 WeakPolarHBondContact O-CB 3.49Å; N826-A829 PolarHBondContact O-N 3.42Å
827	L	92.9	Very high	90.5	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-66.2	-27.9	179.5	-66.7	173.5	0	0	0	113.1	I741 L795 W796 Y804 A823 I824 S835 V838	I741-L827 HydrophobicContact CG2-CD2 4.13Å; L795-L827 HydrophobicContact CB-CD2 4.39Å; L795-L827 WeakPolarHBondContact O-CD1 3.34Å; W796-L827 HydrophobicContact CB-CD2 4.27Å; Y804-L827 HydrophobicContact CE2-CD1 3.89Å; A823-L827 WeakPolarHBondContact O-CB 2.88Å; A823-L827 VanDerWaalsContact O-CG 3.25Å; A823-L827 WeakPolarHBondContact O-CG 3.28Å; A823-L827 PolarHBondContact O-N 2.94Å; I824-L827 PolarHBondContact O-N 3.47Å; L827-S835 WeakPolarHBondContact O-CA 3.38Å; L827-S835 WeakPolarHBondContact O-CB 3.13Å; L827-S835 PolarHBondContact O-OG 3.27Å; L827-V838 HydrophobicContact CB-CG1 3.99Å; L827-V838 HydrophobicContact CB-CG2 4.22Å
828	A	91.3	Very high	90.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-0.3	177.9	0	0	0	0	0	114.7	I824 Q825 N826 C830 R839 N872 L873	I824-A828 WeakPolarHBondContact O-CB 3.22Å; I824-A828 PolarHBondContact O-N 2.98Å; Q825-A828 PolarHBondContact O-N 3.37Å; N826-A828 VanDerWaalsContact C-N 3.28Å; N826-A828 PolarHBondContact O-N 3.13Å; A828-C830 PolarHBondContact O-N 2.9Å; A828-R839 HydrophobicContact CB-CG 4.09Å; A828-R839 PolarHBondContact O-NH1 3.15Å; A828-N872 HydrophobicContact CB-CB 3.81Å; A828-L873 HydrophobicContact CB-CD2 4.26Å
829	A	84.3	Confident	90.2	Very high	11 Å²	11	22.3 Å²	22.3	9%	0.091	12%	0.124	C	C	.	.	S	Bend	trans	-71	-13.7	-162.6	0	0	0	0	0	117.5	Q825 N826 N872	Q825-A829 WeakPolarHBondContact O-CB 3.3Å; Q825-A829 PolarHBondContact O-N 2.9Å; N826-A829 WeakPolarHBondContact O-CB 3.49Å; N826-A829 PolarHBondContact O-N 3.42Å; A829-N872 WeakPolarHBondContact CA-ND2 3.41Å
830	C	76.6	Confident	90	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.014	13%	0.134	C	C	.	.	S	Bend	trans	-140.1	177.8	-169.4	60.8	0	0	0	0	114.4	Y749 A828 F832 S835 R839	Y749-C830 HydrophobicContact CE2-CB 4.17Å; Y749-C830 WeakPolarHBondContact OH-CB 3.35Å; A828-C830 PolarHBondContact O-N 2.9Å; C830-F832 VanDerWaalsContact C-N 3.25Å; C830-F832 PolarHBondContact O-N 2.86Å; C830-F832 WeakPolarHBondContact SG-CB 3.37Å; C830-S835 VanDerWaalsContact O-CB 3.3Å; C830-S835 WeakPolarHBondContact O-CB 3.41Å; C830-S835 PolarHBondContact SG-OG 3.37Å; C830-S835 VanDerWaalsContact SG-OG 3.41Å; C830-R839 PolarHBondContact O-NH1 3.01Å; C830-R839 PolarHBondContact O-NH2 3.36Å
831	Q	73.9	Confident	89.8	Confident	105 Å²	105	24 Å²	24	49%	0.491	14%	0.138	S	C	.	.	S	Bend	trans	-85.2	10.2	178.7	-63.4	-175.3	33.6	0	0	113.6	A754	A754-Q831 PolarHBondContact O-NE2 3.28Å
832	F	76.6	Confident	89.8	Confident	15 Å²	15	24 Å²	24	7%	0.066	14%	0.138	C	C	.	.			trans	-57.8	140.4	172.1	-177.5	-131.5	0	0	0	111.3	Q742 V745 D746 C830 P834 S835 A836	Q742-F832 HydrophobicContact CB-CB 4.06Å; Q742-F832 HydrophobicContact CB-CD1 3.68Å; Q742-F832 HydrophobicContact CB-CD2 3.95Å; Q742-F832 HydrophobicContact CB-CE1 4.01Å; Q742-F832 HydrophobicContact CB-CE2 4.29Å; Q742-F832 HydrophobicContact CB-CG 3.66Å; Q742-F832 HydrophobicContact CB-CZ 4.32Å; V745-F832 HydrophobicContact CB-CZ 3.93Å; V745-F832 HydrophobicContact CG1-CZ 3.81Å; D746-F832 HydrophobicContact CB-CD2 4.5Å; D746-F832 HydrophobicContact CB-CE2 4.01Å; C830-F832 VanDerWaalsContact C-N 3.25Å; C830-F832 PolarHBondContact O-N 2.86Å; C830-F832 WeakPolarHBondContact SG-CB 3.37Å; F832-P834 HydrophobicContact CD1-CB 3.86Å; F832-P834 HydrophobicContact CD1-CG 3.93Å; F832-P834 HydrophobicContact CE1-CB 3.64Å; F832-P834 HydrophobicContact CE1-CG 3.44Å; F832-P834 VanDerWaalsContact CE1-CG 3.44Å; F832-P834 HydrophobicContact CE2-CG 4.29Å; F832-P834 HydrophobicContact CZ-CB 4.34Å; F832-P834 HydrophobicContact CZ-CG 3.64Å; F832-S835 WeakPolarHBondContact O-CA 3.35Å; F832-S835 VanDerWaalsContact O-CB 3.31Å; F832-S835 WeakPolarHBondContact O-CB 3.39Å; F832-S835 PolarHBondContact O-N 3.2Å; F832-A836 PolarHBondContact O-N 2.96Å
833	P	83.6	Confident	89.7	Confident	85 Å²	85	26.2 Å²	26.2	55%	0.552	15%	0.146	S	C	*	.	H	α-helix	trans	-61.4	-43.4	-174.1	-21.7	32.3	0	0	0	114.2	S835 A836 E837	P833-S835 PolarHBondContact O-N 3.31Å; P833-A836 WeakPolarHBondContact O-CA 3.39Å; P833-A836 VanDerWaalsContact O-CB 3.31Å; P833-A836 WeakPolarHBondContact O-CB 3.46Å; P833-A836 PolarHBondContact O-N 3.1Å; P833-E837 PolarHBondContact O-N 3.07Å
834	P	88.1	Confident	89.5	Confident	18 Å²	18	31.6 Å²	31.6	12%	0.117	18%	0.178	C	C	.	.	H	α-helix	trans	-55.9	-32.3	169.2	-32.2	39.9	0	0	0	114.9	W796 F832 A836 E837 V838	W796-P834 HydrophobicContact CB-CB 4.39Å; W796-P834 HydrophobicContact CD2-CB 4.07Å; W796-P834 HydrophobicContact CG-CB 3.82Å; W796-P834 HydrophobicContact CZ2-CG 4.34Å; F832-P834 HydrophobicContact CD1-CB 3.86Å; F832-P834 HydrophobicContact CD1-CG 3.93Å; F832-P834 HydrophobicContact CE1-CB 3.64Å; F832-P834 HydrophobicContact CE1-CG 3.44Å; F832-P834 VanDerWaalsContact CE1-CG 3.44Å; F832-P834 HydrophobicContact CE2-CG 4.29Å; F832-P834 HydrophobicContact CZ-CB 4.34Å; F832-P834 HydrophobicContact CZ-CG 3.64Å; P834-A836 VanDerWaalsContact C-N 3.28Å; P834-A836 PolarHBondContact O-N 3.38Å; P834-E837 WeakPolarHBondContact O-CB 3.38Å; P834-E837 PolarHBondContact O-N 2.66Å; P834-V838 WeakPolarHBondContact O-CG2 3.49Å; P834-V838 PolarHBondContact O-N 2.72Å
835	S	89.9	Confident	89.4	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.014	19%	0.192	C	C	.	.	H	α-helix	trans	-66.7	-30.2	172.5	-61.2	0	0	0	0	112.3	L827 C830 F832 P833 R839	L827-S835 WeakPolarHBondContact O-CA 3.38Å; L827-S835 WeakPolarHBondContact O-CB 3.13Å; L827-S835 PolarHBondContact O-OG 3.27Å; C830-S835 VanDerWaalsContact O-CB 3.3Å; C830-S835 WeakPolarHBondContact O-CB 3.41Å; C830-S835 PolarHBondContact SG-OG 3.37Å; C830-S835 VanDerWaalsContact SG-OG 3.41Å; F832-S835 WeakPolarHBondContact O-CA 3.35Å; F832-S835 VanDerWaalsContact O-CB 3.31Å; F832-S835 WeakPolarHBondContact O-CB 3.39Å; F832-S835 PolarHBondContact O-N 3.2Å; P833-S835 PolarHBondContact O-N 3.31Å; S835-R839 WeakPolarHBondContact O-CB 3.42Å; S835-R839 VanDerWaalsContact O-CG 3.24Å; S835-R839 WeakPolarHBondContact O-CG 3.46Å; S835-R839 PolarHBondContact O-N 3.37Å; S835-R839 PolarHBondContact O-NE 3.16Å
836	A	87.9	Confident	89.4	Confident	46 Å²	46	40.6 Å²	40.6	38%	0.38	22%	0.218	S	C	.	.	H	α-helix	trans	-72.7	-35	171	0	0	0	0	0	112.2	F832 P833 P834 A840	F832-A836 PolarHBondContact O-N 2.96Å; P833-A836 WeakPolarHBondContact O-CA 3.39Å; P833-A836 VanDerWaalsContact O-CB 3.31Å; P833-A836 WeakPolarHBondContact O-CB 3.46Å; P833-A836 PolarHBondContact O-N 3.1Å; P834-A836 VanDerWaalsContact C-N 3.28Å; P834-A836 PolarHBondContact O-N 3.38Å; A836-A840 WeakPolarHBondContact O-CB 3.34Å; A836-A840 PolarHBondContact O-N 2.96Å
837	E	90	Very high	89.4	Confident	112 Å²	112	39.8 Å²	39.8	52%	0.523	21%	0.213	S	C	.	.	H	α-helix	trans	-65.3	-45.5	172.3	-65.1	-179.8	179.3	0	0	111.7	P833 P834 R839 A840 A841	P833-E837 PolarHBondContact O-N 3.07Å; P834-E837 WeakPolarHBondContact O-CB 3.38Å; P834-E837 PolarHBondContact O-N 2.66Å; E837-R839 PolarHBondContact O-N 3.04Å; E837-A840 CarbonylContact O-C 3.55Å; E837-A840 WeakPolarHBondContact O-CA 3.45Å; E837-A840 WeakPolarHBondContact O-CB 3.28Å; E837-A840 PolarHBondContact O-N 3.38Å; E837-A840 VanDerWaalsContact O-N 3.09Å; E837-A841 WeakPolarHBondContact O-CB 3.44Å; E837-A841 PolarHBondContact O-N 3.2Å
838	V	94.2	Very high	89.5	Confident	1 Å²	1	40 Å²	40	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-45.2	174.3	171	0	0	0	0	111	W796 V801 L827 P834 A840 A841 V842	W796-V838 HydrophobicContact CB-CG2 3.8Å; V801-V838 HydrophobicContact CG2-CB 4.43Å; V801-V838 HydrophobicContact CG2-CG1 4.07Å; V801-V838 HydrophobicContact CG2-CG2 3.95Å; L827-V838 HydrophobicContact CB-CG1 3.99Å; L827-V838 HydrophobicContact CB-CG2 4.22Å; P834-V838 WeakPolarHBondContact O-CG2 3.49Å; P834-V838 PolarHBondContact O-N 2.72Å; V838-A840 PolarHBondContact O-N 3.14Å; V838-A841 PolarHBondContact O-N 3.15Å; V838-A841 VanDerWaalsContact O-N 3.16Å; V838-V842 WeakPolarHBondContact O-CG2 3.47Å; V838-V842 PolarHBondContact O-N 2.93Å
839	R	94.7	Very high	89.6	Confident	14 Å²	14	44.1 Å²	44.1	5%	0.053	24%	0.241	C	C	.	.	H	α-helix	trans	-58.3	-33.6	173.6	-77.9	-176.6	-68.5	-100.6	-1.6	112.8	A828 C830 S835 E837 N872 L873 D876 N879	A828-R839 HydrophobicContact CB-CG 4.09Å; A828-R839 PolarHBondContact O-NH1 3.15Å; C830-R839 PolarHBondContact O-NH1 3.01Å; C830-R839 PolarHBondContact O-NH2 3.36Å; S835-R839 WeakPolarHBondContact O-CB 3.42Å; S835-R839 VanDerWaalsContact O-CG 3.24Å; S835-R839 WeakPolarHBondContact O-CG 3.46Å; S835-R839 PolarHBondContact O-N 3.37Å; S835-R839 PolarHBondContact O-NE 3.16Å; E837-R839 PolarHBondContact O-N 3.04Å; R839-N872 VanDerWaalsContact CD-O 3.31Å; R839-N872 WeakPolarHBondContact CD-O 3.3Å; R839-L873 HydrophobicContact CB-CD2 4.39Å; R839-L873 HydrophobicContact CG-CD2 3.96Å; R839-D876 HydrophobicContact CB-CB 4.41Å; R839-N879 PolarHBondContact O-ND2 3.5Å; R839-N879 PolarHBondContact O-OD1 3Å
840	A	92.5	Very high	90.1	Very high	25 Å²	25	44.5 Å²	44.5	21%	0.207	24%	0.242	C	C	.	.	H	α-helix	trans	-78.3	-38.8	174.5	0	0	0	0	0	112.8	A836 E837 V838 R843 V844	A836-A840 WeakPolarHBondContact O-CB 3.34Å; A836-A840 PolarHBondContact O-N 2.96Å; E837-A840 CarbonylContact O-C 3.55Å; E837-A840 WeakPolarHBondContact O-CA 3.45Å; E837-A840 WeakPolarHBondContact O-CB 3.28Å; E837-A840 PolarHBondContact O-N 3.38Å; E837-A840 VanDerWaalsContact O-N 3.09Å; V838-A840 PolarHBondContact O-N 3.14Å; A840-R843 WeakPolarHBondContact O-CB 3.41Å; A840-R843 PolarHBondContact O-N 2.85Å; A840-V844 WeakPolarHBondContact O-CG2 3.34Å; A840-V844 PolarHBondContact O-N 2.77Å
841	A	94.9	Very high	91	Very high	11 Å²	11	44.4 Å²	44.4	9%	0.091	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-45.4	179	0	0	0	0	0	111.5	P798 V801 E837 V838 R843 V844 E845	P798-A841 HydrophobicContact CB-CB 4.24Å; V801-A841 HydrophobicContact CB-CB 4.37Å; V801-A841 HydrophobicContact CG1-CB 4.12Å; V801-A841 HydrophobicContact CG2-CB 4.49Å; E837-A841 WeakPolarHBondContact O-CB 3.44Å; E837-A841 PolarHBondContact O-N 3.2Å; V838-A841 PolarHBondContact O-N 3.15Å; V838-A841 VanDerWaalsContact O-N 3.16Å; A841-R843 PolarHBondContact O-N 3.19Å; A841-V844 PolarHBondContact O-N 2.9Å; A841-V844 VanDerWaalsContact O-N 3.12Å; A841-E845 WeakPolarHBondContact O-CB 3.25Å; A841-E845 PolarHBondContact O-N 3.41Å
842	V	96.6	Very high	92	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.1	-35.8	176	171.8	0	0	0	0	112	V801 L805 I824 V838 K846 G847 L848 L851 L873	V801-V842 HydrophobicContact CG1-CG2 3.49Å; V801-V842 VanDerWaalsContact CG1-CG2 3.49Å; L805-V842 HydrophobicContact CD1-CB 4.48Å; L805-V842 HydrophobicContact CD1-CG1 4.41Å; L805-V842 HydrophobicContact CD1-CG2 4.35Å; L805-V842 HydrophobicContact CD2-CG1 4.41Å; I824-V842 HydrophobicContact CG2-CG2 4.08Å; V838-V842 WeakPolarHBondContact O-CG2 3.47Å; V838-V842 PolarHBondContact O-N 2.93Å; V842-K846 PolarHBondContact O-N 3.05Å; V842-G847 PolarHBondContact O-N 3.37Å; V842-L848 HydrophobicContact CG1-CD2 3.98Å; V842-L848 HydrophobicContact CG1-CG 4.39Å; V842-L851 HydrophobicContact CG1-CD1 4.38Å; V842-L873 HydrophobicContact CB-CD2 3.96Å; V842-L873 HydrophobicContact CG1-CD1 4.38Å; V842-L873 HydrophobicContact CG1-CD2 4.06Å; V842-L873 HydrophobicContact CG1-CG 4.06Å; V842-L873 HydrophobicContact CG2-CD2 4.09Å
843	R	94.3	Very high	92.8	Very high	48 Å²	48	45.5 Å²	45.5	18%	0.181	25%	0.248	C	C	.	.	H	α-helix	trans	-71.9	-43.8	174.8	-178.2	179.8	57	-113.2	-1.3	112.7	A840 A841 E845 K846 L848 D876 R878 N879 L882	A840-R843 WeakPolarHBondContact O-CB 3.41Å; A840-R843 PolarHBondContact O-N 2.85Å; A841-R843 PolarHBondContact O-N 3.19Å; R843-E845 VanDerWaalsContact C-N 3.34Å; R843-K846 PolarHBondContact O-N 3.36Å; R843-L848 HydrophobicContact CB-CD1 4.34Å; R843-L848 HydrophobicContact CG-CD1 4.37Å; R843-D876 IonicContact CZ-OD2 2.68Å; R843-D876 VanDerWaalsContact NH1-CG 3.33Å; R843-D876 IonicContact NH1-OD1 3.29Å; R843-D876 IonicContact NH1-OD2 2.6Å; R843-D876 PolarHBondContact NH1-OD2 2.95Å; R843-D876 IonicContact NH2-OD2 2.75Å; R843-R878 VanDerWaalsContact NH2-CZ 3.27Å; R843-N879 WeakPolarHBondContact CB-OD1 3.39Å; R843-N879 WeakPolarHBondContact CD-OD1 3.43Å; R843-N879 PolarHBondContact NH1-OD1 3.01Å; R843-L882 HydrophobicContact CG-CD1 3.66Å
844	V	93.8	Very high	93.3	Very high	113 Å²	113	42.4 Å²	42.4	69%	0.685	23%	0.227	S	C	*	.	H	α-helix	trans	-63.8	-40.6	179.2	168.8	0	0	0	0	111.3	A840 A841 K846	A840-V844 WeakPolarHBondContact O-CG2 3.34Å; A840-V844 PolarHBondContact O-N 2.77Å; A841-V844 PolarHBondContact O-N 2.9Å; A841-V844 VanDerWaalsContact O-N 3.12Å; V844-K846 PolarHBondContact O-N 2.84Å
845	E	93.9	Very high	93.7	Very high	63 Å²	63	41.6 Å²	41.6	29%	0.294	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	9.3	177.4	-68.7	-68.2	-176	0	0	113.8	K802 L805 A841 R843 G847	K802-E845 HydrophobicContact CB-CG 4.29Å; K802-E845 WeakPolarHBondContact CD-OE1 3.44Å; K802-E845 HydrophobicContact CG-CG 4.26Å; K802-E845 IonicContact NZ-OE1 2.82Å; K802-E845 PolarHBondContact NZ-OE1 3.14Å; K802-E845 IonicContact NZ-OE2 2.65Å; K802-E845 PolarHBondContact NZ-OE2 2.82Å; L805-E845 HydrophobicContact CD1-CB 3.8Å; A841-E845 WeakPolarHBondContact O-CB 3.25Å; A841-E845 PolarHBondContact O-N 3.41Å; R843-E845 VanDerWaalsContact C-N 3.34Å; E845-G847 VanDerWaalsContact C-N 3.27Å; E845-G847 PolarHBondContact O-N 3.38Å
846	K	93.3	Very high	93.8	Very high	163 Å²	163	47.9 Å²	47.9	71%	0.709	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.5	37	179.1	-53.6	179.8	-179.3	178.3	0	114.1	V842 R843 V844 P849	V842-K846 PolarHBondContact O-N 3.05Å; R843-K846 PolarHBondContact O-N 3.36Å; V844-K846 PolarHBondContact O-N 2.84Å; K846-P849 WeakPolarHBondContact O-CD 3.43Å
847	G	94.8	Very high	94.1	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-76.6	-18.2	177.7	0	0	0	0	0	115.3	V842 E845 V850 L851	V842-G847 PolarHBondContact O-N 3.37Å; E845-G847 VanDerWaalsContact C-N 3.27Å; E845-G847 PolarHBondContact O-N 3.38Å; G847-V850 WeakPolarHBondContact O-CB 3.19Å; G847-V850 PolarHBondContact O-N 2.65Å; G847-L851 PolarHBondContact O-N 2.68Å; G847-L851 VanDerWaalsContact O-N 3.11Å
848	L	94.9	Very high	94.2	Very high	7 Å²	7	47.4 Å²	47.4	4%	0.037	25%	0.245	C	C	.	.	H	α-helix	trans	-62.4	-45.1	-177.9	-58.8	173.9	0	0	0	113.1	V842 R843 V850 L851 V852 L873 N879 L882 I883	V842-L848 HydrophobicContact CG1-CD2 3.98Å; V842-L848 HydrophobicContact CG1-CG 4.39Å; R843-L848 HydrophobicContact CB-CD1 4.34Å; R843-L848 HydrophobicContact CG-CD1 4.37Å; L848-V850 PolarHBondContact O-N 3.28Å; L848-L851 PolarHBondContact O-N 2.9Å; L848-V852 WeakPolarHBondContact O-CG2 3.42Å; L848-V852 PolarHBondContact O-N 2.93Å; L848-L873 HydrophobicContact CD2-CB 3.99Å; L848-L873 HydrophobicContact CD2-CG 3.86Å; L848-N879 HydrophobicContact CD1-CB 4.03Å; L848-N879 HydrophobicContact CD2-CB 4.44Å; L848-L882 HydrophobicContact CD1-CB 3.99Å; L848-L882 HydrophobicContact CD1-CD1 4.41Å; L848-I883 HydrophobicContact CB-CG1 4.43Å; L848-I883 HydrophobicContact CD1-CG1 4.42Å; L848-I883 HydrophobicContact CD2-CD1 4.26Å; L848-I883 HydrophobicContact CD2-CG1 4.2Å
849	P	93.1	Very high	94.1	Very high	86 Å²	86	50.2 Å²	50.2	56%	0.558	26%	0.258	S	S	*	.	H	α-helix	trans	-60.8	-39.4	173	-25.9	36.3	0	0	0	114	K846 L851 V852 E853	K846-P849 WeakPolarHBondContact O-CD 3.43Å; P849-L851 PolarHBondContact O-N 3.07Å; P849-V852 PolarHBondContact O-N 2.96Å; P849-E853 WeakPolarHBondContact O-CB 3.2Å; P849-E853 PolarHBondContact O-N 3.24Å
850	V	94.6	Very high	94	Very high	18 Å²	18	51.3 Å²	51.3	11%	0.109	27%	0.265	C	S	.	.	H	α-helix	trans	-58.8	-50.1	178.5	-173	0	0	0	0	110.2	L808 Q809 G847 L848 V852 E853 L854	L808-V850 HydrophobicContact CB-CG1 3.96Å; L808-V850 VanDerWaalsContact O-CG1 3.24Å; L808-V850 WeakPolarHBondContact O-CG1 3.16Å; Q809-V850 HydrophobicContact CG-CG1 3.86Å; Q809-V850 HydrophobicContact CG-CG2 3.82Å; G847-V850 WeakPolarHBondContact O-CB 3.19Å; G847-V850 PolarHBondContact O-N 2.65Å; L848-V850 PolarHBondContact O-N 3.28Å; V850-V852 VanDerWaalsContact C-N 3.33Å; V850-V852 PolarHBondContact O-N 3.45Å; V850-E853 PolarHBondContact O-N 2.67Å; V850-L854 HydrophobicContact CG1-CD1 4.27Å; V850-L854 WeakPolarHBondContact O-CG 3.43Å; V850-L854 PolarHBondContact O-N 3.3Å
851	L	95.8	Very high	93.9	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-36.4	177.6	-70.9	167.1	0	0	0	112	L808 V842 G847 L848 P849 I855 V866 L870 L873	L808-L851 HydrophobicContact CD1-CD2 3.95Å; V842-L851 HydrophobicContact CG1-CD1 4.38Å; G847-L851 PolarHBondContact O-N 2.68Å; G847-L851 VanDerWaalsContact O-N 3.11Å; L848-L851 PolarHBondContact O-N 2.9Å; P849-L851 PolarHBondContact O-N 3.07Å; L851-I855 PolarHBondContact O-N 2.67Å; L851-V866 HydrophobicContact CB-CG1 4.24Å; L851-V866 HydrophobicContact CD2-CG1 4.15Å; L851-V866 HydrophobicContact CD2-CG2 4.28Å; L851-V866 WeakPolarHBondContact O-CG1 3.26Å; L851-L870 HydrophobicContact CB-CD1 4.17Å; L851-L870 HydrophobicContact CB-CD2 3.59Å; L851-L870 HydrophobicContact CB-CG 3.84Å; L851-L870 HydrophobicContact CD1-CD2 4.21Å; L851-L873 HydrophobicContact CD1-CD1 3.75Å
852	V	93.9	Very high	93.8	Very high	17 Å²	17	53.4 Å²	53.4	10%	0.103	27%	0.267	C	S	.	.	H	α-helix	trans	-67.4	-36.1	174.6	167.1	0	0	0	0	112	L848 P849 V850 I855 L870 I883 A889	L848-V852 WeakPolarHBondContact O-CG2 3.42Å; L848-V852 PolarHBondContact O-N 2.93Å; P849-V852 PolarHBondContact O-N 2.96Å; V850-V852 VanDerWaalsContact C-N 3.33Å; V850-V852 PolarHBondContact O-N 3.45Å; V852-I855 WeakPolarHBondContact O-CB 3.37Å; V852-I855 PolarHBondContact O-N 3.18Å; V852-L870 HydrophobicContact CG2-CD1 4.15Å; V852-L870 HydrophobicContact CG2-CD2 4.28Å; V852-I883 HydrophobicContact CG2-CG2 4.21Å; V852-A889 HydrophobicContact CG1-CB 3.66Å; V852-A889 HydrophobicContact CG2-CB 4.01Å
853	E	93.4	Very high	93.8	Very high	127 Å²	127	53.4 Å²	53.4	59%	0.593	27%	0.268	S	S	*	.	H	α-helix	trans	-67.1	-42	177.4	-174.6	158.4	-149.5	0	0	111.8	P849 V850 I855 R856	P849-E853 WeakPolarHBondContact O-CB 3.2Å; P849-E853 PolarHBondContact O-N 3.24Å; V850-E853 PolarHBondContact O-N 2.67Å; E853-I855 PolarHBondContact O-N 3.24Å; E853-I855 VanDerWaalsContact O-N 3.17Å; E853-R856 WeakPolarHBondContact O-CB 3.4Å; E853-R856 PolarHBondContact O-N 3.28Å
854	L	95.3	Very high	93.8	Very high	20 Å²	20	51.5 Å²	51.5	11%	0.105	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-15.8	176.4	-67.7	169.5	0	0	0	114.3	L808 L817 V850 R856 L857 V866	L808-L854 HydrophobicContact CB-CD1 4.03Å; L808-L854 HydrophobicContact CD2-CD1 3.55Å; L808-L854 HydrophobicContact CG-CD1 4.32Å; L817-L854 HydrophobicContact CD1-CD2 4.42Å; L817-L854 HydrophobicContact CD2-CD2 4.48Å; V850-L854 HydrophobicContact CG1-CD1 4.27Å; V850-L854 WeakPolarHBondContact O-CG 3.43Å; V850-L854 PolarHBondContact O-N 3.3Å; L854-R856 PolarHBondContact O-N 3.03Å; L854-L857 HydrophobicContact CB-CD1 4.4Å; L854-L857 HydrophobicContact CD2-CD1 3.62Å; L854-L857 HydrophobicContact CD2-CG 4.28Å; L854-L857 WeakPolarHBondContact O-CB 3.18Å; L854-L857 PolarHBondContact O-N 3.29Å; L854-V866 HydrophobicContact CB-CG1 4.13Å; L854-V866 HydrophobicContact CB-CG2 4.04Å; L854-V866 HydrophobicContact CD1-CG2 4.35Å
855	I	95.3	Very high	93.8	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-24.9	169.8	-66.3	-71.4	0	0	0	111.6	L851 V852 E853 L857 V863 V866 A867 L870 D892 F893 K896	L851-I855 PolarHBondContact O-N 2.67Å; V852-I855 WeakPolarHBondContact O-CB 3.37Å; V852-I855 PolarHBondContact O-N 3.18Å; E853-I855 PolarHBondContact O-N 3.24Å; E853-I855 VanDerWaalsContact O-N 3.17Å; I855-L857 VanDerWaalsContact C-N 3.31Å; I855-L857 PolarHBondContact O-N 3.44Å; I855-V863 HydrophobicContact CD1-CG1 4.27Å; I855-V866 HydrophobicContact CD1-CB 4.34Å; I855-V866 HydrophobicContact CD1-CG1 3.74Å; I855-V866 HydrophobicContact CG1-CG1 3.97Å; I855-A867 HydrophobicContact CD1-CB 3.88Å; I855-L870 HydrophobicContact CD1-CD1 4.13Å; I855-L870 HydrophobicContact CG1-CD1 3.94Å; I855-D892 HydrophobicContact CG2-CB 4.07Å; I855-F893 HydrophobicContact CD1-CD1 4.36Å; I855-F893 HydrophobicContact CD1-CE1 4.08Å; I855-F893 HydrophobicContact CG1-CD1 4.34Å; I855-F893 HydrophobicContact CG1-CE1 3.93Å; I855-F893 HydrophobicContact CG2-CD1 4.24Å; I855-K896 HydrophobicContact CG2-CG 4.16Å; I855-K896 WeakPolarHBondContact O-CE 3.43Å
856	R	93.3	Very high	94	Very high	133 Å²	133	43.3 Å²	43.3	50%	0.502	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-14.7	-178.3	-60.7	-173.6	-175.6	121.5	14.7	114	E853 L854 D892	E853-R856 WeakPolarHBondContact O-CB 3.4Å; E853-R856 PolarHBondContact O-N 3.28Å; L854-R856 PolarHBondContact O-N 3.03Å; R856-D892 IonicContact CZ-OD1 3.48Å; R856-D892 IonicContact CZ-OD2 3.01Å; R856-D892 IonicContact NE-OD1 2.7Å; R856-D892 PolarHBondContact NE-OD1 3.07Å; R856-D892 IonicContact NE-OD2 3.92Å; R856-D892 VanDerWaalsContact NH2-CG 3.34Å; R856-D892 IonicContact NH2-OD1 3.48Å; R856-D892 PolarHBondContact NH2-OD1 2.82Å; R856-D892 VanDerWaalsContact NH2-OD1 3.16Å; R856-D892 IonicContact NH2-OD2 2.66Å; R856-D892 PolarHBondContact NH2-OD2 3.38Å
857	L	93.1	Very high	94.1	Very high	46 Å²	46	35.6 Å²	35.6	24%	0.241	18%	0.183	C	C	.	.	S	Bend	trans	-55.8	143.6	178	-75.5	-178	0	0	0	112.3	L817 L854 I855 E859 V862 V863 K896	L817-L857 HydrophobicContact CD1-CD1 4.22Å; L854-L857 HydrophobicContact CB-CD1 4.4Å; L854-L857 HydrophobicContact CD2-CD1 3.62Å; L854-L857 HydrophobicContact CD2-CG 4.28Å; L854-L857 WeakPolarHBondContact O-CB 3.18Å; L854-L857 PolarHBondContact O-N 3.29Å; I855-L857 VanDerWaalsContact C-N 3.31Å; I855-L857 PolarHBondContact O-N 3.44Å; L857-E859 VanDerWaalsContact C-N 3.3Å; L857-E859 WeakPolarHBondContact CB-OE2 3.31Å; L857-V862 HydrophobicContact CD1-CB 4.45Å; L857-V862 HydrophobicContact CD1-CG1 3.84Å; L857-V863 HydrophobicContact CB-CG2 4.29Å; L857-V863 VanDerWaalsContact O-CG2 3.28Å; L857-V863 WeakPolarHBondContact O-CG2 3.36Å; L857-K896 PolarHBondContact O-NZ 3.37Å
858	P	91.9	Very high	94.1	Very high	103 Å²	103	36.4 Å²	36.4	67%	0.669	19%	0.188	S	C	*	.	S	Bend	trans	-70.8	-22.3	173.2	27.7	-33.1	0	0	0	113.5	D860	P858-D860 PolarHBondContact O-N 3.43Å; P858-D860 VanDerWaalsContact O-N 3.12Å
859	E	93.3	Very high	94.2	Very high	59 Å²	59	36.1 Å²	36.1	28%	0.276	19%	0.186	S	C	.	.			trans	-69.1	102.7	-175	-65	73	-157.7	0	0	112.7	I814 L857 F861 V862 V863	I814-E859 HydrophobicContact CG2-CG 3.96Å; L857-E859 VanDerWaalsContact C-N 3.3Å; L857-E859 WeakPolarHBondContact CB-OE2 3.31Å; E859-F861 HydrophobicContact CB-CE1 4.38Å; E859-F861 PolarHBondContact O-N 3.33Å; E859-V862 HydrophobicContact CB-CB 4.16Å; E859-V862 HydrophobicContact CB-CG2 3.83Å; E859-V862 PolarHBondContact O-N 3.12Å; E859-V862 VanDerWaalsContact O-N 3.16Å; E859-V863 WeakPolarHBondContact O-CG2 3.35Å; E859-V863 PolarHBondContact O-N 3.07Å
860	D	91.3	Very high	94.3	Very high	37 Å²	37	32 Å²	32	20%	0.198	16%	0.16	C	C	.	.	H	α-helix	trans	-53.2	-45.6	-172.8	-175.4	67.9	0	0	0	113.7	P858 V863 C864 I908 S909 T912	P858-D860 PolarHBondContact O-N 3.43Å; P858-D860 VanDerWaalsContact O-N 3.12Å; D860-V863 PolarHBondContact O-N 3.39Å; D860-C864 WeakPolarHBondContact O-CB 3.35Å; D860-C864 PolarHBondContact O-N 2.81Å; D860-I908 VanDerWaalsContact OD1-CA 3.31Å; D860-I908 WeakPolarHBondContact OD1-CA 3.41Å; D860-I908 WeakPolarHBondContact OD1-CG2 3.48Å; D860-S909 PolarHBondContact OD1-N 3.43Å; D860-S909 WeakPolarHBondContact OD2-CB 3.32Å; D860-S909 PolarHBondContact OD2-N 3.18Å; D860-S909 PolarHBondContact OD2-OG 2.96Å; D860-T912 PolarHBondContact O-OG1 2.96Å; D860-T912 VanDerWaalsContact O-OG1 3.13Å; D860-T912 WeakPolarHBondContact OD1-CB 3.36Å; D860-T912 WeakPolarHBondContact OD1-CG2 3.42Å; D860-T912 PolarHBondContact OD1-OG1 3.44Å; D860-T912 PolarHBondContact OD2-OG1 2.99Å
861	F	91.1	Very high	94.2	Very high	80 Å²	80	32 Å²	32	35%	0.351	16%	0.158	S	C	.	.	H	α-helix	trans	-68.6	-35.7	-177.9	64.3	-92.3	0	0	0	113	I814 E818 E859 C864 A865	I814-F861 HydrophobicContact CB-CE2 4.4Å; I814-F861 HydrophobicContact CB-CZ 3.98Å; I814-F861 HydrophobicContact CD1-CE1 4.44Å; I814-F861 HydrophobicContact CD1-CZ 3.84Å; I814-F861 HydrophobicContact CG1-CZ 3.87Å; E818-F861 HydrophobicContact CB-CD2 3.94Å; E818-F861 HydrophobicContact CB-CE2 4.07Å; E818-F861 HydrophobicContact CG-CD2 3.98Å; E859-F861 HydrophobicContact CB-CE1 4.38Å; E859-F861 PolarHBondContact O-N 3.33Å; F861-C864 WeakPolarHBondContact O-CB 2.98Å; F861-C864 PolarHBondContact O-N 2.98Å; F861-A865 PolarHBondContact O-N 3.38Å
862	V	94.1	Very high	94.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66.1	-46.6	173.9	-174.7	0	0	0	0	109.5	I814 L817 L857 E859 C864 A865 V866	I814-V862 HydrophobicContact CB-CG2 4.36Å; L817-V862 HydrophobicContact CB-CG1 4.01Å; L857-V862 HydrophobicContact CD1-CB 4.45Å; L857-V862 HydrophobicContact CD1-CG1 3.84Å; E859-V862 HydrophobicContact CB-CB 4.16Å; E859-V862 HydrophobicContact CB-CG2 3.83Å; E859-V862 PolarHBondContact O-N 3.12Å; E859-V862 VanDerWaalsContact O-N 3.16Å; V862-C864 VanDerWaalsContact C-N 3.27Å; V862-C864 PolarHBondContact O-N 3.08Å; V862-A865 PolarHBondContact O-N 3.13Å; V862-V866 HydrophobicContact CG1-CG2 4.17Å; V862-V866 VanDerWaalsContact O-CB 3.31Å; V862-V866 WeakPolarHBondContact O-CB 3.36Å; V862-V866 WeakPolarHBondContact O-CG2 3.5Å; V862-V866 PolarHBondContact O-N 2.55Å
863	V	95.4	Very high	94.1	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-60.4	-37.5	175.7	178.3	0	0	0	0	111.2	I855 L857 E859 D860 A867 K896 T912	I855-V863 HydrophobicContact CD1-CG1 4.27Å; L857-V863 HydrophobicContact CB-CG2 4.29Å; L857-V863 VanDerWaalsContact O-CG2 3.28Å; L857-V863 WeakPolarHBondContact O-CG2 3.36Å; E859-V863 WeakPolarHBondContact O-CG2 3.35Å; E859-V863 PolarHBondContact O-N 3.07Å; D860-V863 PolarHBondContact O-N 3.39Å; V863-A867 WeakPolarHBondContact O-CB 3.26Å; V863-A867 PolarHBondContact O-N 3.45Å; V863-K896 HydrophobicContact CG1-CD 4.35Å; V863-K896 HydrophobicContact CG1-CG 4.3Å; V863-T912 HydrophobicContact CB-CG2 4.11Å; V863-T912 HydrophobicContact CG1-CG2 3.72Å
864	C	93.7	Very high	94.1	Very high	8 Å²	8	25.3 Å²	25.3	5%	0.054	13%	0.126	C	C	.	.	H	α-helix	trans	-60.7	-51.9	175	-165	0	0	0	0	112.4	D860 F861 V862 T868 Q911 T912	D860-C864 WeakPolarHBondContact O-CB 3.35Å; D860-C864 PolarHBondContact O-N 2.81Å; F861-C864 WeakPolarHBondContact O-CB 2.98Å; F861-C864 PolarHBondContact O-N 2.98Å; V862-C864 VanDerWaalsContact C-N 3.27Å; V862-C864 PolarHBondContact O-N 3.08Å; C864-T868 VanDerWaalsContact O-CB 3.3Å; C864-T868 WeakPolarHBondContact O-CB 3.35Å; C864-T868 PolarHBondContact O-N 2.9Å; C864-T868 PolarHBondContact O-OG1 2.85Å; C864-Q911 PolarHBondContact SG-NE2 3.31Å; C864-Q911 VanDerWaalsContact SG-NE2 3.36Å; C864-T912 WeakPolarHBondContact CB-OG1 3.26Å
865	A	94.8	Very high	93.7	Very high	4 Å²	4	27.2 Å²	27.2	3%	0.033	14%	0.135	C	C	.	.	H	α-helix	trans	-63.4	-43.2	178.7	0	0	0	0	0	111.4	E818 A821 Q825 F861 V862 T868 A869	E818-A865 HydrophobicContact CG-CB 4.2Å; A821-A865 HydrophobicContact CB-CB 4Å; Q825-A865 PolarHBondContact OE1-O 2.88Å; F861-A865 PolarHBondContact O-N 3.38Å; V862-A865 PolarHBondContact O-N 3.13Å; A865-T868 PolarHBondContact O-N 2.83Å; A865-A869 VanDerWaalsContact O-CB 3.3Å; A865-A869 WeakPolarHBondContact O-CB 3.22Å; A865-A869 PolarHBondContact O-N 3.45Å
866	V	97.1	Very high	93.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-66.8	-44.8	179.2	170.8	0	0	0	0	112.1	A821 L851 L854 I855 V862 T868 A869 L870	A821-V866 HydrophobicContact CB-CG2 3.66Å; L851-V866 HydrophobicContact CB-CG1 4.24Å; L851-V866 HydrophobicContact CD2-CG1 4.15Å; L851-V866 HydrophobicContact CD2-CG2 4.28Å; L851-V866 WeakPolarHBondContact O-CG1 3.26Å; L854-V866 HydrophobicContact CB-CG1 4.13Å; L854-V866 HydrophobicContact CB-CG2 4.04Å; L854-V866 HydrophobicContact CD1-CG2 4.35Å; I855-V866 HydrophobicContact CD1-CB 4.34Å; I855-V866 HydrophobicContact CD1-CG1 3.74Å; I855-V866 HydrophobicContact CG1-CG1 3.97Å; V862-V866 HydrophobicContact CG1-CG2 4.17Å; V862-V866 VanDerWaalsContact O-CB 3.31Å; V862-V866 WeakPolarHBondContact O-CB 3.36Å; V862-V866 WeakPolarHBondContact O-CG2 3.5Å; V862-V866 PolarHBondContact O-N 2.55Å; V866-T868 VanDerWaalsContact C-N 3.31Å; V866-T868 PolarHBondContact O-N 3.01Å; V866-A869 PolarHBondContact O-N 3.02Å; V866-L870 HydrophobicContact CG1-CD1 4.15Å; V866-L870 WeakPolarHBondContact O-CB 3.26Å; V866-L870 WeakPolarHBondContact O-CG 3.26Å; V866-L870 PolarHBondContact O-N 2.92Å
867	A	96.1	Very high	93.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.4	-38.7	175.8	0	0	0	0	0	111.8	I855 V863 L870 R871 A915 V916	I855-A867 HydrophobicContact CD1-CB 3.88Å; V863-A867 WeakPolarHBondContact O-CB 3.26Å; V863-A867 PolarHBondContact O-N 3.45Å; A867-L870 PolarHBondContact O-N 3.31Å; A867-R871 WeakPolarHBondContact O-CB 3.38Å; A867-R871 PolarHBondContact O-N 3.34Å; A867-A915 HydrophobicContact CB-CB 3.98Å; A867-V916 HydrophobicContact CB-CG2 4.19Å
868	T	94.9	Very high	93.1	Very high	18 Å²	18	29.9 Å²	29.9	11%	0.11	15%	0.154	C	C	.	.	H	α-helix	trans	-71.3	-38.3	177.3	-54.5	0	0	0	0	111.8	Q825 C864 A865 V866 R871 N872 A915 I1005	Q825-T868 VanDerWaalsContact CD-CG2 3.47Å; Q825-T868 HydrophobicContact CG-CG2 3.86Å; Q825-T868 VanDerWaalsContact OE1-CB 3.28Å; C864-T868 VanDerWaalsContact O-CB 3.3Å; C864-T868 WeakPolarHBondContact O-CB 3.35Å; C864-T868 PolarHBondContact O-N 2.9Å; C864-T868 PolarHBondContact O-OG1 2.85Å; A865-T868 PolarHBondContact O-N 2.83Å; V866-T868 VanDerWaalsContact C-N 3.31Å; V866-T868 PolarHBondContact O-N 3.01Å; T868-R871 PolarHBondContact O-N 3.13Å; T868-N872 PolarHBondContact O-N 3.45Å; T868-N872 VanDerWaalsContact O-N 3.1Å; T868-A915 WeakPolarHBondContact OG1-CB 3.29Å; T868-I1005 HydrophobicContact CG2-CD1 3.44Å; T868-I1005 VanDerWaalsContact CG2-CD1 3.44Å
869	A	96	Very high	93.2	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60	-50.7	169.7	0	0	0	0	0	110.8	Q825 A865 V866 R871 N872 L873	Q825-A869 HydrophobicContact CB-CB 3.97Å; A865-A869 VanDerWaalsContact O-CB 3.3Å; A865-A869 WeakPolarHBondContact O-CB 3.22Å; A865-A869 PolarHBondContact O-N 3.45Å; V866-A869 PolarHBondContact O-N 3.02Å; A869-R871 VanDerWaalsContact C-N 3.34Å; A869-R871 PolarHBondContact O-N 3.34Å; A869-N872 CarbonylContact O-C 3.48Å; A869-N872 WeakPolarHBondContact O-CA 3.33Å; A869-N872 WeakPolarHBondContact O-CB 3.42Å; A869-N872 PolarHBondContact O-N 3.5Å; A869-L873 HydrophobicContact CB-CD1 4.33Å; A869-L873 WeakPolarHBondContact O-CD1 3.33Å; A869-L873 PolarHBondContact O-N 2.92Å
870	L	95.8	Very high	93.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.2	-39.8	178.3	-74.6	170.4	0	0	0	112.5	L851 V852 I855 V866 A867 N872 L873 A874 I883 F893 I919	L851-L870 HydrophobicContact CB-CD1 4.17Å; L851-L870 HydrophobicContact CB-CD2 3.59Å; L851-L870 HydrophobicContact CB-CG 3.84Å; L851-L870 HydrophobicContact CD1-CD2 4.21Å; V852-L870 HydrophobicContact CG2-CD1 4.15Å; V852-L870 HydrophobicContact CG2-CD2 4.28Å; I855-L870 HydrophobicContact CD1-CD1 4.13Å; I855-L870 HydrophobicContact CG1-CD1 3.94Å; V866-L870 HydrophobicContact CG1-CD1 4.15Å; V866-L870 WeakPolarHBondContact O-CB 3.26Å; V866-L870 WeakPolarHBondContact O-CG 3.26Å; V866-L870 PolarHBondContact O-N 2.92Å; A867-L870 PolarHBondContact O-N 3.31Å; L870-N872 VanDerWaalsContact C-N 3.32Å; L870-N872 PolarHBondContact O-N 3.15Å; L870-L873 PolarHBondContact O-N 3.31Å; L870-A874 VanDerWaalsContact O-CB 3.23Å; L870-A874 WeakPolarHBondContact O-CB 3.43Å; L870-A874 PolarHBondContact O-N 2.62Å; L870-I883 HydrophobicContact CD2-CD1 4.09Å; L870-I883 HydrophobicContact CD2-CG1 4.25Å; L870-F893 HydrophobicContact CD1-CE1 3.96Å; L870-F893 HydrophobicContact CD1-CZ 4.12Å; L870-I919 HydrophobicContact CB-CD1 3.42Å; L870-I919 VanDerWaalsContact CB-CD1 3.42Å
871	R	93.3	Very high	92.9	Very high	19 Å²	19	26.9 Å²	26.9	7%	0.072	13%	0.129	C	C	.	.	H	α-helix	trans	-55.6	-47.1	171.1	178.2	-176.5	171.8	-144.5	-10	111	A867 T868 A869 A874 I919 E922 L1001 R1003 I1005	A867-R871 WeakPolarHBondContact O-CB 3.38Å; A867-R871 PolarHBondContact O-N 3.34Å; T868-R871 PolarHBondContact O-N 3.13Å; A869-R871 VanDerWaalsContact C-N 3.34Å; A869-R871 PolarHBondContact O-N 3.34Å; R871-A874 PolarHBondContact O-N 3.05Å; R871-I919 HydrophobicContact CB-CB 4.09Å; R871-E922 HydrophobicContact CG-CB 4.47Å; R871-L1001 PolarHBondContact NH2-O 3.1Å; R871-R1003 PolarHBondContact NH2-O 3.2Å; R871-I1005 VanDerWaalsContact NH1-CD1 3.25Å
872	N	92.9	Very high	92.8	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.016	14%	0.135	C	C	.	.	H	α-helix	trans	-68.7	-38.1	178.4	-70.7	-11.2	0	0	0	112.5	Q825 A828 A829 R839 T868 A869 L870 A874 I875 I1005	Q825-N872 PolarHBondContact O-ND2 2.69Å; A828-N872 HydrophobicContact CB-CB 3.81Å; A829-N872 WeakPolarHBondContact CA-ND2 3.41Å; R839-N872 VanDerWaalsContact CD-O 3.31Å; R839-N872 WeakPolarHBondContact CD-O 3.3Å; T868-N872 PolarHBondContact O-N 3.45Å; T868-N872 VanDerWaalsContact O-N 3.1Å; A869-N872 CarbonylContact O-C 3.48Å; A869-N872 WeakPolarHBondContact O-CA 3.33Å; A869-N872 WeakPolarHBondContact O-CB 3.42Å; A869-N872 PolarHBondContact O-N 3.5Å; L870-N872 VanDerWaalsContact C-N 3.32Å; L870-N872 PolarHBondContact O-N 3.15Å; N872-A874 VanDerWaalsContact C-N 3.34Å; N872-I875 PolarHBondContact O-N 2.87Å; N872-I1005 WeakPolarHBondContact OD1-CD1 3.45Å
873	L	94.4	Very high	92.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.4	-42.3	172.1	-85.6	96.6	0	0	0	111.7	I824 A828 R839 V842 L848 L851 A869 L870 I875 D876 N879	I824-L873 HydrophobicContact CG2-CD1 3.72Å; A828-L873 HydrophobicContact CB-CD2 4.26Å; R839-L873 HydrophobicContact CB-CD2 4.39Å; R839-L873 HydrophobicContact CG-CD2 3.96Å; V842-L873 HydrophobicContact CB-CD2 3.96Å; V842-L873 HydrophobicContact CG1-CD1 4.38Å; V842-L873 HydrophobicContact CG1-CD2 4.06Å; V842-L873 HydrophobicContact CG1-CG 4.06Å; V842-L873 HydrophobicContact CG2-CD2 4.09Å; L848-L873 HydrophobicContact CD2-CB 3.99Å; L848-L873 HydrophobicContact CD2-CG 3.86Å; L851-L873 HydrophobicContact CD1-CD1 3.75Å; A869-L873 HydrophobicContact CB-CD1 4.33Å; A869-L873 WeakPolarHBondContact O-CD1 3.33Å; A869-L873 PolarHBondContact O-N 2.92Å; L870-L873 PolarHBondContact O-N 3.31Å; L873-I875 PolarHBondContact O-N 3.27Å; L873-I875 VanDerWaalsContact O-N 3.17Å; L873-D876 PolarHBondContact O-N 3.37Å; L873-N879 WeakPolarHBondContact O-CB 3.49Å; L873-N879 PolarHBondContact O-ND2 2.97Å
874	A	92.5	Very high	91.8	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-6.4	-176.6	0	0	0	0	0	114.6	L870 R871 N872 D876 R880 I883 E922	L870-A874 VanDerWaalsContact O-CB 3.23Å; L870-A874 WeakPolarHBondContact O-CB 3.43Å; L870-A874 PolarHBondContact O-N 2.62Å; R871-A874 PolarHBondContact O-N 3.05Å; N872-A874 VanDerWaalsContact C-N 3.34Å; A874-D876 PolarHBondContact O-N 3.1Å; A874-R880 HydrophobicContact CB-CB 4.3Å; A874-R880 HydrophobicContact CB-CG 4.24Å; A874-R880 PolarHBondContact O-NE 3.14Å; A874-R880 PolarHBondContact O-NH2 2.75Å; A874-I883 HydrophobicContact CB-CD1 3.97Å; A874-E922 HydrophobicContact CB-CG 3.67Å
875	I	88.2	Confident	90.9	Very high	60 Å²	60	31.9 Å²	31.9	31%	0.308	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-36.3	168.7	-65	167.2	0	0	0	110.8	N872 L873 P877 R880	N872-I875 PolarHBondContact O-N 2.87Å; L873-I875 PolarHBondContact O-N 3.27Å; L873-I875 VanDerWaalsContact O-N 3.17Å; I875-P877 WeakPolarHBondContact O-CD 3.14Å; I875-R880 PolarHBondContact O-NH2 3.08Å
876	D	88.6	Confident	89.2	Confident	15 Å²	15	33.7 Å²	33.7	8%	0.08	18%	0.184	C	C	.	.	S	Bend	trans	-74.8	118.3	170	-175.7	-24.7	0	0	0	109.4	R839 R843 L873 A874 R878 N879 R880	R839-D876 HydrophobicContact CB-CB 4.41Å; R843-D876 IonicContact CZ-OD2 2.68Å; R843-D876 VanDerWaalsContact NH1-CG 3.33Å; R843-D876 IonicContact NH1-OD1 3.29Å; R843-D876 IonicContact NH1-OD2 2.6Å; R843-D876 PolarHBondContact NH1-OD2 2.95Å; R843-D876 IonicContact NH2-OD2 2.75Å; L873-D876 PolarHBondContact O-N 3.37Å; A874-D876 PolarHBondContact O-N 3.1Å; D876-R878 PolarHBondContact O-N 3.23Å; D876-R878 WeakPolarHBondContact OD1-CB 2.84Å; D876-R878 IonicContact OD1-CZ 3.02Å; D876-R878 PolarHBondContact OD1-N 3.23Å; D876-R878 IonicContact OD1-NE 3.8Å; D876-R878 PolarHBondContact OD1-NE 2.92Å; D876-R878 IonicContact OD1-NH2 3.79Å; D876-R878 IonicContact OD2-CZ 3.94Å; D876-R878 IonicContact OD2-NE 3.91Å; D876-R878 PolarHBondContact OD2-NE 2.74Å; D876-R878 IonicContact OD2-NH2 3.86Å; D876-R878 PolarHBondContact OD2-NH2 2.69Å; D876-N879 HydrophobicContact CB-CB 4.23Å; D876-N879 WeakPolarHBondContact O-CB 3.44Å; D876-N879 PolarHBondContact O-N 3.12Å; D876-R880 PolarHBondContact O-N 3.5Å
877	P	89.7	Confident	87.6	Confident	83 Å²	83	37.3 Å²	37.3	54%	0.539	20%	0.2	S	C	.	.	H	α-helix	trans	-55.2	-31.6	-178.2	-26.6	35.5	0	0	0	113.9	I875 N879 R880 E881	I875-P877 WeakPolarHBondContact O-CD 3.14Å; P877-N879 VanDerWaalsContact C-N 3.31Å; P877-N879 PolarHBondContact O-N 2.95Å; P877-R880 PolarHBondContact O-N 2.95Å; P877-E881 PolarHBondContact O-N 2.71Å
878	R	91.2	Very high	86.6	Confident	137 Å²	137	44.6 Å²	44.6	52%	0.517	23%	0.229	S	C	.	.	H	α-helix	trans	-72.1	-26.1	179.1	-56.4	166.7	-66.5	-172.5	2.2	112.4	R843 D876 L882	R843-R878 VanDerWaalsContact NH2-CZ 3.27Å; D876-R878 PolarHBondContact O-N 3.23Å; D876-R878 WeakPolarHBondContact OD1-CB 2.84Å; D876-R878 IonicContact OD1-CZ 3.02Å; D876-R878 PolarHBondContact OD1-N 3.23Å; D876-R878 IonicContact OD1-NE 3.8Å; D876-R878 PolarHBondContact OD1-NE 2.92Å; D876-R878 IonicContact OD1-NH2 3.79Å; D876-R878 IonicContact OD2-CZ 3.94Å; D876-R878 IonicContact OD2-NE 3.91Å; D876-R878 PolarHBondContact OD2-NE 2.74Å; D876-R878 IonicContact OD2-NH2 3.86Å; D876-R878 PolarHBondContact OD2-NH2 2.69Å; R878-L882 WeakPolarHBondContact O-CD1 3.49Å; R878-L882 VanDerWaalsContact O-CG 3.32Å; R878-L882 WeakPolarHBondContact O-CG 3.49Å
879	N	93	Very high	86.3	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-77.6	-44.9	170.8	-70.4	-5.8	0	0	0	110	R839 R843 L848 L873 D876 P877 E881 L882 I883	R839-N879 PolarHBondContact O-ND2 3.5Å; R839-N879 PolarHBondContact O-OD1 3Å; R843-N879 WeakPolarHBondContact CB-OD1 3.39Å; R843-N879 WeakPolarHBondContact CD-OD1 3.43Å; R843-N879 PolarHBondContact NH1-OD1 3.01Å; L848-N879 HydrophobicContact CD1-CB 4.03Å; L848-N879 HydrophobicContact CD2-CB 4.44Å; L873-N879 WeakPolarHBondContact O-CB 3.49Å; L873-N879 PolarHBondContact O-ND2 2.97Å; D876-N879 HydrophobicContact CB-CB 4.23Å; D876-N879 WeakPolarHBondContact O-CB 3.44Å; D876-N879 PolarHBondContact O-N 3.12Å; P877-N879 VanDerWaalsContact C-N 3.31Å; P877-N879 PolarHBondContact O-N 2.95Å; N879-E881 VanDerWaalsContact C-N 3.31Å; N879-E881 PolarHBondContact O-N 3.11Å; N879-L882 PolarHBondContact O-N 3.47Å; N879-L882 VanDerWaalsContact O-N 3.14Å; N879-I883 VanDerWaalsContact O-CG1 3.27Å; N879-I883 WeakPolarHBondContact O-CG1 3.38Å; N879-I883 PolarHBondContact O-N 3.37Å
880	R	90.4	Very high	86.1	Confident	22 Å²	22	44 Å²	44	8%	0.083	23%	0.225	C	C	.	.	H	α-helix	trans	-55	-46.6	179.4	-161	-173.7	-63	122.7	2.2	111.7	A874 I875 D876 P877 I883 V884 E922 I923 S926	A874-R880 HydrophobicContact CB-CB 4.3Å; A874-R880 HydrophobicContact CB-CG 4.24Å; A874-R880 PolarHBondContact O-NE 3.14Å; A874-R880 PolarHBondContact O-NH2 2.75Å; I875-R880 PolarHBondContact O-NH2 3.08Å; D876-R880 PolarHBondContact O-N 3.5Å; P877-R880 PolarHBondContact O-N 2.95Å; R880-I883 PolarHBondContact O-N 3.4Å; R880-V884 WeakPolarHBondContact O-CG2 3.22Å; R880-V884 PolarHBondContact O-N 2.95Å; R880-E922 WeakPolarHBondContact CD-O 3.33Å; R880-E922 IonicContact CZ-OE1 3.78Å; R880-E922 PolarHBondContact NE-O 3.17Å; R880-E922 VanDerWaalsContact NE-O 3.11Å; R880-E922 IonicContact NE-OE1 3.63Å; R880-E922 PolarHBondContact NE-OE1 3.43Å; R880-E922 IonicContact NH2-OE1 2.73Å; R880-E922 PolarHBondContact NH2-OE1 2.77Å; R880-I923 HydrophobicContact CG-CG1 4.24Å; R880-S926 WeakPolarHBondContact CD-OG 3.48Å
881	E	87.9	Confident	86	Confident	114 Å²	114	49.1 Å²	49.1	53%	0.533	24%	0.244	S	C	.	.	H	α-helix	trans	-58.9	-48	175.1	-177.2	175.5	-163.2	0	0	112.3	P877 N879 I883 V884 S885	P877-E881 PolarHBondContact O-N 2.71Å; N879-E881 VanDerWaalsContact C-N 3.31Å; N879-E881 PolarHBondContact O-N 3.11Å; E881-I883 PolarHBondContact O-N 3.14Å; E881-V884 PolarHBondContact O-N 3.16Å; E881-S885 WeakPolarHBondContact O-CB 3.37Å; E881-S885 PolarHBondContact O-N 3.39Å
882	L	87.8	Confident	86	Confident	92 Å²	92	49 Å²	49	48%	0.482	25%	0.246	S	C	.	.	H	α-helix	trans	-71.6	-25.9	-178.9	-71.2	172.8	0	0	0	114.4	R843 L848 R878 N879 V884 S885	R843-L882 HydrophobicContact CG-CD1 3.66Å; L848-L882 HydrophobicContact CD1-CB 3.99Å; L848-L882 HydrophobicContact CD1-CD1 4.41Å; R878-L882 WeakPolarHBondContact O-CD1 3.49Å; R878-L882 VanDerWaalsContact O-CG 3.32Å; R878-L882 WeakPolarHBondContact O-CG 3.49Å; N879-L882 PolarHBondContact O-N 3.47Å; N879-L882 VanDerWaalsContact O-N 3.14Å; L882-V884 VanDerWaalsContact C-N 3.34Å; L882-S885 PolarHBondContact O-OG 3.22Å
883	I	87.8	Confident	86.1	Confident	9 Å²	9	48.9 Å²	48.9	5%	0.046	25%	0.245	C	C	.	.	H	α-helix	trans	-66.5	-39.4	173.3	-71.8	161.8	0	0	0	109.9	L848 V852 L870 A874 N879 R880 E881 A889 F893	L848-I883 HydrophobicContact CB-CG1 4.43Å; L848-I883 HydrophobicContact CD1-CG1 4.42Å; L848-I883 HydrophobicContact CD2-CD1 4.26Å; L848-I883 HydrophobicContact CD2-CG1 4.2Å; V852-I883 HydrophobicContact CG2-CG2 4.21Å; L870-I883 HydrophobicContact CD2-CD1 4.09Å; L870-I883 HydrophobicContact CD2-CG1 4.25Å; A874-I883 HydrophobicContact CB-CD1 3.97Å; N879-I883 VanDerWaalsContact O-CG1 3.27Å; N879-I883 WeakPolarHBondContact O-CG1 3.38Å; N879-I883 PolarHBondContact O-N 3.37Å; R880-I883 PolarHBondContact O-N 3.4Å; E881-I883 PolarHBondContact O-N 3.14Å; I883-A889 HydrophobicContact CG2-CB 4.19Å; I883-A889 WeakPolarHBondContact O-CB 3.4Å; I883-F893 HydrophobicContact CG2-CE2 4.1Å; I883-F893 HydrophobicContact CG2-CZ 4.04Å
884	V	81.7	Confident	86.1	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.018	25%	0.246	C	C	.	.	H	α-helix	trans	-102.1	-7.3	-171.6	-53.9	0	0	0	0	114.8	R880 E881 L882 G886 K887 L890 I923 Y930	R880-V884 WeakPolarHBondContact O-CG2 3.22Å; R880-V884 PolarHBondContact O-N 2.95Å; E881-V884 PolarHBondContact O-N 3.16Å; L882-V884 VanDerWaalsContact C-N 3.34Å; V884-G886 PolarHBondContact O-N 3.16Å; V884-K887 PolarHBondContact O-N 3.06Å; V884-L890 HydrophobicContact CB-CD1 4.49Å; V884-L890 HydrophobicContact CB-CG 4.44Å; V884-L890 HydrophobicContact CG1-CD2 4.28Å; V884-L890 HydrophobicContact CG1-CG 4.17Å; V884-I923 HydrophobicContact CG1-CD1 3.66Å; V884-I923 HydrophobicContact CG1-CG1 4.02Å; V884-I923 HydrophobicContact CG1-CG2 3.95Å; V884-Y930 HydrophobicContact CB-CD1 4.47Å; V884-Y930 HydrophobicContact CG2-CD1 3.63Å; V884-Y930 HydrophobicContact CG2-CD2 3.95Å; V884-Y930 HydrophobicContact CG2-CE1 3.32Å; V884-Y930 HydrophobicContact CG2-CE2 3.67Å; V884-Y930 HydrophobicContact CG2-CG 3.95Å
885	S	74	Confident	86.1	Confident	91 Å²	91	53.7 Å²	53.7	64%	0.636	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-9	-170.4	58.8	0	0	0	0	116.3	E881 L882	E881-S885 WeakPolarHBondContact O-CB 3.37Å; E881-S885 PolarHBondContact O-N 3.39Å; L882-S885 PolarHBondContact O-OG 3.22Å
886	G	60.8	Low	86.3	Confident	42 Å²	42	52.2 Å²	52.2	43%	0.433	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	2.7	173.2	0	0	0	0	0	115.7	V884 Y888	V884-G886 PolarHBondContact O-N 3.16Å; G886-Y888 WeakPolarHBondContact O-CD2 3.45Å; G886-Y888 WeakPolarHBondContact O-CE2 3.47Å; G886-Y888 PolarHBondContact O-N 2.72Å
887	K	62.5	Low	86.5	Confident	76 Å²	76	51.6 Å²	51.6	33%	0.33	26%	0.259	S	S	.	.	S	Bend	trans	56.6	-22.9	-163.9	-57.1	-157.4	-170.3	-160.6	0	116.7	V884 A889 L890 R891 D933 E936	V884-K887 PolarHBondContact O-N 3.06Å; K887-A889 PolarHBondContact O-N 2.99Å; K887-L890 WeakPolarHBondContact O-CB 3.28Å; K887-L890 PolarHBondContact O-N 2.94Å; K887-L890 VanDerWaalsContact O-N 3.08Å; K887-R891 PolarHBondContact O-N 3.09Å; K887-D933 HydrophobicContact CD-CB 4.33Å; K887-D933 VanDerWaalsContact CE-CG 3.48Å; K887-D933 WeakPolarHBondContact CE-OD1 3.47Å; K887-D933 IonicContact NZ-OD1 3.56Å; K887-D933 PolarHBondContact NZ-OD1 3.16Å; K887-D933 IonicContact NZ-OD2 3.34Å; K887-E936 IonicContact NZ-OE2 3.69Å; K887-E936 PolarHBondContact NZ-OE2 2.85Å
888	Y	76.1	Confident	86.5	Confident	153 Å²	153	48.5 Å²	48.5	60%	0.6	24%	0.239	S	C	*	.	H	α-helix	trans	-52.3	-50.5	-177.6	-62.8	-77.5	0	0	0	113	G886 L890 R891 D892	G886-Y888 WeakPolarHBondContact O-CD2 3.45Å; G886-Y888 WeakPolarHBondContact O-CE2 3.47Å; G886-Y888 PolarHBondContact O-N 2.72Å; Y888-L890 VanDerWaalsContact C-N 3.25Å; Y888-L890 PolarHBondContact O-N 2.96Å; Y888-R891 CarbonylContact O-C 3.6Å; Y888-R891 WeakPolarHBondContact O-CA 3.27Å; Y888-R891 WeakPolarHBondContact O-CB 3.43Å; Y888-R891 PolarHBondContact O-N 3.2Å; Y888-D892 PolarHBondContact O-N 3.49Å
889	A	88.3	Confident	86.4	Confident	4 Å²	4	47.3 Å²	47.3	3%	0.033	24%	0.239	C	C	.	.	H	α-helix	trans	-56	-36.5	178.6	0	0	0	0	0	113.6	V852 I883 K887 R891 D892 F893	V852-A889 HydrophobicContact CG1-CB 3.66Å; V852-A889 HydrophobicContact CG2-CB 4.01Å; I883-A889 HydrophobicContact CG2-CB 4.19Å; I883-A889 WeakPolarHBondContact O-CB 3.4Å; K887-A889 PolarHBondContact O-N 2.99Å; A889-R891 VanDerWaalsContact C-N 3.32Å; A889-R891 PolarHBondContact O-N 3.43Å; A889-D892 PolarHBondContact N-OD2 3.21Å; A889-D892 PolarHBondContact O-N 3.02Å; A889-F893 HydrophobicContact CB-CE2 4.02Å; A889-F893 HydrophobicContact CB-CZ 4.21Å; A889-F893 WeakPolarHBondContact O-CD2 3.5Å; A889-F893 WeakPolarHBondContact O-CE2 3.48Å; A889-F893 WeakPolarHBondContact O-CG 3.48Å; A889-F893 PolarHBondContact O-N 3.37Å
890	L	91.8	Very high	86	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66	-34.9	175.5	-75	177.2	0	0	0	112.1	V884 K887 Y888 F893 L894 L920 I923 D933 V934 L937	V884-L890 HydrophobicContact CB-CD1 4.49Å; V884-L890 HydrophobicContact CB-CG 4.44Å; V884-L890 HydrophobicContact CG1-CD2 4.28Å; V884-L890 HydrophobicContact CG1-CG 4.17Å; K887-L890 WeakPolarHBondContact O-CB 3.28Å; K887-L890 PolarHBondContact O-N 2.94Å; K887-L890 VanDerWaalsContact O-N 3.08Å; Y888-L890 VanDerWaalsContact C-N 3.25Å; Y888-L890 PolarHBondContact O-N 2.96Å; L890-F893 HydrophobicContact CD2-CD2 4.39Å; L890-L894 WeakPolarHBondContact O-CB 3.33Å; L890-L894 WeakPolarHBondContact O-CD1 3.31Å; L890-L894 WeakPolarHBondContact O-CG 3.28Å; L890-L894 PolarHBondContact O-N 3.33Å; L890-L894 VanDerWaalsContact O-N 3.13Å; L890-L920 HydrophobicContact CD2-CD2 4.14Å; L890-I923 HydrophobicContact CD2-CD1 3.95Å; L890-I923 HydrophobicContact CD2-CG2 4.18Å; L890-D933 HydrophobicContact CD1-CB 3.77Å; L890-V934 HydrophobicContact CD1-CG2 4.31Å; L890-V934 HydrophobicContact CD2-CG2 3.88Å; L890-L937 HydrophobicContact CB-CD1 3.79Å
891	R	92.5	Very high	85.2	Confident	108 Å²	108	53.3 Å²	53.3	41%	0.408	30%	0.295	S	S	.	.	H	α-helix	trans	-68.5	-49.4	170.2	-177.3	-179.2	-59.9	117.2	4.2	110.5	K887 Y888 A889 F893 L894 D895 L937	K887-R891 PolarHBondContact O-N 3.09Å; Y888-R891 CarbonylContact O-C 3.6Å; Y888-R891 WeakPolarHBondContact O-CA 3.27Å; Y888-R891 WeakPolarHBondContact O-CB 3.43Å; Y888-R891 PolarHBondContact O-N 3.2Å; A889-R891 VanDerWaalsContact C-N 3.32Å; A889-R891 PolarHBondContact O-N 3.43Å; R891-F893 PolarHBondContact O-N 3.17Å; R891-L894 CarbonylContact O-C 3.53Å; R891-L894 PolarHBondContact O-N 3.5Å; R891-D895 VanDerWaalsContact CG-OD2 3.28Å; R891-D895 WeakPolarHBondContact CG-OD2 3.37Å; R891-D895 WeakPolarHBondContact O-CB 3.46Å; R891-D895 VanDerWaalsContact O-CG 3.25Å; R891-D895 PolarHBondContact O-N 3.13Å; R891-L937 HydrophobicContact CB-CD1 4.41Å
892	D	93.5	Very high	84.4	Confident	18 Å²	18	50.1 Å²	50.1	10%	0.096	29%	0.285	C	S	.	.	H	α-helix	trans	-55.4	-38.3	179.9	-59.3	-53.5	0	0	0	112	I855 R856 Y888 A889	I855-D892 HydrophobicContact CG2-CB 4.07Å; R856-D892 IonicContact CZ-OD1 3.48Å; R856-D892 IonicContact CZ-OD2 3.01Å; R856-D892 IonicContact NE-OD1 2.7Å; R856-D892 PolarHBondContact NE-OD1 3.07Å; R856-D892 IonicContact NE-OD2 3.92Å; R856-D892 VanDerWaalsContact NH2-CG 3.34Å; R856-D892 IonicContact NH2-OD1 3.48Å; R856-D892 PolarHBondContact NH2-OD1 2.82Å; R856-D892 VanDerWaalsContact NH2-OD1 3.16Å; R856-D892 IonicContact NH2-OD2 2.66Å; R856-D892 PolarHBondContact NH2-OD2 3.38Å; Y888-D892 PolarHBondContact O-N 3.49Å; A889-D892 PolarHBondContact N-OD2 3.21Å; A889-D892 PolarHBondContact O-N 3.02Å
893	F	94.9	Very high	83.6	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-68.8	-43.7	171.6	-58.4	-39.2	0	0	0	113.1	I855 L870 I883 A889 L890 R891 D895 K896 V916 I919 L920 I923	I855-F893 HydrophobicContact CD1-CD1 4.36Å; I855-F893 HydrophobicContact CD1-CE1 4.08Å; I855-F893 HydrophobicContact CG1-CD1 4.34Å; I855-F893 HydrophobicContact CG1-CE1 3.93Å; I855-F893 HydrophobicContact CG2-CD1 4.24Å; L870-F893 HydrophobicContact CD1-CE1 3.96Å; L870-F893 HydrophobicContact CD1-CZ 4.12Å; I883-F893 HydrophobicContact CG2-CE2 4.1Å; I883-F893 HydrophobicContact CG2-CZ 4.04Å; A889-F893 HydrophobicContact CB-CE2 4.02Å; A889-F893 HydrophobicContact CB-CZ 4.21Å; A889-F893 WeakPolarHBondContact O-CD2 3.5Å; A889-F893 WeakPolarHBondContact O-CE2 3.48Å; A889-F893 WeakPolarHBondContact O-CG 3.48Å; A889-F893 PolarHBondContact O-N 3.37Å; L890-F893 HydrophobicContact CD2-CD2 4.39Å; R891-F893 PolarHBondContact O-N 3.17Å; F893-D895 VanDerWaalsContact C-N 3.34Å; F893-K896 PolarHBondContact O-N 3.47Å; F893-V916 HydrophobicContact CB-CG1 4.18Å; F893-V916 WeakPolarHBondContact O-CG1 3.41Å; F893-I919 HydrophobicContact CD1-CG2 4.15Å; F893-I919 HydrophobicContact CD2-CG1 4.5Å; F893-I919 HydrophobicContact CE1-CD1 3.96Å; F893-I919 HydrophobicContact CE1-CG2 4.18Å; F893-I919 HydrophobicContact CE2-CD1 3.75Å; F893-I919 HydrophobicContact CE2-CG1 3.95Å; F893-I919 HydrophobicContact CG-CG2 4.35Å; F893-I919 HydrophobicContact CZ-CD1 3.34Å; F893-I919 HydrophobicContact CZ-CG1 4Å; F893-I919 HydrophobicContact CZ-CG2 4.42Å; F893-L920 HydrophobicContact CB-CD2 4.03Å; F893-L920 HydrophobicContact CB-CG 4.28Å; F893-L920 HydrophobicContact CD2-CD2 4.33Å; F893-I923 HydrophobicContact CD2-CD1 4.17Å; F893-I923 HydrophobicContact CE2-CD1 3.75Å
894	L	94.3	Very high	82.8	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.021	32%	0.315	C	S	.	.	H	α-helix	trans	-71.5	-27.5	-179.3	-72.2	173.6	0	0	0	112.9	L890 R891 K896 L897 L920 V934 L937 K942	L890-L894 WeakPolarHBondContact O-CB 3.33Å; L890-L894 WeakPolarHBondContact O-CD1 3.31Å; L890-L894 WeakPolarHBondContact O-CG 3.28Å; L890-L894 PolarHBondContact O-N 3.33Å; L890-L894 VanDerWaalsContact O-N 3.13Å; R891-L894 CarbonylContact O-C 3.53Å; R891-L894 PolarHBondContact O-N 3.5Å; L894-K896 VanDerWaalsContact C-N 3.26Å; L894-K896 PolarHBondContact O-N 3.44Å; L894-L897 HydrophobicContact CD2-CD1 3.97Å; L894-L897 WeakPolarHBondContact O-CB 3.49Å; L894-L897 PolarHBondContact O-N 3.44Å; L894-L897 VanDerWaalsContact O-N 3.12Å; L894-L920 HydrophobicContact CD2-CD1 4.02Å; L894-L920 HydrophobicContact CD2-CD2 4.42Å; L894-V934 HydrophobicContact CD1-CG1 4.41Å; L894-V934 HydrophobicContact CD2-CG1 4.49Å; L894-L937 HydrophobicContact CD1-CB 3.63Å; L894-L937 HydrophobicContact CD1-CD1 4.23Å; L894-K942 WeakPolarHBondContact O-CD 3.5Å; L894-K942 WeakPolarHBondContact O-CE 3.47Å; L894-K942 PolarHBondContact O-NZ 3.16Å
895	D	92.6	Very high	81.6	Confident	97 Å²	97	67.4 Å²	67.4	52%	0.519	35%	0.354	S	S	.	.	H	α-helix	trans	-73.3	-20.6	176.1	-67.8	-5.1	0	0	0	111.5	R891 F893	R891-D895 VanDerWaalsContact CG-OD2 3.28Å; R891-D895 WeakPolarHBondContact CG-OD2 3.37Å; R891-D895 WeakPolarHBondContact O-CB 3.46Å; R891-D895 VanDerWaalsContact O-CG 3.25Å; R891-D895 PolarHBondContact O-N 3.13Å; F893-D895 VanDerWaalsContact C-N 3.34Å
896	K	92.6	Very high	81.1	Confident	28 Å²	28	65.6 Å²	65.6	12%	0.122	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-4	167.6	-67.3	-63.1	-170.5	178	0	114.4	I855 L857 V863 F893 L894 I908 V916	I855-K896 HydrophobicContact CG2-CG 4.16Å; I855-K896 WeakPolarHBondContact O-CE 3.43Å; L857-K896 PolarHBondContact O-NZ 3.37Å; V863-K896 HydrophobicContact CG1-CD 4.35Å; V863-K896 HydrophobicContact CG1-CG 4.3Å; F893-K896 PolarHBondContact O-N 3.47Å; L894-K896 VanDerWaalsContact C-N 3.26Å; L894-K896 PolarHBondContact O-N 3.44Å; K896-I908 HydrophobicContact CB-CD1 4.39Å; K896-I908 HydrophobicContact CD-CD1 3.8Å; K896-I908 WeakPolarHBondContact O-CD1 3.35Å; K896-V916 HydrophobicContact CB-CG2 4.12Å
897	L	93.2	Very high	81.5	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.016	36%	0.359	C	S	.	.	S	Bend	trans	-90.6	139.3	168.5	-63.5	-174	0	0	0	110.6	L894 I913 V916 L917 L920 K942 L943 L946	L894-L897 HydrophobicContact CD2-CD1 3.97Å; L894-L897 WeakPolarHBondContact O-CB 3.49Å; L894-L897 PolarHBondContact O-N 3.44Å; L894-L897 VanDerWaalsContact O-N 3.12Å; L897-I913 HydrophobicContact CD2-CG2 4.01Å; L897-V916 HydrophobicContact CD2-CB 4.33Å; L897-V916 HydrophobicContact CD2-CG1 3.72Å; L897-V916 HydrophobicContact CG-CG1 4.05Å; L897-L917 HydrophobicContact CD1-CD2 4.1Å; L897-L917 HydrophobicContact CD2-CD2 4.07Å; L897-L917 HydrophobicContact CD2-CG 4.14Å; L897-L920 HydrophobicContact CD1-CD1 3.77Å; L897-L920 HydrophobicContact CG-CD1 4.43Å; L897-K942 HydrophobicContact CB-CB 4.48Å; L897-K942 HydrophobicContact CB-CD 3.92Å; L897-K942 PolarHBondContact O-NZ 3.46Å; L897-L943 HydrophobicContact CD1-CD2 4.06Å; L897-L943 HydrophobicContact CD1-CG 4.5Å; L897-L946 HydrophobicContact CD2-CD2 4.29Å
898	P	90.6	Very high	82.7	Confident	18 Å²	18	66.3 Å²	66.3	12%	0.117	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-61.6	150.8	-178.4	26.9	-35.8	0	0	0	112.5	L946 Y953	P898-L946 HydrophobicContact CG-CD1 3.93Å; P898-Y953 VanDerWaalsContact CB-OH 3.26Å; P898-Y953 WeakPolarHBondContact CB-OH 3.39Å; P898-Y953 HydrophobicContact CG-CE1 4.29Å; P898-Y953 HydrophobicContact CG-CE2 4.2Å
899	E	88.3	Confident	83.4	Confident	112 Å²	112	61 Å²	61	52%	0.523	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-76.1	144.2	178	-67.7	-59	157.4	0	0	111.8	G901 S902 K942	E899-G901 PolarHBondContact O-N 2.95Å; E899-S902 PolarHBondContact N-OG 2.87Å; E899-S902 WeakPolarHBondContact O-CB 3.47Å; E899-S902 PolarHBondContact O-N 3.41Å; E899-S902 PolarHBondContact O-OG 3Å; E899-K942 WeakPolarHBondContact OE1-CE 3.41Å; E899-K942 IonicContact OE1-NZ 2.84Å; E899-K942 PolarHBondContact OE1-NZ 3.11Å; E899-K942 VanDerWaalsContact OE2-CE 3.25Å; E899-K942 WeakPolarHBondContact OE2-CE 3.28Å; E899-K942 IonicContact OE2-NZ 3.18Å
900	P	85	Confident	83.4	Confident	67 Å²	67	62.3 Å²	62.3	44%	0.435	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	124.1	177.8	-26.9	36.4	0	0	0	112.4	S902 A945	P900-S902 VanDerWaalsContact C-N 3.29Å; P900-S902 PolarHBondContact O-N 3.39Å; P900-A945 HydrophobicContact CB-CB 3.78Å; P900-A945 HydrophobicContact CG-CB 4.04Å
901	G	72.5	Confident	83.3	Confident	80 Å²	80	69 Å²	69	83%	0.825	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	5.6	-179.8	0	0	0	0	0	115.3	E899	E899-G901 PolarHBondContact O-N 2.95Å
902	S	71.9	Confident	83.3	Confident	47 Å²	47	63.8 Å²	63.8	33%	0.329	36%	0.356	S	S	.	.			trans	-67.4	133.8	170.6	58.9	0	0	0	0	111.1	E899 P900	E899-S902 PolarHBondContact N-OG 2.87Å; E899-S902 WeakPolarHBondContact O-CB 3.47Å; E899-S902 PolarHBondContact O-N 3.41Å; E899-S902 PolarHBondContact O-OG 3Å; P900-S902 VanDerWaalsContact C-N 3.29Å; P900-S902 PolarHBondContact O-N 3.39Å
903	P	70.1	Confident	83.3	Confident	88 Å²	88	63 Å²	63	57%	0.571	35%	0.351	S	S	*	.			trans	-68.4	156.3	173.5	29.5	-34.9	0	0	0	110.3	R905	P903-R905 HydrophobicContact CG-CG 4.38Å; P903-R905 PolarHBondContact O-N 3.49Å
904	R	72.3	Confident	83.1	Confident	154 Å²	154	63.3 Å²	63.3	58%	0.581	36%	0.355	S	S	*	.	S	Bend	trans	-68.4	76.2	177.9	-156.9	-172.6	-163.7	-161.9	5.5	111.7	D910 T952	R904-D910 IonicContact CZ-OD1 2.79Å; R904-D910 IonicContact NH2-OD1 3.16Å; R904-D910 PolarHBondContact NH2-OD1 2.95Å; R904-T952 HydrophobicContact CB-CG2 3.86Å; R904-T952 WeakPolarHBondContact CD-O 3.44Å; R904-T952 HydrophobicContact CG-CG2 4.42Å; R904-T952 PolarHBondContact NE-O 3.37Å
905	R	56.8	Low	83	Confident	225 Å²	225	63.5 Å²	63.5	85%	0.849	36%	0.357	S	S	*	.			trans	-125.2	6.7	171.7	-61.9	-174.6	179.4	-172.1	-0.6	111.7	P903	P903-R905 HydrophobicContact CG-CG 4.38Å; P903-R905 PolarHBondContact O-N 3.49Å
906	S	63.2	Low	83.2	Confident	53 Å²	53	58.9 Å²	58.9	37%	0.371	33%	0.332	S	S	.	.			trans	-69.9	136	175	-175.9	0	0	0	0	110.1	I908	S906-I908 PolarHBondContact O-N 3.5Å; S906-I908 PolarHBondContact OG-N 3.21Å
907	A	69.6	Low	83.3	Confident	97 Å²	97	57.5 Å²	57.5	80%	0.802	33%	0.326	S	S	*	.	S	Bend	trans	-76.4	-8.6	170.8	0	0	0	0	0	113.2
908	I	86.4	Confident	83.2	Confident	37 Å²	37	57.4 Å²	57.4	19%	0.19	33%	0.326	C	S	.	.	S	Bend	trans	-80.3	126	-178.8	-52.4	175.9	0	0	0	109.6	D860 K896 S906 T912 I913	D860-I908 VanDerWaalsContact OD1-CA 3.31Å; D860-I908 WeakPolarHBondContact OD1-CA 3.41Å; D860-I908 WeakPolarHBondContact OD1-CG2 3.48Å; K896-I908 HydrophobicContact CB-CD1 4.39Å; K896-I908 HydrophobicContact CD-CD1 3.8Å; K896-I908 WeakPolarHBondContact O-CD1 3.35Å; S906-I908 PolarHBondContact O-N 3.5Å; S906-I908 PolarHBondContact OG-N 3.21Å; I908-T912 HydrophobicContact CG2-CG2 3.77Å; I908-I913 HydrophobicContact CG2-CG1 3.9Å
909	S	90.1	Very high	83.3	Confident	41 Å²	41	56.5 Å²	56.5	29%	0.287	32%	0.32	S	S	.	.			trans	-77.4	156.6	-176.5	72.6	0	0	0	0	113.4	D860 Q911 T912 I913	D860-S909 PolarHBondContact OD1-N 3.43Å; D860-S909 WeakPolarHBondContact OD2-CB 3.32Å; D860-S909 PolarHBondContact OD2-N 3.18Å; D860-S909 PolarHBondContact OD2-OG 2.96Å; S909-Q911 PolarHBondContact O-N 2.9Å; S909-Q911 VanDerWaalsContact O-N 3.14Å; S909-Q911 PolarHBondContact OG-N 3.03Å; S909-T912 PolarHBondContact O-N 2.93Å; S909-T912 VanDerWaalsContact O-N 3.1Å; S909-T912 PolarHBondContact OG-N 3.22Å; S909-T912 PolarHBondContact OG-OG1 3.4Å; S909-I913 WeakPolarHBondContact O-CG1 3.25Å; S909-I913 PolarHBondContact O-N 2.91Å
910	D	90.1	Very high	83.6	Confident	32 Å²	32	51.2 Å²	51.2	17%	0.171	30%	0.295	C	S	.	.	H	α-helix	trans	-52.9	-29.5	168.4	-82.5	71.8	0	0	0	112.8	R904 G914 S954 V957	R904-D910 IonicContact CZ-OD1 2.79Å; R904-D910 IonicContact NH2-OD1 3.16Å; R904-D910 PolarHBondContact NH2-OD1 2.95Å; D910-G914 PolarHBondContact O-N 3.3Å; D910-S954 WeakPolarHBondContact OD2-CB 3.42Å; D910-S954 PolarHBondContact OD2-N 3.2Å; D910-S954 PolarHBondContact OD2-OG 2.91Å; D910-V957 HydrophobicContact CB-CG2 3.89Å; D910-V957 VanDerWaalsContact O-CG2 3.27Å; D910-V957 WeakPolarHBondContact O-CG2 3.15Å; D910-V957 WeakPolarHBondContact OD2-CG2 3.27Å
911	Q	88.1	Confident	84	Confident	139 Å²	139	48.4 Å²	48.4	65%	0.65	28%	0.276	S	S	*	.	H	α-helix	trans	-70.9	-45	177	-164.6	-179.4	-75.5	0	0	111.4	C864 S909 G914 A915	C864-Q911 PolarHBondContact SG-NE2 3.31Å; C864-Q911 VanDerWaalsContact SG-NE2 3.36Å; S909-Q911 PolarHBondContact O-N 2.9Å; S909-Q911 VanDerWaalsContact O-N 3.14Å; S909-Q911 PolarHBondContact OG-N 3.03Å; Q911-G914 PolarHBondContact O-N 2.63Å; Q911-A915 PolarHBondContact O-N 3.26Å
912	T	92.6	Very high	84.9	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-68.1	-43.1	177	-57.7	0	0	0	0	111.9	D860 V863 C864 I908 S909 G914 A915 V916	D860-T912 PolarHBondContact O-OG1 2.96Å; D860-T912 VanDerWaalsContact O-OG1 3.13Å; D860-T912 WeakPolarHBondContact OD1-CB 3.36Å; D860-T912 WeakPolarHBondContact OD1-CG2 3.42Å; D860-T912 PolarHBondContact OD1-OG1 3.44Å; D860-T912 PolarHBondContact OD2-OG1 2.99Å; V863-T912 HydrophobicContact CB-CG2 4.11Å; V863-T912 HydrophobicContact CG1-CG2 3.72Å; C864-T912 WeakPolarHBondContact CB-OG1 3.26Å; I908-T912 HydrophobicContact CG2-CG2 3.77Å; S909-T912 PolarHBondContact O-N 2.93Å; S909-T912 VanDerWaalsContact O-N 3.1Å; S909-T912 PolarHBondContact OG-N 3.22Å; S909-T912 PolarHBondContact OG-OG1 3.4Å; T912-G914 VanDerWaalsContact C-N 3.26Å; T912-G914 PolarHBondContact O-N 3.19Å; T912-A915 WeakPolarHBondContact O-CB 3.46Å; T912-A915 PolarHBondContact O-N 3.22Å; T912-A915 VanDerWaalsContact O-N 3.13Å; T912-V916 WeakPolarHBondContact O-CG2 3.33Å; T912-V916 PolarHBondContact O-N 2.66Å
913	I	93.3	Very high	85.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-56.9	-44.7	171.2	-64.2	168.5	0	0	0	109.7	L897 I908 S909 A915 V916 L917 L946 Y953 V957	L897-I913 HydrophobicContact CD2-CG2 4.01Å; I908-I913 HydrophobicContact CG2-CG1 3.9Å; S909-I913 WeakPolarHBondContact O-CG1 3.25Å; S909-I913 PolarHBondContact O-N 2.91Å; I913-A915 PolarHBondContact O-N 3.13Å; I913-V916 PolarHBondContact O-N 3.36Å; I913-L917 HydrophobicContact CG2-CD1 3.92Å; I913-L917 HydrophobicContact CG2-CG 4.36Å; I913-L917 WeakPolarHBondContact O-CB 3.45Å; I913-L917 VanDerWaalsContact O-CG 3.22Å; I913-L917 WeakPolarHBondContact O-CG 3.25Å; I913-L917 PolarHBondContact O-N 3.05Å; I913-L946 HydrophobicContact CG2-CD2 3.75Å; I913-Y953 HydrophobicContact CD1-CD1 3.89Å; I913-Y953 HydrophobicContact CD1-CE1 3.64Å; I913-V957 HydrophobicContact CB-CG2 4.36Å; I913-V957 HydrophobicContact CG2-CG1 3.6Å; I913-V957 HydrophobicContact CG2-CG2 4.21Å
914	G	91.4	Very high	86.8	Confident	7 Å²	7	38.6 Å²	38.6	7%	0.072	20%	0.196	C	C	.	.	H	α-helix	trans	-60.9	-38.3	175.4	0	0	0	0	0	114.3	D910 Q911 T912 G918	D910-G914 PolarHBondContact O-N 3.3Å; Q911-G914 PolarHBondContact O-N 2.63Å; T912-G914 VanDerWaalsContact C-N 3.26Å; T912-G914 PolarHBondContact O-N 3.19Å; G914-G918 PolarHBondContact O-N 2.81Å; G914-G918 VanDerWaalsContact O-N 3.08Å
915	A	92.3	Very high	87.6	Confident	8 Å²	8	36.5 Å²	36.5	7%	0.066	19%	0.188	C	C	.	.	H	α-helix	trans	-67.8	-45.6	175.7	0	0	0	0	0	112.1	A867 T868 Q911 T912 I913 G918 I919	A867-A915 HydrophobicContact CB-CB 3.98Å; T868-A915 WeakPolarHBondContact OG1-CB 3.29Å; Q911-A915 PolarHBondContact O-N 3.26Å; T912-A915 WeakPolarHBondContact O-CB 3.46Å; T912-A915 PolarHBondContact O-N 3.22Å; T912-A915 VanDerWaalsContact O-N 3.13Å; I913-A915 PolarHBondContact O-N 3.13Å; A915-G918 WeakPolarHBondContact O-CA 3.45Å; A915-G918 PolarHBondContact O-N 3.4Å; A915-G918 VanDerWaalsContact O-N 3.07Å; A915-I919 PolarHBondContact O-N 2.84Å; A915-I919 VanDerWaalsContact O-N 3.11Å
916	V	95.9	Very high	89	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.1	-45.8	176.3	169.7	0	0	0	0	111.3	A867 F893 K896 L897 T912 I913 G918 I919 L920	A867-V916 HydrophobicContact CB-CG2 4.19Å; F893-V916 HydrophobicContact CB-CG1 4.18Å; F893-V916 WeakPolarHBondContact O-CG1 3.41Å; K896-V916 HydrophobicContact CB-CG2 4.12Å; L897-V916 HydrophobicContact CD2-CB 4.33Å; L897-V916 HydrophobicContact CD2-CG1 3.72Å; L897-V916 HydrophobicContact CG-CG1 4.05Å; T912-V916 WeakPolarHBondContact O-CG2 3.33Å; T912-V916 PolarHBondContact O-N 2.66Å; I913-V916 PolarHBondContact O-N 3.36Å; V916-G918 PolarHBondContact O-N 3.38Å; V916-I919 WeakPolarHBondContact O-CG2 3.43Å; V916-I919 PolarHBondContact O-N 3.45Å; V916-L920 HydrophobicContact CG1-CD1 4.06Å; V916-L920 WeakPolarHBondContact O-CG 3.35Å; V916-L920 PolarHBondContact O-N 2.91Å
917	L	94.6	Very high	90.2	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.9	-34.7	172.6	-69.9	171.1	0	0	0	112.1	L897 I913 L920 F921 L943 L946 V957 A961 V964	L897-L917 HydrophobicContact CD1-CD2 4.1Å; L897-L917 HydrophobicContact CD2-CD2 4.07Å; L897-L917 HydrophobicContact CD2-CG 4.14Å; I913-L917 HydrophobicContact CG2-CD1 3.92Å; I913-L917 HydrophobicContact CG2-CG 4.36Å; I913-L917 WeakPolarHBondContact O-CB 3.45Å; I913-L917 VanDerWaalsContact O-CG 3.22Å; I913-L917 WeakPolarHBondContact O-CG 3.25Å; I913-L917 PolarHBondContact O-N 3.05Å; L917-L920 PolarHBondContact O-N 3.35Å; L917-F921 WeakPolarHBondContact O-CB 3.12Å; L917-F921 PolarHBondContact O-N 3.17Å; L917-L943 HydrophobicContact CD2-CD2 3.35Å; L917-L946 HydrophobicContact CD1-CD2 4.02Å; L917-L946 HydrophobicContact CD2-CD2 4.33Å; L917-V957 HydrophobicContact CD1-CG1 4.26Å; L917-A961 HydrophobicContact CD1-CB 4.2Å; L917-A961 HydrophobicContact CD2-CB 4.26Å; L917-V964 HydrophobicContact CB-CG2 4.5Å; L917-V964 HydrophobicContact CD2-CG2 4.28Å
918	G	92	Very high	91.2	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-66.8	-38.2	177.1	0	0	0	0	0	114.5	G914 A915 V916 E922	G914-G918 PolarHBondContact O-N 2.81Å; G914-G918 VanDerWaalsContact O-N 3.08Å; A915-G918 WeakPolarHBondContact O-CA 3.45Å; A915-G918 PolarHBondContact O-N 3.4Å; A915-G918 VanDerWaalsContact O-N 3.07Å; V916-G918 PolarHBondContact O-N 3.38Å; G918-E922 WeakPolarHBondContact O-CB 3.21Å; G918-E922 PolarHBondContact O-N 3.04Å
919	I	92.9	Very high	91.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-74.2	-38.7	171.3	175.7	153.7	0	0	0	111.9	L870 R871 F893 A915 V916 F921 E922 I923	L870-I919 HydrophobicContact CB-CD1 3.42Å; L870-I919 VanDerWaalsContact CB-CD1 3.42Å; R871-I919 HydrophobicContact CB-CB 4.09Å; F893-I919 HydrophobicContact CD1-CG2 4.15Å; F893-I919 HydrophobicContact CD2-CG1 4.5Å; F893-I919 HydrophobicContact CE1-CD1 3.96Å; F893-I919 HydrophobicContact CE1-CG2 4.18Å; F893-I919 HydrophobicContact CE2-CD1 3.75Å; F893-I919 HydrophobicContact CE2-CG1 3.95Å; F893-I919 HydrophobicContact CG-CG2 4.35Å; F893-I919 HydrophobicContact CZ-CD1 3.34Å; F893-I919 HydrophobicContact CZ-CG1 4Å; F893-I919 HydrophobicContact CZ-CG2 4.42Å; A915-I919 PolarHBondContact O-N 2.84Å; A915-I919 VanDerWaalsContact O-N 3.11Å; V916-I919 WeakPolarHBondContact O-CG2 3.43Å; V916-I919 PolarHBondContact O-N 3.45Å; I919-F921 VanDerWaalsContact C-N 3.32Å; I919-F921 PolarHBondContact O-N 3.06Å; I919-E922 WeakPolarHBondContact O-CB 3.48Å; I919-E922 PolarHBondContact O-N 3.3Å; I919-E922 VanDerWaalsContact O-N 3.15Å; I919-I923 HydrophobicContact CD1-CD1 4.31Å; I919-I923 HydrophobicContact CG1-CD1 3.67Å; I919-I923 HydrophobicContact CG1-CG1 4.22Å; I919-I923 WeakPolarHBondContact O-CG1 3.48Å; I919-I923 PolarHBondContact O-N 3.18Å
920	L	94.6	Very high	91.4	Very high	1 Å²	1	24 Å²	24	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-58.4	-45.1	174.6	-72.2	169.6	0	0	0	111.1	L890 F893 L894 L897 V916 L917 E922 I923 V924 V934	L890-L920 HydrophobicContact CD2-CD2 4.14Å; F893-L920 HydrophobicContact CB-CD2 4.03Å; F893-L920 HydrophobicContact CB-CG 4.28Å; F893-L920 HydrophobicContact CD2-CD2 4.33Å; L894-L920 HydrophobicContact CD2-CD1 4.02Å; L894-L920 HydrophobicContact CD2-CD2 4.42Å; L897-L920 HydrophobicContact CD1-CD1 3.77Å; L897-L920 HydrophobicContact CG-CD1 4.43Å; V916-L920 HydrophobicContact CG1-CD1 4.06Å; V916-L920 WeakPolarHBondContact O-CG 3.35Å; V916-L920 PolarHBondContact O-N 2.91Å; L917-L920 PolarHBondContact O-N 3.35Å; L920-E922 PolarHBondContact O-N 2.86Å; L920-I923 PolarHBondContact O-N 2.99Å; L920-V924 WeakPolarHBondContact O-CG2 3.43Å; L920-V924 PolarHBondContact O-N 3.39Å; L920-V934 HydrophobicContact CD2-CG2 4.4Å
921	F	93.4	Very high	91.6	Very high	8 Å²	8	22.5 Å²	22.5	4%	0.035	12%	0.122	C	C	.	.	H	α-helix	trans	-55.8	-48.8	172	-179.4	-91.7	0	0	0	112.6	L917 I919 I923 V924 R925 Q963 V964 V967 S999 L1001 A1002	L917-F921 WeakPolarHBondContact O-CB 3.12Å; L917-F921 PolarHBondContact O-N 3.17Å; I919-F921 VanDerWaalsContact C-N 3.32Å; I919-F921 PolarHBondContact O-N 3.06Å; F921-I923 PolarHBondContact O-N 3.17Å; F921-V924 PolarHBondContact O-N 3.45Å; F921-R925 VanDerWaalsContact O-CB 3.28Å; F921-R925 WeakPolarHBondContact O-CB 3.37Å; F921-R925 VanDerWaalsContact O-CG 3.26Å; F921-R925 WeakPolarHBondContact O-CG 3.39Å; F921-R925 PolarHBondContact O-N 2.92Å; F921-Q963 HydrophobicContact CD2-CB 4.38Å; F921-Q963 HydrophobicContact CE2-CB 4.27Å; F921-V964 HydrophobicContact CB-CG2 4Å; F921-V967 HydrophobicContact CD2-CG2 4.16Å; F921-V967 HydrophobicContact CE2-CB 4.48Å; F921-V967 HydrophobicContact CE2-CG2 3.54Å; F921-V967 HydrophobicContact CZ-CG2 4.23Å; F921-S999 WeakPolarHBondContact CE2-OG 3.29Å; F921-S999 WeakPolarHBondContact CZ-OG 3.46Å; F921-L1001 HydrophobicContact CB-CB 4.26Å; F921-L1001 HydrophobicContact CB-CD1 3.73Å; F921-L1001 HydrophobicContact CD1-CB 3.64Å; F921-L1001 HydrophobicContact CD2-CB 3.94Å; F921-L1001 HydrophobicContact CD2-CD1 3.87Å; F921-L1001 HydrophobicContact CE1-CB 3.86Å; F921-L1001 HydrophobicContact CE2-CB 4.14Å; F921-L1001 HydrophobicContact CG-CB 3.69Å; F921-L1001 HydrophobicContact CG-CD1 3.84Å; F921-L1001 HydrophobicContact CG-CG 4.42Å; F921-L1001 HydrophobicContact CZ-CB 4.12Å; F921-A1002 HydrophobicContact CE1-CB 4Å; F921-A1002 HydrophobicContact CZ-CB 4.17Å
922	E	90.4	Very high	91.8	Very high	8 Å²	8	20.5 Å²	20.5	4%	0.037	11%	0.111	C	C	.	.	H	α-helix	trans	-60.7	-33.3	179.3	-176.7	58.2	-151	0	0	112.7	R871 A874 R880 G918 I919 L920 R925	R871-E922 HydrophobicContact CG-CB 4.47Å; A874-E922 HydrophobicContact CB-CG 3.67Å; R880-E922 WeakPolarHBondContact CD-O 3.33Å; R880-E922 IonicContact CZ-OE1 3.78Å; R880-E922 PolarHBondContact NE-O 3.17Å; R880-E922 VanDerWaalsContact NE-O 3.11Å; R880-E922 IonicContact NE-OE1 3.63Å; R880-E922 PolarHBondContact NE-OE1 3.43Å; R880-E922 IonicContact NH2-OE1 2.73Å; R880-E922 PolarHBondContact NH2-OE1 2.77Å; G918-E922 WeakPolarHBondContact O-CB 3.21Å; G918-E922 PolarHBondContact O-N 3.04Å; I919-E922 WeakPolarHBondContact O-CB 3.48Å; I919-E922 PolarHBondContact O-N 3.3Å; I919-E922 VanDerWaalsContact O-N 3.15Å; L920-E922 PolarHBondContact O-N 2.86Å; E922-R925 IonicContact OE1-CZ 3.49Å; E922-R925 IonicContact OE1-NE 2.88Å; E922-R925 IonicContact OE1-NH2 2.84Å; E922-R925 PolarHBondContact OE1-NH2 3.47Å; E922-R925 IonicContact OE2-CZ 2.74Å; E922-R925 IonicContact OE2-NE 2.84Å; E922-R925 PolarHBondContact OE2-NE 2.95Å; E922-R925 IonicContact OE2-NH2 3.81Å; E922-R925 PolarHBondContact OE2-NH2 2.98Å
923	I	91.4	Very high	91.8	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-75.2	-59.8	175	-66.8	163.1	0	0	0	110.8	R880 V884 L890 F893 I919 L920 F921 R925 S926 Y930	R880-I923 HydrophobicContact CG-CG1 4.24Å; V884-I923 HydrophobicContact CG1-CD1 3.66Å; V884-I923 HydrophobicContact CG1-CG1 4.02Å; V884-I923 HydrophobicContact CG1-CG2 3.95Å; L890-I923 HydrophobicContact CD2-CD1 3.95Å; L890-I923 HydrophobicContact CD2-CG2 4.18Å; F893-I923 HydrophobicContact CD2-CD1 4.17Å; F893-I923 HydrophobicContact CE2-CD1 3.75Å; I919-I923 HydrophobicContact CD1-CD1 4.31Å; I919-I923 HydrophobicContact CG1-CD1 3.67Å; I919-I923 HydrophobicContact CG1-CG1 4.22Å; I919-I923 WeakPolarHBondContact O-CG1 3.48Å; I919-I923 PolarHBondContact O-N 3.18Å; L920-I923 PolarHBondContact O-N 2.99Å; F921-I923 PolarHBondContact O-N 3.17Å; I923-R925 VanDerWaalsContact C-N 3.29Å; I923-R925 PolarHBondContact O-N 3.35Å; I923-S926 PolarHBondContact O-N 3.11Å; I923-S926 VanDerWaalsContact O-N 3.15Å; I923-S926 PolarHBondContact O-OG 3.25Å; I923-Y930 HydrophobicContact CG2-CD2 3.83Å; I923-Y930 HydrophobicContact CG2-CG 4Å
924	V	92.1	Very high	91.8	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.8	-31.5	-171.2	-58.9	0	0	0	0	112.4	L920 F921 S926 S927 T931 V934 V964 V967 M968 H971	L920-V924 WeakPolarHBondContact O-CG2 3.43Å; L920-V924 PolarHBondContact O-N 3.39Å; F921-V924 PolarHBondContact O-N 3.45Å; V924-S926 PolarHBondContact O-N 2.84Å; V924-S927 PolarHBondContact O-N 3.13Å; V924-T931 WeakPolarHBondContact CB-OG1 3.32Å; V924-T931 PolarHBondContact O-OG1 3.41Å; V924-V934 HydrophobicContact CG1-CG2 4.05Å; V924-V964 HydrophobicContact CG2-CG1 4.05Å; V924-V967 HydrophobicContact CG2-CB 4.45Å; V924-V967 HydrophobicContact CG2-CG1 3.93Å; V924-M968 HydrophobicContact CB-CG 4.36Å; V924-M968 HydrophobicContact CG1-CG 4.4Å; V924-M968 HydrophobicContact CG2-CG 4.19Å; V924-H971 PolarHBondContact O-NE2 3.01Å
925	R	88.6	Confident	91.9	Very high	111 Å²	111	22.9 Å²	22.9	42%	0.419	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-9.3	177.8	78.2	-174.2	-173.7	79.4	-2.9	115.2	F921 E922 I923 V967	F921-R925 VanDerWaalsContact O-CB 3.28Å; F921-R925 WeakPolarHBondContact O-CB 3.37Å; F921-R925 VanDerWaalsContact O-CG 3.26Å; F921-R925 WeakPolarHBondContact O-CG 3.39Å; F921-R925 PolarHBondContact O-N 2.92Å; E922-R925 IonicContact OE1-CZ 3.49Å; E922-R925 IonicContact OE1-NE 2.88Å; E922-R925 IonicContact OE1-NH2 2.84Å; E922-R925 PolarHBondContact OE1-NH2 3.47Å; E922-R925 IonicContact OE2-CZ 2.74Å; E922-R925 IonicContact OE2-NE 2.84Å; E922-R925 PolarHBondContact OE2-NE 2.95Å; E922-R925 IonicContact OE2-NH2 3.81Å; E922-R925 PolarHBondContact OE2-NH2 2.98Å; I923-R925 VanDerWaalsContact C-N 3.29Å; I923-R925 PolarHBondContact O-N 3.35Å; R925-V967 HydrophobicContact CB-CG1 3.63Å
926	S	85.1	Confident	91.8	Very high	50 Å²	50	27.4 Å²	27.4	35%	0.35	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-16.3	-172.5	73.8	0	0	0	0	115	R880 I923 V924	R880-S926 WeakPolarHBondContact CD-OG 3.48Å; I923-S926 PolarHBondContact O-N 3.11Å; I923-S926 VanDerWaalsContact O-N 3.15Å; I923-S926 PolarHBondContact O-OG 3.25Å; V924-S926 PolarHBondContact O-N 2.84Å
927	S	88.6	Confident	91.7	Very high	28 Å²	28	29.4 Å²	29.4	20%	0.196	15%	0.152	C	C	.	.			trans	-160.5	123.6	-169.7	177.1	0	0	0	0	112.6	V924 A929 Y930 T931	V924-S927 PolarHBondContact O-N 3.13Å; S927-A929 PolarHBondContact O-N 3.06Å; S927-A929 PolarHBondContact OG-N 2.92Å; S927-Y930 PolarHBondContact O-N 3.34Å; S927-T931 PolarHBondContact O-N 3.36Å; S927-T931 VanDerWaalsContact O-N 3.15Å; S927-T931 PolarHBondContact O-OG1 3.38Å
928	A	91.2	Very high	91.5	Very high	14 Å²	14	36.9 Å²	36.9	12%	0.116	18%	0.184	C	C	.	.	H	α-helix	trans	-62.3	-28.6	170.1	0	0	0	0	0	112.2	T931 K932 H971 E973 L974	A928-T931 PolarHBondContact O-N 3.02Å; A928-K932 WeakPolarHBondContact O-CB 3.42Å; A928-K932 PolarHBondContact O-N 2.82Å; A928-H971 HydrophobicContact CB-CB 3.94Å; A928-E973 HydrophobicContact CB-CG 3.77Å; A928-E973 WeakPolarHBondContact CB-OE1 3.3Å; A928-L974 HydrophobicContact CB-CD1 4.24Å; A928-L974 HydrophobicContact CB-CD2 4.42Å; A928-L974 HydrophobicContact CB-CG 4.26Å; A928-L974 WeakPolarHBondContact O-CD1 3.26Å
929	A	90.7	Very high	91.5	Very high	54 Å²	54	36.9 Å²	36.9	45%	0.446	18%	0.184	S	C	.	.	H	α-helix	trans	-64.8	-45.4	177.6	0	0	0	0	0	111.7	S927 K932 D933	S927-A929 PolarHBondContact O-N 3.06Å; S927-A929 PolarHBondContact OG-N 2.92Å; A929-K932 WeakPolarHBondContact O-CB 3.44Å; A929-K932 PolarHBondContact O-N 2.9Å; A929-D933 PolarHBondContact O-N 3.26Å
930	Y	90.6	Very high	91.5	Very high	45 Å²	45	37 Å²	37	18%	0.176	19%	0.185	C	C	.	.	H	α-helix	trans	-73.2	-30.9	178.1	-49.2	-35.3	0	0	0	111.9	V884 I923 S927 K932 D933 V934	V884-Y930 HydrophobicContact CB-CD1 4.47Å; V884-Y930 HydrophobicContact CG2-CD1 3.63Å; V884-Y930 HydrophobicContact CG2-CD2 3.95Å; V884-Y930 HydrophobicContact CG2-CE1 3.32Å; V884-Y930 HydrophobicContact CG2-CE2 3.67Å; V884-Y930 HydrophobicContact CG2-CG 3.95Å; I923-Y930 HydrophobicContact CG2-CD2 3.83Å; I923-Y930 HydrophobicContact CG2-CG 4Å; S927-Y930 PolarHBondContact O-N 3.34Å; Y930-K932 VanDerWaalsContact C-N 3.32Å; Y930-D933 PolarHBondContact O-N 3.33Å; Y930-V934 WeakPolarHBondContact O-CG2 3.28Å; Y930-V934 PolarHBondContact O-N 2.6Å
931	T	93.2	Very high	91.4	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.8	-40.5	170.2	-57.9	0	0	0	0	111.6	V924 S927 A928 H935 M968 H971 L974 F978	V924-T931 WeakPolarHBondContact CB-OG1 3.32Å; V924-T931 PolarHBondContact O-OG1 3.41Å; S927-T931 PolarHBondContact O-N 3.36Å; S927-T931 VanDerWaalsContact O-N 3.15Å; S927-T931 PolarHBondContact O-OG1 3.38Å; A928-T931 PolarHBondContact O-N 3.02Å; T931-H935 PolarHBondContact O-N 3.08Å; T931-H935 VanDerWaalsContact O-N 3.15Å; T931-M968 HydrophobicContact CG2-CB 3.69Å; T931-M968 HydrophobicContact CG2-CE 3.74Å; T931-M968 HydrophobicContact CG2-CG 3.84Å; T931-M968 WeakPolarHBondContact O-CE 3.27Å; T931-H971 PolarHBondContact OG1-CD2 3.48Å; T931-H971 VanDerWaalsContact OG1-CD2 3.29Å; T931-H971 PolarHBondContact OG1-NE2 3.4Å; T931-L974 HydrophobicContact CG2-CD1 3.37Å; T931-F978 HydrophobicContact CG2-CZ 4.14Å
932	K	92.8	Very high	91.4	Very high	97 Å²	97	40.4 Å²	40.4	42%	0.422	20%	0.202	S	C	.	.	H	α-helix	trans	-65.4	-41	172.6	-178	174.9	176.8	-73.5	0	111.8	A928 A929 Y930 H935 E936 L974	A928-K932 WeakPolarHBondContact O-CB 3.42Å; A928-K932 PolarHBondContact O-N 2.82Å; A929-K932 WeakPolarHBondContact O-CB 3.44Å; A929-K932 PolarHBondContact O-N 2.9Å; Y930-K932 VanDerWaalsContact C-N 3.32Å; K932-H935 WeakPolarHBondContact O-CB 3.33Å; K932-H935 PolarHBondContact O-N 2.94Å; K932-H935 VanDerWaalsContact O-N 3.16Å; K932-E936 IonicContact NZ-OE1 3.46Å; K932-E936 PolarHBondContact NZ-OE1 3.33Å; K932-E936 WeakPolarHBondContact O-CG 3.48Å; K932-E936 PolarHBondContact O-N 3.12Å; K932-L974 HydrophobicContact CB-CD1 4.45Å; K932-L974 HydrophobicContact CB-CD2 3.98Å; K932-L974 HydrophobicContact CD-CD2 4.38Å
933	D	91.9	Very high	91.6	Very high	22 Å²	22	40 Å²	40	12%	0.118	20%	0.201	C	C	.	.	H	α-helix	trans	-63.3	-41.6	176.3	-69.3	-16.8	0	0	0	112.5	K887 L890 A929 Y930 H935 E936 L937	K887-D933 HydrophobicContact CD-CB 4.33Å; K887-D933 VanDerWaalsContact CE-CG 3.48Å; K887-D933 WeakPolarHBondContact CE-OD1 3.47Å; K887-D933 IonicContact NZ-OD1 3.56Å; K887-D933 PolarHBondContact NZ-OD1 3.16Å; K887-D933 IonicContact NZ-OD2 3.34Å; L890-D933 HydrophobicContact CD1-CB 3.77Å; A929-D933 PolarHBondContact O-N 3.26Å; Y930-D933 PolarHBondContact O-N 3.33Å; D933-H935 VanDerWaalsContact C-N 3.28Å; D933-H935 PolarHBondContact O-N 3.5Å; D933-E936 PolarHBondContact O-N 3.33Å; D933-L937 WeakPolarHBondContact O-CB 3.46Å; D933-L937 VanDerWaalsContact O-CG 3.32Å; D933-L937 WeakPolarHBondContact O-CG 3.48Å; D933-L937 PolarHBondContact O-N 2.9Å
934	V	93.1	Very high	91.6	Very high	1 Å²	1	43 Å²	43	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-61.3	-36.7	172.9	169.4	0	0	0	0	111.4	L890 L894 L920 V924 Y930 G939 L943 M968	L890-V934 HydrophobicContact CD1-CG2 4.31Å; L890-V934 HydrophobicContact CD2-CG2 3.88Å; L894-V934 HydrophobicContact CD1-CG1 4.41Å; L894-V934 HydrophobicContact CD2-CG1 4.49Å; L920-V934 HydrophobicContact CD2-CG2 4.4Å; V924-V934 HydrophobicContact CG1-CG2 4.05Å; Y930-V934 WeakPolarHBondContact O-CG2 3.28Å; Y930-V934 PolarHBondContact O-N 2.6Å; V934-G939 WeakPolarHBondContact O-CA 3.31Å; V934-G939 PolarHBondContact O-N 3Å; V934-L943 HydrophobicContact CG1-CD1 4.41Å; V934-M968 HydrophobicContact CB-CE 4.1Å; V934-M968 HydrophobicContact CG1-CE 3.75Å; V934-M968 HydrophobicContact CG1-SD 4.2Å
935	H	93.6	Very high	91.5	Very high	34 Å²	34	44.3 Å²	44.3	16%	0.157	22%	0.223	C	C	.	.	H	α-helix	trans	-70.7	-43.5	175.4	-174	59	0	0	0	112.7	T931 K932 D933 L937 K938 T940 F978 S981	T931-H935 PolarHBondContact O-N 3.08Å; T931-H935 VanDerWaalsContact O-N 3.15Å; K932-H935 WeakPolarHBondContact O-CB 3.33Å; K932-H935 PolarHBondContact O-N 2.94Å; K932-H935 VanDerWaalsContact O-N 3.16Å; D933-H935 VanDerWaalsContact C-N 3.28Å; D933-H935 PolarHBondContact O-N 3.5Å; H935-L937 PolarHBondContact O-N 3.3Å; H935-K938 PolarHBondContact O-N 3.11Å; H935-T940 PolarHBondContact ND1-OG1 3.26Å; H935-F978 HydrophobicContact CB-CE1 4.04Å; H935-F978 AromaticContact CD2-CD1 3.96Å; H935-F978 AromaticContact CE1-CD1 4Å; H935-F978 AromaticContact CG-CD1 3.93Å; H935-F978 AromaticContact CG-CE1 3.83Å; H935-F978 AromaticContact ND1-CD1 3.94Å; H935-F978 AromaticContact NE2-CD1 3.99Å; H935-S981 WeakPolarHBondContact NE2-CB 3.38Å; H935-S981 PolarHBondContact NE2-OG 3.35Å
936	E	92.2	Very high	91.6	Very high	102 Å²	102	39.1 Å²	39.1	48%	0.477	20%	0.203	S	C	.	.	H	α-helix	trans	-60	-32.1	174.2	-74.7	177.6	-177.9	0	0	112.6	K887 K932 D933 K938	K887-E936 IonicContact NZ-OE2 3.69Å; K887-E936 PolarHBondContact NZ-OE2 2.85Å; K932-E936 IonicContact NZ-OE1 3.46Å; K932-E936 PolarHBondContact NZ-OE1 3.33Å; K932-E936 WeakPolarHBondContact O-CG 3.48Å; K932-E936 PolarHBondContact O-N 3.12Å; D933-E936 PolarHBondContact O-N 3.33Å; E936-K938 PolarHBondContact O-N 3.2Å
937	L	92.1	Very high	91.8	Very high	43 Å²	43	37.5 Å²	37.5	23%	0.225	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	14.5	174.8	-67.9	171.1	0	0	0	113.8	L890 R891 L894 D933 H935 G939	L890-L937 HydrophobicContact CB-CD1 3.79Å; R891-L937 HydrophobicContact CB-CD1 4.41Å; L894-L937 HydrophobicContact CD1-CB 3.63Å; L894-L937 HydrophobicContact CD1-CD1 4.23Å; D933-L937 WeakPolarHBondContact O-CB 3.46Å; D933-L937 VanDerWaalsContact O-CG 3.32Å; D933-L937 WeakPolarHBondContact O-CG 3.48Å; D933-L937 PolarHBondContact O-N 2.9Å; H935-L937 PolarHBondContact O-N 3.3Å; L937-G939 PolarHBondContact O-N 3.24Å; L937-G939 VanDerWaalsContact O-N 3.1Å
938	K	91.4	Very high	91.8	Very high	157 Å²	157	43 Å²	43	68%	0.683	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.8	12.5	-175.5	-56.4	-177.7	177.9	-178.9	0	115.3	H935 E936 T940 D941	H935-K938 PolarHBondContact O-N 3.11Å; E936-K938 PolarHBondContact O-N 3.2Å; K938-T940 PolarHBondContact O-N 3.02Å; K938-T940 VanDerWaalsContact O-N 3.14Å; K938-D941 PolarHBondContact O-N 3.16Å
939	G	92.4	Very high	91.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.7	-28.7	-178.4	0	0	0	0	0	113.4	V934 L937 D941 K942 L943	V934-G939 WeakPolarHBondContact O-CA 3.31Å; V934-G939 PolarHBondContact O-N 3Å; L937-G939 PolarHBondContact O-N 3.24Å; L937-G939 VanDerWaalsContact O-N 3.1Å; G939-D941 VanDerWaalsContact C-N 3.29Å; G939-D941 PolarHBondContact O-N 3.44Å; G939-K942 PolarHBondContact O-N 3.49Å; G939-L943 WeakPolarHBondContact O-CB 3.46Å; G939-L943 WeakPolarHBondContact O-CD1 3.48Å; G939-L943 WeakPolarHBondContact O-CG 3.21Å; G939-L943 PolarHBondContact O-N 3.39Å
940	T	93.3	Very high	91	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.018	22%	0.216	C	C	.	.	H	α-helix	trans	-60.7	-34.9	174.6	-43.4	0	0	0	0	112.8	H935 K938 R944 L965 L983 F988	H935-T940 PolarHBondContact ND1-OG1 3.26Å; K938-T940 PolarHBondContact O-N 3.02Å; K938-T940 VanDerWaalsContact O-N 3.14Å; T940-R944 WeakPolarHBondContact O-CB 3.34Å; T940-R944 PolarHBondContact O-N 3.27Å; T940-L965 HydrophobicContact CG2-CD2 3.99Å; T940-L983 HydrophobicContact CG2-CD1 3.62Å; T940-F988 HydrophobicContact CG2-CE1 3.8Å; T940-F988 HydrophobicContact CG2-CZ 3.92Å
941	D	91.6	Very high	90.5	Very high	62 Å²	62	49.4 Å²	49.4	33%	0.332	24%	0.235	S	C	.	.	H	α-helix	trans	-74.4	-41.2	178.2	-72.3	-54.8	0	0	0	112	K938 G939 R944 A945	K938-D941 PolarHBondContact O-N 3.16Å; G939-D941 VanDerWaalsContact C-N 3.29Å; G939-D941 PolarHBondContact O-N 3.44Å; D941-R944 PolarHBondContact O-N 3.4Å; D941-R944 IonicContact OD1-CZ 3.16Å; D941-R944 IonicContact OD1-NE 2.66Å; D941-R944 IonicContact OD1-NH2 2.75Å; D941-R944 PolarHBondContact OD1-NH2 2.89Å; D941-A945 WeakPolarHBondContact O-CB 3.43Å; D941-A945 PolarHBondContact O-N 3.34Å
942	K	93.3	Very high	90	Very high	17 Å²	17	52.3 Å²	52.3	7%	0.074	25%	0.253	C	S	.	.	H	α-helix	trans	-57.1	-50.7	170.9	-67.1	-158.8	173.8	-161.4	0	111.4	L894 L897 E899 G939 R944 A945 L946	L894-K942 WeakPolarHBondContact O-CD 3.5Å; L894-K942 WeakPolarHBondContact O-CE 3.47Å; L894-K942 PolarHBondContact O-NZ 3.16Å; L897-K942 HydrophobicContact CB-CB 4.48Å; L897-K942 HydrophobicContact CB-CD 3.92Å; L897-K942 PolarHBondContact O-NZ 3.46Å; E899-K942 WeakPolarHBondContact OE1-CE 3.41Å; E899-K942 IonicContact OE1-NZ 2.84Å; E899-K942 PolarHBondContact OE1-NZ 3.11Å; E899-K942 VanDerWaalsContact OE2-CE 3.25Å; E899-K942 WeakPolarHBondContact OE2-CE 3.28Å; E899-K942 IonicContact OE2-NZ 3.18Å; G939-K942 PolarHBondContact O-N 3.49Å; K942-R944 PolarHBondContact O-N 3.37Å; K942-A945 PolarHBondContact O-N 3.46Å; K942-L946 VanDerWaalsContact O-CB 3.25Å; K942-L946 WeakPolarHBondContact O-CB 3.1Å; K942-L946 PolarHBondContact O-N 3.36Å
943	L	94.2	Very high	89.7	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.3	-42.1	179.2	-70.6	167.2	0	0	0	112.1	L897 L917 V934 G939 L946 S947 A961 V964 L965 M968	L897-L943 HydrophobicContact CD1-CD2 4.06Å; L897-L943 HydrophobicContact CD1-CG 4.5Å; L917-L943 HydrophobicContact CD2-CD2 3.35Å; V934-L943 HydrophobicContact CG1-CD1 4.41Å; G939-L943 WeakPolarHBondContact O-CB 3.46Å; G939-L943 WeakPolarHBondContact O-CD1 3.48Å; G939-L943 WeakPolarHBondContact O-CG 3.21Å; G939-L943 PolarHBondContact O-N 3.39Å; L943-L946 PolarHBondContact O-N 3.19Å; L943-S947 WeakPolarHBondContact O-CB 3.37Å; L943-S947 PolarHBondContact O-N 3.31Å; L943-S947 PolarHBondContact O-OG 3.33Å; L943-A961 HydrophobicContact CD2-CB 4.42Å; L943-V964 HydrophobicContact CD1-CB 4.36Å; L943-V964 HydrophobicContact CD1-CG1 3.6Å; L943-V964 HydrophobicContact CD2-CB 4.1Å; L943-V964 HydrophobicContact CD2-CG1 4.06Å; L943-V964 HydrophobicContact CD2-CG2 4.44Å; L943-V964 HydrophobicContact CG-CG1 4.5Å; L943-L965 HydrophobicContact CB-CD1 4.31Å; L943-L965 HydrophobicContact CB-CD2 3.78Å; L943-L965 HydrophobicContact CB-CG 3.93Å; L943-L965 HydrophobicContact CD1-CD2 4.4Å; L943-M968 HydrophobicContact CD1-SD 3.8Å
944	R	91.2	Very high	89.2	Confident	63 Å²	63	49.1 Å²	49.1	24%	0.238	24%	0.243	C	C	.	.	H	α-helix	trans	-66.7	-42.6	178.2	178	170.5	61	156.9	-3.7	112.5	T940 D941 K942 S947 R948 L965 D987	T940-R944 WeakPolarHBondContact O-CB 3.34Å; T940-R944 PolarHBondContact O-N 3.27Å; D941-R944 PolarHBondContact O-N 3.4Å; D941-R944 IonicContact OD1-CZ 3.16Å; D941-R944 IonicContact OD1-NE 2.66Å; D941-R944 IonicContact OD1-NH2 2.75Å; D941-R944 PolarHBondContact OD1-NH2 2.89Å; K942-R944 PolarHBondContact O-N 3.37Å; R944-S947 PolarHBondContact O-OG 3.41Å; R944-R948 WeakPolarHBondContact O-CG 3.32Å; R944-L965 HydrophobicContact CB-CD1 4.49Å; R944-D987 WeakPolarHBondContact CD-OD1 3.4Å; R944-D987 IonicContact CZ-OD1 3.52Å; R944-D987 IonicContact NE-OD1 3.75Å; R944-D987 IonicContact NH1-OD1 3.62Å; R944-D987 PolarHBondContact NH1-OD1 2.99Å; R944-D987 IonicContact NH1-OD2 2.71Å
945	A	90.8	Very high	88.6	Confident	27 Å²	27	53.6 Å²	53.6	22%	0.223	26%	0.264	C	S	.	.	H	α-helix	trans	-61.4	-51.8	173.2	0	0	0	0	0	110.5	P900 D941 K942 S947 R948 S949	P900-A945 HydrophobicContact CB-CB 3.78Å; P900-A945 HydrophobicContact CG-CB 4.04Å; D941-A945 WeakPolarHBondContact O-CB 3.43Å; D941-A945 PolarHBondContact O-N 3.34Å; K942-A945 PolarHBondContact O-N 3.46Å; A945-S947 PolarHBondContact O-N 2.92Å; A945-R948 CarbonylContact O-C 3.43Å; A945-R948 PolarHBondContact O-N 3.39Å; A945-S949 PolarHBondContact O-N 2.89Å; A945-S949 PolarHBondContact O-OG 2.85Å
946	L	90.3	Very high	88	Confident	3 Å²	3	58.4 Å²	58.4	2%	0.016	28%	0.281	C	S	.	.	H	α-helix	trans	-60.4	-40.7	-177.7	-171.7	58.7	0	0	0	112.9	L897 P898 I913 L917 K942 L943 R948 S949 Y953 V957 C958 A961	L897-L946 HydrophobicContact CD2-CD2 4.29Å; P898-L946 HydrophobicContact CG-CD1 3.93Å; I913-L946 HydrophobicContact CG2-CD2 3.75Å; L917-L946 HydrophobicContact CD1-CD2 4.02Å; L917-L946 HydrophobicContact CD2-CD2 4.33Å; K942-L946 VanDerWaalsContact O-CB 3.25Å; K942-L946 WeakPolarHBondContact O-CB 3.1Å; K942-L946 PolarHBondContact O-N 3.36Å; L943-L946 PolarHBondContact O-N 3.19Å; L946-R948 PolarHBondContact O-N 2.96Å; L946-R948 VanDerWaalsContact O-N 3.13Å; L946-S949 PolarHBondContact O-N 3.45Å; L946-S949 VanDerWaalsContact O-N 3.17Å; L946-Y953 HydrophobicContact CD1-CD1 4.36Å; L946-Y953 HydrophobicContact CD1-CD2 3.64Å; L946-Y953 HydrophobicContact CD1-CE2 4.02Å; L946-Y953 HydrophobicContact CD1-CG 3.84Å; L946-V957 HydrophobicContact CD1-CG1 3.63Å; L946-V957 HydrophobicContact CD2-CG1 3.98Å; L946-V957 HydrophobicContact CG-CG1 3.83Å; L946-C958 PolarHBondContact O-SG 2.71Å; L946-C958 VanDerWaalsContact O-SG 3.35Å; L946-A961 HydrophobicContact CB-CB 4.2Å; L946-A961 HydrophobicContact CD2-CB 4.22Å; L946-A961 HydrophobicContact CG-CB 4.1Å
947	S	90	Very high	87.8	Confident	15 Å²	15	53.6 Å²	53.6	11%	0.105	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-16.7	175.6	70	0	0	0	0	114.5	L943 R944 A945	L943-S947 WeakPolarHBondContact O-CB 3.37Å; L943-S947 PolarHBondContact O-N 3.31Å; L943-S947 PolarHBondContact O-OG 3.33Å; R944-S947 PolarHBondContact O-OG 3.41Å; A945-S947 PolarHBondContact O-N 2.92Å
948	R	87.2	Confident	87.5	Confident	144 Å²	144	51.8 Å²	51.8	54%	0.543	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	13.9	-180	-59.4	178.2	-174.4	164.5	3.5	112.5	R944 A945 L946 D987	R944-R948 WeakPolarHBondContact O-CG 3.32Å; A945-R948 CarbonylContact O-C 3.43Å; A945-R948 PolarHBondContact O-N 3.39Å; L946-R948 PolarHBondContact O-N 2.96Å; L946-R948 VanDerWaalsContact O-N 3.13Å; R948-D987 IonicContact CZ-OD1 3.68Å; R948-D987 IonicContact NH1-OD1 2.77Å; R948-D987 IonicContact NH2-OD1 2.8Å; R948-D987 PolarHBondContact NH2-OD1 3.42Å
949	S	85.9	Confident	87.2	Confident	31 Å²	31	47.3 Å²	47.3	22%	0.217	23%	0.23	C	C	.	.			trans	-104.1	31.7	-174.2	-63.8	0	0	0	0	113.8	A945 L946 T952 Y953	A945-S949 PolarHBondContact O-N 2.89Å; A945-S949 PolarHBondContact O-OG 2.85Å; L946-S949 PolarHBondContact O-N 3.45Å; L946-S949 VanDerWaalsContact O-N 3.17Å; S949-T952 CarbonylContact O-C 3.4Å; S949-T952 WeakPolarHBondContact O-CA 3.41Å; S949-T952 VanDerWaalsContact O-CB 3.22Å; S949-T952 WeakPolarHBondContact O-CB 3.21Å; S949-T952 PolarHBondContact O-N 2.85Å; S949-Y953 PolarHBondContact O-N 2.68Å
950	Y	80.6	Confident	87	Confident	127 Å²	127	48 Å²	48	50%	0.498	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	144.7	165.3	-177.6	-94.8	0	0	0	109.4	H955	Y950-H955 HydrophobicContact CD2-CB 4.34Å; Y950-H955 HydrophobicContact CE2-CB 4.28Å
951	P	79.6	Confident	86.9	Confident	90 Å²	90	47.9 Å²	47.9	58%	0.584	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	cis	-83.7	3.8	-4.4	34.1	-35.9	0	0	0	114.8	Y953	P951-Y953 PolarHBondContact O-N 3.25Å; P951-Y953 VanDerWaalsContact O-N 3.14Å
952	T	83.8	Confident	86.7	Confident	60 Å²	60	45 Å²	45	37%	0.368	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-31.6	-180	-46.8	0	0	0	0	113.6	R904 S949	R904-T952 HydrophobicContact CB-CG2 3.86Å; R904-T952 WeakPolarHBondContact CD-O 3.44Å; R904-T952 HydrophobicContact CG-CG2 4.42Å; R904-T952 PolarHBondContact NE-O 3.37Å; S949-T952 CarbonylContact O-C 3.4Å; S949-T952 WeakPolarHBondContact O-CA 3.41Å; S949-T952 VanDerWaalsContact O-CB 3.22Å; S949-T952 WeakPolarHBondContact O-CB 3.21Å; S949-T952 PolarHBondContact O-N 2.85Å
953	Y	84.6	Confident	86.5	Confident	8 Å²	8	45.5 Å²	45.5	3%	0.031	22%	0.219	C	C	.	.	S	Bend	trans	-127	153.8	167	-60.4	-85.7	0	0	0	110	P898 I913 L946 S949 P951 V957	P898-Y953 VanDerWaalsContact CB-OH 3.26Å; P898-Y953 WeakPolarHBondContact CB-OH 3.39Å; P898-Y953 HydrophobicContact CG-CE1 4.29Å; P898-Y953 HydrophobicContact CG-CE2 4.2Å; I913-Y953 HydrophobicContact CD1-CD1 3.89Å; I913-Y953 HydrophobicContact CD1-CE1 3.64Å; L946-Y953 HydrophobicContact CD1-CD1 4.36Å; L946-Y953 HydrophobicContact CD1-CD2 3.64Å; L946-Y953 HydrophobicContact CD1-CE2 4.02Å; L946-Y953 HydrophobicContact CD1-CG 3.84Å; S949-Y953 PolarHBondContact O-N 2.68Å; P951-Y953 PolarHBondContact O-N 3.25Å; P951-Y953 VanDerWaalsContact O-N 3.14Å; Y953-V957 HydrophobicContact CG-CG1 4.45Å
954	S	83.3	Confident	86.4	Confident	45 Å²	45	45.5 Å²	45.5	32%	0.315	22%	0.219	S	C	.	.			trans	-57.8	148.9	-178.1	62	0	0	0	0	112.6	D910 R956 V957 C958	D910-S954 WeakPolarHBondContact OD2-CB 3.42Å; D910-S954 PolarHBondContact OD2-N 3.2Å; D910-S954 PolarHBondContact OD2-OG 2.91Å; S954-R956 PolarHBondContact O-N 3.09Å; S954-V957 PolarHBondContact O-N 3.15Å; S954-V957 PolarHBondContact OG-N 2.64Å; S954-C958 PolarHBondContact O-N 2.88Å; S954-C958 VanDerWaalsContact O-N 3.11Å
955	H	79.8	Confident	86.4	Confident	94 Å²	94	42.6 Å²	42.6	44%	0.435	21%	0.208	S	C	.	.	H	α-helix	trans	-53.9	-31.7	176.2	-179.9	-142.9	0	0	0	112.4	Y950 C958 K959	Y950-H955 HydrophobicContact CD2-CB 4.34Å; Y950-H955 HydrophobicContact CE2-CB 4.28Å; H955-C958 PolarHBondContact O-N 3.19Å; H955-K959 WeakPolarHBondContact O-CB 3.37Å; H955-K959 PolarHBondContact O-N 2.89Å
956	R	81.5	Confident	86.4	Confident	135 Å²	135	45.5 Å²	45.5	51%	0.509	21%	0.214	S	C	.	.	H	α-helix	trans	-60.1	-47.7	173	-175.5	179.5	-178.4	179.3	1.3	112.6	S954 K959 Y960	S954-R956 PolarHBondContact O-N 3.09Å; R956-K959 PolarHBondContact O-N 3.1Å; R956-Y960 HydrophobicContact CG-CD1 4.39Å; R956-Y960 HydrophobicContact CG-CE1 4.01Å; R956-Y960 HydrophobicContact CG-CE2 4.18Å; R956-Y960 PolarHBondContact NE-OH 2.83Å; R956-Y960 PolarHBondContact NH2-OH 2.86Å; R956-Y960 VanDerWaalsContact NH2-OH 3.09Å; R956-Y960 WeakPolarHBondContact O-CB 3.44Å; R956-Y960 WeakPolarHBondContact O-CD1 3.26Å; R956-Y960 VanDerWaalsContact O-CG 3.29Å; R956-Y960 PolarHBondContact O-N 3.34Å
957	V	87.5	Confident	86.4	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-64.1	-46.3	177.9	164.9	0	0	0	0	110.7	D910 I913 L917 L946 Y953 S954 K959 Y960 A961	D910-V957 HydrophobicContact CB-CG2 3.89Å; D910-V957 VanDerWaalsContact O-CG2 3.27Å; D910-V957 WeakPolarHBondContact O-CG2 3.15Å; D910-V957 WeakPolarHBondContact OD2-CG2 3.27Å; I913-V957 HydrophobicContact CB-CG2 4.36Å; I913-V957 HydrophobicContact CG2-CG1 3.6Å; I913-V957 HydrophobicContact CG2-CG2 4.21Å; L917-V957 HydrophobicContact CD1-CG1 4.26Å; L946-V957 HydrophobicContact CD1-CG1 3.63Å; L946-V957 HydrophobicContact CD2-CG1 3.98Å; L946-V957 HydrophobicContact CG-CG1 3.83Å; Y953-V957 HydrophobicContact CG-CG1 4.45Å; S954-V957 PolarHBondContact O-N 3.15Å; S954-V957 PolarHBondContact OG-N 2.64Å; V957-K959 PolarHBondContact O-N 2.92Å; V957-Y960 PolarHBondContact O-N 3.31Å; V957-A961 PolarHBondContact O-N 2.67Å
958	C	85.8	Confident	86.6	Confident	6 Å²	6	45.6 Å²	45.6	4%	0.041	21%	0.214	C	C	.	.	H	α-helix	trans	-60.9	-45.7	177.6	-60.6	0	0	0	0	111.6	L946 S954 H955 Y960 A961 S962	L946-C958 PolarHBondContact O-SG 2.71Å; L946-C958 VanDerWaalsContact O-SG 3.35Å; S954-C958 PolarHBondContact O-N 2.88Å; S954-C958 VanDerWaalsContact O-N 3.11Å; H955-C958 PolarHBondContact O-N 3.19Å; C958-Y960 PolarHBondContact O-N 2.9Å; C958-A961 PolarHBondContact O-N 2.71Å; C958-S962 PolarHBondContact O-N 2.99Å; C958-S962 PolarHBondContact O-OG 3.04Å; C958-S962 VanDerWaalsContact O-OG 3.11Å
959	K	84.2	Confident	86.8	Confident	63 Å²	63	39.2 Å²	39.2	27%	0.274	19%	0.19	S	C	.	.	H	α-helix	trans	-62.3	-37.7	175.2	-174	168.6	-176.9	169.4	0	112.3	H955 R956 V957 Q963	H955-K959 WeakPolarHBondContact O-CB 3.37Å; H955-K959 PolarHBondContact O-N 2.89Å; R956-K959 PolarHBondContact O-N 3.1Å; V957-K959 PolarHBondContact O-N 2.92Å; K959-Q963 WeakPolarHBondContact O-CG 3.45Å; K959-Q963 PolarHBondContact O-N 3.15Å
960	Y	88.9	Confident	87.1	Confident	15 Å²	15	41.6 Å²	41.6	6%	0.059	20%	0.198	C	C	.	.	H	α-helix	trans	-68.2	-43	175.4	-78.1	12.5	0	0	0	111.8	R956 V957 C958 S962 Q963 V964 L1001	R956-Y960 HydrophobicContact CG-CD1 4.39Å; R956-Y960 HydrophobicContact CG-CE1 4.01Å; R956-Y960 HydrophobicContact CG-CE2 4.18Å; R956-Y960 PolarHBondContact NE-OH 2.83Å; R956-Y960 PolarHBondContact NH2-OH 2.86Å; R956-Y960 VanDerWaalsContact NH2-OH 3.09Å; R956-Y960 WeakPolarHBondContact O-CB 3.44Å; R956-Y960 WeakPolarHBondContact O-CD1 3.26Å; R956-Y960 VanDerWaalsContact O-CG 3.29Å; R956-Y960 PolarHBondContact O-N 3.34Å; V957-Y960 PolarHBondContact O-N 3.31Å; C958-Y960 PolarHBondContact O-N 2.9Å; Y960-S962 PolarHBondContact O-N 2.87Å; Y960-Q963 PolarHBondContact O-N 3.35Å; Y960-V964 WeakPolarHBondContact O-CG2 3.36Å; Y960-V964 PolarHBondContact O-N 2.75Å; Y960-L1001 HydrophobicContact CD1-CD1 4.34Å; Y960-L1001 HydrophobicContact CD1-CD2 3.98Å; Y960-L1001 HydrophobicContact CD1-CG 3.87Å; Y960-L1001 HydrophobicContact CD2-CD1 4.44Å; Y960-L1001 HydrophobicContact CD2-CD2 3.47Å; Y960-L1001 VanDerWaalsContact CD2-CD2 3.47Å; Y960-L1001 HydrophobicContact CD2-CG 4.17Å; Y960-L1001 HydrophobicContact CE1-CD2 4Å; Y960-L1001 HydrophobicContact CE1-CG 4.16Å; Y960-L1001 HydrophobicContact CE2-CD2 3.49Å; Y960-L1001 VanDerWaalsContact CE2-CD2 3.49Å; Y960-L1001 HydrophobicContact CE2-CG 4.44Å; Y960-L1001 HydrophobicContact CG-CD1 4Å; Y960-L1001 HydrophobicContact CG-CD2 3.73Å; Y960-L1001 HydrophobicContact CG-CG 3.88Å
961	A	91.3	Very high	87.6	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.1	-42.1	175.3	0	0	0	0	0	111.7	L917 L943 L946 V957 C958 Q963 V964 L965	L917-A961 HydrophobicContact CD1-CB 4.2Å; L917-A961 HydrophobicContact CD2-CB 4.26Å; L943-A961 HydrophobicContact CD2-CB 4.42Å; L946-A961 HydrophobicContact CB-CB 4.2Å; L946-A961 HydrophobicContact CD2-CB 4.22Å; L946-A961 HydrophobicContact CG-CB 4.1Å; V957-A961 PolarHBondContact O-N 2.67Å; C958-A961 PolarHBondContact O-N 2.71Å; A961-Q963 PolarHBondContact O-N 2.92Å; A961-V964 PolarHBondContact O-N 2.84Å; A961-L965 WeakPolarHBondContact O-CG 3.31Å; A961-L965 PolarHBondContact O-N 3.18Å
962	S	87.6	Confident	88.2	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.014	19%	0.185	C	C	.	.	H	α-helix	trans	-59.6	-40.7	171.5	-62.9	0	0	0	0	113.2	C958 Y960 L965 Y966 S990	C958-S962 PolarHBondContact O-N 2.99Å; C958-S962 PolarHBondContact O-OG 3.04Å; C958-S962 VanDerWaalsContact O-OG 3.11Å; Y960-S962 PolarHBondContact O-N 2.87Å; S962-L965 PolarHBondContact O-N 2.78Å; S962-Y966 WeakPolarHBondContact O-CB 3.45Å; S962-Y966 PolarHBondContact O-N 3.13Å; S962-S990 VanDerWaalsContact CB-OG 3.23Å; S962-S990 WeakPolarHBondContact CB-OG 3.37Å; S962-S990 PolarHBondContact OG-OG 3.13Å
963	Q	88.1	Confident	88.7	Confident	27 Å²	27	43.9 Å²	43.9	13%	0.126	20%	0.198	C	C	.	.	H	α-helix	trans	-66.6	-34.5	177.3	-77.6	174.4	11.8	0	0	112.6	F921 K959 Y960 A961 V967 S999 T1000 L1001	F921-Q963 HydrophobicContact CD2-CB 4.38Å; F921-Q963 HydrophobicContact CE2-CB 4.27Å; K959-Q963 WeakPolarHBondContact O-CG 3.45Å; K959-Q963 PolarHBondContact O-N 3.15Å; Y960-Q963 PolarHBondContact O-N 3.35Å; A961-Q963 PolarHBondContact O-N 2.92Å; Q963-V967 WeakPolarHBondContact O-CG2 3.38Å; Q963-V967 PolarHBondContact O-N 3.35Å; Q963-S999 PolarHBondContact OE1-OG 2.66Å; Q963-T1000 PolarHBondContact NE2-OG1 3.42Å; Q963-T1000 PolarHBondContact OE1-OG1 3.14Å; Q963-L1001 HydrophobicContact CB-CD1 4.18Å
964	V	92.3	Very high	89.1	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.7	-52.4	170.7	-179.6	0	0	0	0	110	L917 F921 V924 L943 Y960 A961 Y966 V967 M968 L1001	L917-V964 HydrophobicContact CB-CG2 4.5Å; L917-V964 HydrophobicContact CD2-CG2 4.28Å; F921-V964 HydrophobicContact CB-CG2 4Å; V924-V964 HydrophobicContact CG2-CG1 4.05Å; L943-V964 HydrophobicContact CD1-CB 4.36Å; L943-V964 HydrophobicContact CD1-CG1 3.6Å; L943-V964 HydrophobicContact CD2-CB 4.1Å; L943-V964 HydrophobicContact CD2-CG1 4.06Å; L943-V964 HydrophobicContact CD2-CG2 4.44Å; L943-V964 HydrophobicContact CG-CG1 4.5Å; Y960-V964 WeakPolarHBondContact O-CG2 3.36Å; Y960-V964 PolarHBondContact O-N 2.75Å; A961-V964 PolarHBondContact O-N 2.84Å; V964-Y966 PolarHBondContact O-N 3.37Å; V964-V967 PolarHBondContact O-N 2.7Å; V964-V967 VanDerWaalsContact O-N 3.17Å; V964-M968 HydrophobicContact CG1-CG 4.35Å; V964-M968 HydrophobicContact CG1-SD 4.37Å; V964-M968 WeakPolarHBondContact O-CG 3.47Å; V964-M968 PolarHBondContact O-N 3.38Å; V964-L1001 HydrophobicContact CG2-CD1 4.38Å
965	L	92	Very high	89.6	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-57.4	-48.4	-179.7	-72.2	169.9	0	0	0	113	T940 L943 R944 A961 S962 V967 M968 W969 F988	T940-L965 HydrophobicContact CG2-CD2 3.99Å; L943-L965 HydrophobicContact CB-CD1 4.31Å; L943-L965 HydrophobicContact CB-CD2 3.78Å; L943-L965 HydrophobicContact CB-CG 3.93Å; L943-L965 HydrophobicContact CD1-CD2 4.4Å; R944-L965 HydrophobicContact CB-CD1 4.49Å; A961-L965 WeakPolarHBondContact O-CG 3.31Å; A961-L965 PolarHBondContact O-N 3.18Å; S962-L965 PolarHBondContact O-N 2.78Å; L965-V967 PolarHBondContact O-N 3.08Å; L965-M968 HydrophobicContact CD2-SD 4.49Å; L965-M968 WeakPolarHBondContact O-CB 3.17Å; L965-M968 PolarHBondContact O-N 2.99Å; L965-W969 PolarHBondContact O-N 3.09Å; L965-F988 HydrophobicContact CB-CD1 4.24Å; L965-F988 HydrophobicContact CD2-CD1 4.02Å; L965-F988 HydrophobicContact CD2-CE1 4.31Å; L965-F988 WeakPolarHBondContact O-CD1 3.16Å
966	Y	90.1	Very high	90.1	Very high	88 Å²	88	44 Å²	44	35%	0.345	20%	0.198	S	C	.	.	H	α-helix	trans	-54.6	-41.6	177.3	169.1	-97.7	0	0	0	111.9	S962 V964 W969 Q970 F988 Y989	S962-Y966 WeakPolarHBondContact O-CB 3.45Å; S962-Y966 PolarHBondContact O-N 3.13Å; V964-Y966 PolarHBondContact O-N 3.37Å; Y966-W969 PolarHBondContact O-N 3.09Å; Y966-Q970 HydrophobicContact CE1-CG 4.32Å; Y966-Q970 VanDerWaalsContact CE2-NE2 3.32Å; Y966-Q970 WeakPolarHBondContact O-CG 3.49Å; Y966-Q970 PolarHBondContact O-N 2.95Å; Y966-Q970 PolarHBondContact O-NE2 3.4Å; Y966-F988 PolarHBondContact N-O 3.35Å; Y966-Y989 AromaticContact CD2-CD1 4Å; Y966-Y989 HydrophobicContact CD2-CD1 4Å; Y966-Y989 AromaticContact CD2-CE1 3.6Å; Y966-Y989 HydrophobicContact CD2-CE1 3.6Å; Y966-Y989 HydrophobicContact CE2-CD1 4.4Å; Y966-Y989 AromaticContact CE2-CE1 3.64Å; Y966-Y989 HydrophobicContact CE2-CE1 3.64Å
967	V	90.8	Very high	90.5	Very high	19 Å²	19	38.6 Å²	38.6	12%	0.115	19%	0.185	C	C	.	.	H	α-helix	trans	-70.8	-39.1	176.4	169.9	0	0	0	0	112.1	F921 V924 R925 Q963 V964 L965 W969 Q970	F921-V967 HydrophobicContact CD2-CG2 4.16Å; F921-V967 HydrophobicContact CE2-CB 4.48Å; F921-V967 HydrophobicContact CE2-CG2 3.54Å; F921-V967 HydrophobicContact CZ-CG2 4.23Å; V924-V967 HydrophobicContact CG2-CB 4.45Å; V924-V967 HydrophobicContact CG2-CG1 3.93Å; R925-V967 HydrophobicContact CB-CG1 3.63Å; Q963-V967 WeakPolarHBondContact O-CG2 3.38Å; Q963-V967 PolarHBondContact O-N 3.35Å; V964-V967 PolarHBondContact O-N 2.7Å; V964-V967 VanDerWaalsContact O-N 3.17Å; L965-V967 PolarHBondContact O-N 3.08Å; V967-W969 PolarHBondContact O-N 3.27Å; V967-Q970 PolarHBondContact O-N 3.5Å
968	M	93.4	Very high	90.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-56.6	-36.1	173.7	-64.1	-173.8	73.5	0	0	111.5	V924 T931 V934 L943 V964 L965 F988	V924-M968 HydrophobicContact CB-CG 4.36Å; V924-M968 HydrophobicContact CG1-CG 4.4Å; V924-M968 HydrophobicContact CG2-CG 4.19Å; T931-M968 HydrophobicContact CG2-CB 3.69Å; T931-M968 HydrophobicContact CG2-CE 3.74Å; T931-M968 HydrophobicContact CG2-CG 3.84Å; T931-M968 WeakPolarHBondContact O-CE 3.27Å; V934-M968 HydrophobicContact CB-CE 4.1Å; V934-M968 HydrophobicContact CG1-CE 3.75Å; V934-M968 HydrophobicContact CG1-SD 4.2Å; L943-M968 HydrophobicContact CD1-SD 3.8Å; V964-M968 HydrophobicContact CG1-CG 4.35Å; V964-M968 HydrophobicContact CG1-SD 4.37Å; V964-M968 WeakPolarHBondContact O-CG 3.47Å; V964-M968 PolarHBondContact O-N 3.38Å; L965-M968 HydrophobicContact CD2-SD 4.49Å; L965-M968 WeakPolarHBondContact O-CB 3.17Å; L965-M968 PolarHBondContact O-N 2.99Å; M968-F988 HydrophobicContact CB-CD1 4.37Å; M968-F988 HydrophobicContact CB-CE1 4.25Å
969	W	92	Very high	90.9	Very high	10 Å²	10	43.6 Å²	43.6	4%	0.038	21%	0.206	C	C	.	.	H	α-helix	trans	-76.3	-15	178	-167.5	-103.2	0	0	0	114.7	L965 Y966 V967 H971 H975 F978 E985 F988 Y989	L965-W969 PolarHBondContact O-N 3.09Å; Y966-W969 PolarHBondContact O-N 3.09Å; V967-W969 PolarHBondContact O-N 3.27Å; W969-H971 PolarHBondContact O-N 2.92Å; W969-H975 AromaticContact CD1-NE2 3.9Å; W969-H975 AromaticContact CD2-NE2 3.58Å; W969-H975 AromaticContact CE2-CE1 3.52Å; W969-H975 AromaticContact CE2-NE2 3.52Å; W969-H975 AromaticContact CG-NE2 3.86Å; W969-H975 AromaticContact CZ2-CE1 3.75Å; W969-H975 AromaticContact CZ2-ND1 3.96Å; W969-H975 AromaticContact NE1-CE1 3.6Å; W969-H975 AromaticContact NE1-NE2 3.71Å; W969-H975 PolarHBondContact O-NE2 3.24Å; W969-F978 AromaticContact CE3-CD2 3.7Å; W969-F978 HydrophobicContact CE3-CD2 3.7Å; W969-F978 HydrophobicContact CE3-CE2 4.24Å; W969-F978 HydrophobicContact CZ3-CB 4.14Å; W969-F978 AromaticContact CZ3-CD2 3.79Å; W969-F978 HydrophobicContact CZ3-CD2 3.79Å; W969-F978 HydrophobicContact CZ3-CG 4.42Å; W969-E985 HydrophobicContact CH2-CB 4.12Å; W969-E985 HydrophobicContact CZ2-CB 3.56Å; W969-E985 HydrophobicContact CZ2-CG 3.73Å; W969-E985 PolarHBondContact NE1-OE1 3.34Å; W969-F988 HydrophobicContact CB-CB 3.76Å; W969-F988 HydrophobicContact CB-CD1 4.13Å; W969-F988 HydrophobicContact CB-CG 3.96Å; W969-F988 HydrophobicContact CD2-CB 4.3Å; W969-F988 AromaticContact CD2-CD2 3.99Å; W969-F988 HydrophobicContact CD2-CD2 3.99Å; W969-F988 HydrophobicContact CD2-CG 4.16Å; W969-F988 HydrophobicContact CE3-CB 4.33Å; W969-F988 HydrophobicContact CE3-CD1 4.29Å; W969-F988 AromaticContact CE3-CD2 3.23Å; W969-F988 HydrophobicContact CE3-CD2 3.23Å; W969-F988 HydrophobicContact CE3-CE1 4.42Å; W969-F988 AromaticContact CE3-CE2 3.41Å; W969-F988 HydrophobicContact CE3-CE2 3.41Å; W969-F988 VanDerWaalsContact CE3-CE2 3.41Å; W969-F988 AromaticContact CE3-CG 3.71Å; W969-F988 HydrophobicContact CE3-CG 3.71Å; W969-F988 HydrophobicContact CE3-CZ 4.02Å; W969-F988 HydrophobicContact CG-CB 4.09Å; W969-F988 HydrophobicContact CG-CG 4.31Å; W969-F988 AromaticContact CZ3-CD2 3.62Å; W969-F988 HydrophobicContact CZ3-CD2 3.62Å; W969-F988 AromaticContact CZ3-CE2 3.52Å; W969-F988 HydrophobicContact CZ3-CE2 3.52Å; W969-F988 HydrophobicContact CZ3-CZ 4.35Å; W969-Y989 AromaticContact CD1-CE2 3.49Å; W969-Y989 VanDerWaalsContact CD1-CE2 3.49Å; W969-Y989 AromaticContact CD1-CZ 3.96Å; W969-Y989 HydrophobicContact CG-CE2 4.26Å; W969-Y989 AromaticContact NE1-CE2 3.73Å
970	Q	91	Very high	91.2	Very high	81 Å²	81	50.6 Å²	50.6	38%	0.379	23%	0.23	S	C	.	.	H	α-helix	trans	-71.2	-19.8	175.9	-57.5	-46	-58.8	0	0	112.9	Y966 V967 K972	Y966-Q970 HydrophobicContact CE1-CG 4.32Å; Y966-Q970 VanDerWaalsContact CE2-NE2 3.32Å; Y966-Q970 WeakPolarHBondContact O-CG 3.49Å; Y966-Q970 PolarHBondContact O-N 2.95Å; Y966-Q970 PolarHBondContact O-NE2 3.4Å; V967-Q970 PolarHBondContact O-N 3.5Å; Q970-K972 PolarHBondContact O-N 3.31Å
971	H	92.4	Very high	91.2	Very high	28 Å²	28	53.3 Å²	53.3	13%	0.13	25%	0.251	C	S	.	.			trans	-78	85	174	-61	-72.1	0	0	0	110.7	V924 A928 T931 W969 E973 L974	V924-H971 PolarHBondContact O-NE2 3.01Å; A928-H971 HydrophobicContact CB-CB 3.94Å; T931-H971 PolarHBondContact OG1-CD2 3.48Å; T931-H971 VanDerWaalsContact OG1-CD2 3.29Å; T931-H971 PolarHBondContact OG1-NE2 3.4Å; W969-H971 PolarHBondContact O-N 2.92Å; H971-E973 VanDerWaalsContact C-OE2 3.28Å; H971-E973 PolarHBondContact O-N 3.05Å; H971-L974 HydrophobicContact CB-CD1 3.86Å; H971-L974 HydrophobicContact CB-CG 4.02Å; H971-L974 WeakPolarHBondContact O-CB 3.44Å; H971-L974 PolarHBondContact O-N 2.89Å
972	K	91.8	Very high	91	Very high	158 Å²	158	55.9 Å²	55.9	69%	0.687	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-59	-29.2	-173.8	-65	-177.7	-179.1	-179	0	113.4	Q970 L974 H975	Q970-K972 PolarHBondContact O-N 3.31Å; K972-L974 PolarHBondContact O-N 3.35Å; K972-H975 WeakPolarHBondContact O-CB 3.34Å; K972-H975 PolarHBondContact O-N 3.2Å
973	E	94.3	Very high	91.1	Very high	140 Å²	140	56.1 Å²	56.1	65%	0.654	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-63.2	-16.8	174.6	61.5	-95	-119.6	0	0	114.1	A928 H971	A928-E973 HydrophobicContact CB-CG 3.77Å; A928-E973 WeakPolarHBondContact CB-OE1 3.3Å; H971-E973 VanDerWaalsContact C-OE2 3.28Å; H971-E973 PolarHBondContact O-N 3.05Å
974	L	93.4	Very high	91.1	Very high	18 Å²	18	62 Å²	62	9%	0.094	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-95.7	-9.8	178.7	-55.4	-177.3	0	0	0	113.7	A928 T931 K932 H971 K972 D976 G977 F978	A928-L974 HydrophobicContact CB-CD1 4.24Å; A928-L974 HydrophobicContact CB-CD2 4.42Å; A928-L974 HydrophobicContact CB-CG 4.26Å; A928-L974 WeakPolarHBondContact O-CD1 3.26Å; T931-L974 HydrophobicContact CG2-CD1 3.37Å; K932-L974 HydrophobicContact CB-CD1 4.45Å; K932-L974 HydrophobicContact CB-CD2 3.98Å; K932-L974 HydrophobicContact CD-CD2 4.38Å; H971-L974 HydrophobicContact CB-CD1 3.86Å; H971-L974 HydrophobicContact CB-CG 4.02Å; H971-L974 WeakPolarHBondContact O-CB 3.44Å; H971-L974 PolarHBondContact O-N 2.89Å; K972-L974 PolarHBondContact O-N 3.35Å; L974-D976 VanDerWaalsContact C-N 3.28Å; L974-D976 PolarHBondContact O-N 3.33Å; L974-G977 CarbonylContact O-C 3.47Å; L974-G977 VanDerWaalsContact O-CA 3.29Å; L974-G977 WeakPolarHBondContact O-CA 3.38Å; L974-G977 PolarHBondContact O-N 2.91Å; L974-F978 HydrophobicContact CB-CD2 4.18Å; L974-F978 HydrophobicContact CB-CE1 4.27Å; L974-F978 HydrophobicContact CB-CE2 3.58Å; L974-F978 HydrophobicContact CB-CZ 3.63Å; L974-F978 HydrophobicContact CD1-CE2 4.47Å; L974-F978 HydrophobicContact CD1-CZ 3.87Å; L974-F978 HydrophobicContact CG-CZ 4.43Å; L974-F978 WeakPolarHBondContact O-CD2 3.41Å; L974-F978 WeakPolarHBondContact O-CG 3.45Å; L974-F978 PolarHBondContact O-N 3.21Å
975	H	92.8	Very high	90.7	Very high	31 Å²	31	67 Å²	67	14%	0.144	33%	0.327	C	S	.	.	H	α-helix	trans	-55	-43.2	-175.4	-77.6	-158.2	0	0	0	112.5	W969 K972 G977 F978 K979	W969-H975 AromaticContact CD1-NE2 3.9Å; W969-H975 AromaticContact CD2-NE2 3.58Å; W969-H975 AromaticContact CE2-CE1 3.52Å; W969-H975 AromaticContact CE2-NE2 3.52Å; W969-H975 AromaticContact CG-NE2 3.86Å; W969-H975 AromaticContact CZ2-CE1 3.75Å; W969-H975 AromaticContact CZ2-ND1 3.96Å; W969-H975 AromaticContact NE1-CE1 3.6Å; W969-H975 AromaticContact NE1-NE2 3.71Å; W969-H975 PolarHBondContact O-NE2 3.24Å; K972-H975 WeakPolarHBondContact O-CB 3.34Å; K972-H975 PolarHBondContact O-N 3.2Å; H975-G977 VanDerWaalsContact C-N 3.27Å; H975-G977 PolarHBondContact O-N 3.26Å; H975-F978 PolarHBondContact O-N 3.02Å; H975-K979 WeakPolarHBondContact O-CB 3.23Å; H975-K979 WeakPolarHBondContact O-CD 3.33Å; H975-K979 WeakPolarHBondContact O-CG 3.5Å; H975-K979 PolarHBondContact O-N 3.46Å
976	D	90.2	Very high	90.3	Very high	99 Å²	99	70.3 Å²	70.3	53%	0.529	36%	0.356	S	S	.	.	H	α-helix	trans	-80	-10.2	179.1	-60.6	-21.3	0	0	0	112.7	L974 K979 R980	L974-D976 VanDerWaalsContact C-N 3.28Å; L974-D976 PolarHBondContact O-N 3.33Å; D976-K979 IonicContact OD1-NZ 2.69Å; D976-K979 PolarHBondContact OD1-NZ 3.47Å; D976-R980 WeakPolarHBondContact O-CG 3.25Å; D976-R980 PolarHBondContact O-NE 3.44Å; D976-R980 PolarHBondContact O-NH2 3.31Å
977	G	90	Very high	90	Very high	23 Å²	23	67.3 Å²	67.3	24%	0.237	35%	0.345	C	S	.	.	H	α-helix	trans	-72.2	-58.4	160.7	0	0	0	0	0	110.7	L974 H975 K979 R980 S981	L974-G977 CarbonylContact O-C 3.47Å; L974-G977 VanDerWaalsContact O-CA 3.29Å; L974-G977 WeakPolarHBondContact O-CA 3.38Å; L974-G977 PolarHBondContact O-N 2.91Å; H975-G977 VanDerWaalsContact C-N 3.27Å; H975-G977 PolarHBondContact O-N 3.26Å; G977-K979 VanDerWaalsContact C-N 3.33Å; G977-K979 PolarHBondContact O-N 3.29Å; G977-R980 WeakPolarHBondContact O-CB 3.42Å; G977-R980 PolarHBondContact O-N 2.85Å; G977-S981 PolarHBondContact O-N 3.46Å; G977-S981 VanDerWaalsContact O-N 3.14Å; G977-S981 PolarHBondContact O-OG 3.01Å
978	F	92.1	Very high	89.7	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.009	34%	0.34	C	S	.	.	H	α-helix	trans	-56	-43.4	-178.3	-56.9	-39.6	0	0	0	112.9	T931 H935 W969 L974 H975 R980 S981 G982 L983 F988	T931-F978 HydrophobicContact CG2-CZ 4.14Å; H935-F978 HydrophobicContact CB-CE1 4.04Å; H935-F978 AromaticContact CD2-CD1 3.96Å; H935-F978 AromaticContact CE1-CD1 4Å; H935-F978 AromaticContact CG-CD1 3.93Å; H935-F978 AromaticContact CG-CE1 3.83Å; H935-F978 AromaticContact ND1-CD1 3.94Å; H935-F978 AromaticContact NE2-CD1 3.99Å; W969-F978 AromaticContact CE3-CD2 3.7Å; W969-F978 HydrophobicContact CE3-CD2 3.7Å; W969-F978 HydrophobicContact CE3-CE2 4.24Å; W969-F978 HydrophobicContact CZ3-CB 4.14Å; W969-F978 AromaticContact CZ3-CD2 3.79Å; W969-F978 HydrophobicContact CZ3-CD2 3.79Å; W969-F978 HydrophobicContact CZ3-CG 4.42Å; L974-F978 HydrophobicContact CB-CD2 4.18Å; L974-F978 HydrophobicContact CB-CE1 4.27Å; L974-F978 HydrophobicContact CB-CE2 3.58Å; L974-F978 HydrophobicContact CB-CZ 3.63Å; L974-F978 HydrophobicContact CD1-CE2 4.47Å; L974-F978 HydrophobicContact CD1-CZ 3.87Å; L974-F978 HydrophobicContact CG-CZ 4.43Å; L974-F978 WeakPolarHBondContact O-CD2 3.41Å; L974-F978 WeakPolarHBondContact O-CG 3.45Å; L974-F978 PolarHBondContact O-N 3.21Å; H975-F978 PolarHBondContact O-N 3.02Å; F978-R980 VanDerWaalsContact C-N 3.34Å; F978-R980 PolarHBondContact O-N 3Å; F978-S981 CarbonylContact O-C 3.6Å; F978-S981 WeakPolarHBondContact O-CA 3.44Å; F978-S981 WeakPolarHBondContact O-CB 3.22Å; F978-S981 PolarHBondContact O-N 3.41Å; F978-S981 VanDerWaalsContact O-N 3.12Å; F978-G982 PolarHBondContact O-N 3.41Å; F978-L983 HydrophobicContact CB-CB 4.27Å; F978-L983 HydrophobicContact CB-CD1 4.45Å; F978-L983 WeakPolarHBondContact O-CB 3.49Å; F978-L983 PolarHBondContact O-N 3.11Å; F978-F988 HydrophobicContact CB-CE2 4.16Å; F978-F988 HydrophobicContact CB-CZ 4.05Å; F978-F988 AromaticContact CD1-CZ 3.92Å; F978-F988 HydrophobicContact CD1-CZ 3.92Å; F978-F988 HydrophobicContact CD2-CE1 4.34Å; F978-F988 HydrophobicContact CD2-CE2 4.2Å; F978-F988 AromaticContact CD2-CZ 3.73Å; F978-F988 HydrophobicContact CD2-CZ 3.73Å; F978-F988 HydrophobicContact CE1-CZ 4.27Å; F978-F988 HydrophobicContact CE2-CE1 4.25Å; F978-F988 HydrophobicContact CE2-CZ 4.09Å; F978-F988 HydrophobicContact CG-CE2 4.18Å; F978-F988 AromaticContact CG-CZ 3.64Å; F978-F988 HydrophobicContact CG-CZ 3.64Å; F978-F988 HydrophobicContact CZ-CE1 4.34Å; F978-F988 HydrophobicContact CZ-CZ 4.34Å
979	K	90.6	Very high	88.9	Confident	109 Å²	109	69.9 Å²	69.9	47%	0.474	35%	0.354	S	S	.	.	H	α-helix	trans	-61.9	-37	176.2	-67.8	165.4	-158.7	161.7	0	113	H975 D976 G977 S981 G982	H975-K979 WeakPolarHBondContact O-CB 3.23Å; H975-K979 WeakPolarHBondContact O-CD 3.33Å; H975-K979 WeakPolarHBondContact O-CG 3.5Å; H975-K979 PolarHBondContact O-N 3.46Å; D976-K979 IonicContact OD1-NZ 2.69Å; D976-K979 PolarHBondContact OD1-NZ 3.47Å; G977-K979 VanDerWaalsContact C-N 3.33Å; G977-K979 PolarHBondContact O-N 3.29Å; K979-S981 VanDerWaalsContact C-N 3.3Å; K979-G982 PolarHBondContact O-N 3Å
980	R	90.8	Very high	87.5	Confident	211 Å²	211	70.7 Å²	70.7	80%	0.796	36%	0.361	S	S	*	.	H	α-helix	trans	-69.2	-29.2	175.1	-82.1	-179	-69.9	159.6	-0.9	112.2	D976 G977 F978 G982	D976-R980 WeakPolarHBondContact O-CG 3.25Å; D976-R980 PolarHBondContact O-NE 3.44Å; D976-R980 PolarHBondContact O-NH2 3.31Å; G977-R980 WeakPolarHBondContact O-CB 3.42Å; G977-R980 PolarHBondContact O-N 2.85Å; F978-R980 VanDerWaalsContact C-N 3.34Å; F978-R980 PolarHBondContact O-N 3Å; R980-G982 PolarHBondContact O-N 2.94Å
981	S	88.1	Confident	85.5	Confident	71 Å²	71	70.1 Å²	70.1	50%	0.497	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	9.2	169	-51.7	0	0	0	0	113.5	H935 G977 F978 K979 L983	H935-S981 WeakPolarHBondContact NE2-CB 3.38Å; H935-S981 PolarHBondContact NE2-OG 3.35Å; G977-S981 PolarHBondContact O-N 3.46Å; G977-S981 VanDerWaalsContact O-N 3.14Å; G977-S981 PolarHBondContact O-OG 3.01Å; F978-S981 CarbonylContact O-C 3.6Å; F978-S981 WeakPolarHBondContact O-CA 3.44Å; F978-S981 WeakPolarHBondContact O-CB 3.22Å; F978-S981 PolarHBondContact O-N 3.41Å; F978-S981 VanDerWaalsContact O-N 3.12Å; K979-S981 VanDerWaalsContact C-N 3.3Å; S981-L983 VanDerWaalsContact C-N 3.29Å; S981-L983 PolarHBondContact O-N 3.43Å
982	G	88.2	Confident	83.4	Confident	54 Å²	54	72.2 Å²	72.2	56%	0.557	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	1.5	177.8	0	0	0	0	0	115.8	F978 K979 R980	F978-G982 PolarHBondContact O-N 3.41Å; K979-G982 PolarHBondContact O-N 3Å; R980-G982 PolarHBondContact O-N 2.94Å
983	L	89.1	Confident	81.1	Confident	7 Å²	7	65.8 Å²	65.8	4%	0.037	37%	0.367	C	S	.	.			trans	-80.1	141.6	-179.1	-58.4	175.6	0	0	0	111.5	T940 F978 S981 D987 F988	T940-L983 HydrophobicContact CG2-CD1 3.62Å; F978-L983 HydrophobicContact CB-CB 4.27Å; F978-L983 HydrophobicContact CB-CD1 4.45Å; F978-L983 WeakPolarHBondContact O-CB 3.49Å; F978-L983 PolarHBondContact O-N 3.11Å; S981-L983 VanDerWaalsContact C-N 3.29Å; S981-L983 PolarHBondContact O-N 3.43Å; L983-D987 HydrophobicContact CD2-CB 4.45Å; L983-F988 HydrophobicContact CB-CE2 3.93Å; L983-F988 HydrophobicContact CB-CZ 4.42Å; L983-F988 HydrophobicContact CD1-CE2 4.12Å; L983-F988 HydrophobicContact CD1-CZ 3.79Å
984	K	87.6	Confident	78.5	Confident	152 Å²	152	69 Å²	69	66%	0.661	37%	0.374	S	S	*	.			trans	-110	166.6	179.5	-61.3	174.3	-173.9	173.5	0	110.4	A986 D987 F988	K984-A986 VanDerWaalsContact C-N 3.25Å; K984-A986 PolarHBondContact O-N 3.02Å; K984-D987 PolarHBondContact N-OD2 3.46Å; K984-D987 WeakPolarHBondContact O-CB 3.42Å; K984-D987 PolarHBondContact O-N 2.9Å; K984-F988 WeakPolarHBondContact O-CD2 3.36Å
985	E	84.8	Confident	75.8	Confident	103 Å²	103	76.7 Å²	76.7	48%	0.481	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-55.2	-42.5	176.2	-175.4	152.6	-137.6	0	0	112	W969 D987 F988 Y989	W969-E985 HydrophobicContact CH2-CB 4.12Å; W969-E985 HydrophobicContact CZ2-CB 3.56Å; W969-E985 HydrophobicContact CZ2-CG 3.73Å; W969-E985 PolarHBondContact NE1-OE1 3.34Å; E985-D987 PolarHBondContact O-N 2.95Å; E985-F988 PolarHBondContact O-N 3.15Å; E985-Y989 HydrophobicContact CG-CD2 3.7Å; E985-Y989 HydrophobicContact CG-CE2 3.53Å; E985-Y989 WeakPolarHBondContact O-CD2 3.48Å; E985-Y989 PolarHBondContact O-N 3.02Å
986	A	83	Confident	73.1	Confident	73 Å²	73	79.1 Å²	79.1	60%	0.603	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-63.6	-8.2	175.7	0	0	0	0	0	115.3	K984	K984-A986 VanDerWaalsContact C-N 3.25Å; K984-A986 PolarHBondContact O-N 3.02Å
987	D	83.9	Confident	70.6	Confident	25 Å²	25	80.1 Å²	80.1	13%	0.134	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-80.5	-17.4	169.6	-72.1	-64.1	0	0	0	113.2	R944 R948 L983 K984 E985	R944-D987 WeakPolarHBondContact CD-OD1 3.4Å; R944-D987 IonicContact CZ-OD1 3.52Å; R944-D987 IonicContact NE-OD1 3.75Å; R944-D987 IonicContact NH1-OD1 3.62Å; R944-D987 PolarHBondContact NH1-OD1 2.99Å; R944-D987 IonicContact NH1-OD2 2.71Å; R948-D987 IonicContact CZ-OD1 3.68Å; R948-D987 IonicContact NH1-OD1 2.77Å; R948-D987 IonicContact NH2-OD1 2.8Å; R948-D987 PolarHBondContact NH2-OD1 3.42Å; L983-D987 HydrophobicContact CD2-CB 4.45Å; K984-D987 PolarHBondContact N-OD2 3.46Å; K984-D987 WeakPolarHBondContact O-CB 3.42Å; K984-D987 PolarHBondContact O-N 2.9Å; E985-D987 PolarHBondContact O-N 2.95Å
988	F	84	Confident	68.6	Low	1 Å²	1	81.9 Å²	81.9	0%	0.004	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-10.6	-179.2	-62	-95.2	0	0	0	114	T940 L965 Y966 M968 W969 F978 L983 K984 E985	T940-F988 HydrophobicContact CG2-CE1 3.8Å; T940-F988 HydrophobicContact CG2-CZ 3.92Å; L965-F988 HydrophobicContact CB-CD1 4.24Å; L965-F988 HydrophobicContact CD2-CD1 4.02Å; L965-F988 HydrophobicContact CD2-CE1 4.31Å; L965-F988 WeakPolarHBondContact O-CD1 3.16Å; Y966-F988 PolarHBondContact N-O 3.35Å; M968-F988 HydrophobicContact CB-CD1 4.37Å; M968-F988 HydrophobicContact CB-CE1 4.25Å; W969-F988 HydrophobicContact CB-CB 3.76Å; W969-F988 HydrophobicContact CB-CD1 4.13Å; W969-F988 HydrophobicContact CB-CG 3.96Å; W969-F988 HydrophobicContact CD2-CB 4.3Å; W969-F988 AromaticContact CD2-CD2 3.99Å; W969-F988 HydrophobicContact CD2-CD2 3.99Å; W969-F988 HydrophobicContact CD2-CG 4.16Å; W969-F988 HydrophobicContact CE3-CB 4.33Å; W969-F988 HydrophobicContact CE3-CD1 4.29Å; W969-F988 AromaticContact CE3-CD2 3.23Å; W969-F988 HydrophobicContact CE3-CD2 3.23Å; W969-F988 HydrophobicContact CE3-CE1 4.42Å; W969-F988 AromaticContact CE3-CE2 3.41Å; W969-F988 HydrophobicContact CE3-CE2 3.41Å; W969-F988 VanDerWaalsContact CE3-CE2 3.41Å; W969-F988 AromaticContact CE3-CG 3.71Å; W969-F988 HydrophobicContact CE3-CG 3.71Å; W969-F988 HydrophobicContact CE3-CZ 4.02Å; W969-F988 HydrophobicContact CG-CB 4.09Å; W969-F988 HydrophobicContact CG-CG 4.31Å; W969-F988 AromaticContact CZ3-CD2 3.62Å; W969-F988 HydrophobicContact CZ3-CD2 3.62Å; W969-F988 AromaticContact CZ3-CE2 3.52Å; W969-F988 HydrophobicContact CZ3-CE2 3.52Å; W969-F988 HydrophobicContact CZ3-CZ 4.35Å; F978-F988 HydrophobicContact CB-CE2 4.16Å; F978-F988 HydrophobicContact CB-CZ 4.05Å; F978-F988 AromaticContact CD1-CZ 3.92Å; F978-F988 HydrophobicContact CD1-CZ 3.92Å; F978-F988 HydrophobicContact CD2-CE1 4.34Å; F978-F988 HydrophobicContact CD2-CE2 4.2Å; F978-F988 AromaticContact CD2-CZ 3.73Å; F978-F988 HydrophobicContact CD2-CZ 3.73Å; F978-F988 HydrophobicContact CE1-CZ 4.27Å; F978-F988 HydrophobicContact CE2-CE1 4.25Å; F978-F988 HydrophobicContact CE2-CZ 4.09Å; F978-F988 HydrophobicContact CG-CE2 4.18Å; F978-F988 AromaticContact CG-CZ 3.64Å; F978-F988 HydrophobicContact CG-CZ 3.64Å; F978-F988 HydrophobicContact CZ-CE1 4.34Å; F978-F988 HydrophobicContact CZ-CZ 4.34Å; L983-F988 HydrophobicContact CB-CE2 3.93Å; L983-F988 HydrophobicContact CB-CZ 4.42Å; L983-F988 HydrophobicContact CD1-CE2 4.12Å; L983-F988 HydrophobicContact CD1-CZ 3.79Å; K984-F988 WeakPolarHBondContact O-CD2 3.36Å; E985-F988 PolarHBondContact O-N 3.15Å
989	Y	76.4	Confident	66.8	Low	72 Å²	72	83.2 Å²	83.2	28%	0.282	46%	0.459	S	S	.	.			trans	-115.9	106.8	175.1	-67.5	-94.4	0	0	0	111	Y966 W969 E985	Y966-Y989 AromaticContact CD2-CD1 4Å; Y966-Y989 HydrophobicContact CD2-CD1 4Å; Y966-Y989 AromaticContact CD2-CE1 3.6Å; Y966-Y989 HydrophobicContact CD2-CE1 3.6Å; Y966-Y989 HydrophobicContact CE2-CD1 4.4Å; Y966-Y989 AromaticContact CE2-CE1 3.64Å; Y966-Y989 HydrophobicContact CE2-CE1 3.64Å; W969-Y989 AromaticContact CD1-CE2 3.49Å; W969-Y989 VanDerWaalsContact CD1-CE2 3.49Å; W969-Y989 AromaticContact CD1-CZ 3.96Å; W969-Y989 HydrophobicContact CG-CE2 4.26Å; W969-Y989 AromaticContact NE1-CE2 3.73Å; E985-Y989 HydrophobicContact CG-CD2 3.7Å; E985-Y989 HydrophobicContact CG-CE2 3.53Å; E985-Y989 WeakPolarHBondContact O-CD2 3.48Å; E985-Y989 PolarHBondContact O-N 3.02Å
990	S	63.4	Low	65.4	Low	27 Å²	27	79.7 Å²	79.7	19%	0.189	45%	0.446	C	S	.	.			trans	-82.2	163.5	162.4	60.7	0	0	0	0	111	S962 T992 A993	S962-S990 VanDerWaalsContact CB-OG 3.23Å; S962-S990 WeakPolarHBondContact CB-OG 3.37Å; S962-S990 PolarHBondContact OG-OG 3.13Å; S990-T992 PolarHBondContact O-N 3.48Å; S990-T992 PolarHBondContact OG-OG1 3.42Å; S990-A993 PolarHBondContact O-N 2.77Å; S990-A993 VanDerWaalsContact O-N 3.08Å
991	G	49	Very low	64.1	Low	69 Å²	69	69.7 Å²	69.7	71%	0.711	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-55.7	-41.1	174.2	0	0	0	0	0	112.5	A993 R994	G991-A993 PolarHBondContact O-N 3.06Å; G991-R994 PolarHBondContact O-N 3.28Å; G991-R994 VanDerWaalsContact O-N 3.14Å
992	T	47.8	Very low	62.6	Low	72 Å²	72	69.2 Å²	69.2	44%	0.442	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-63.3	-1.8	176.1	52.7	0	0	0	0	115.8	S990	S990-T992 PolarHBondContact O-N 3.48Å; S990-T992 PolarHBondContact OG-OG1 3.42Å
993	A	43	Very low	61.1	Low	22 Å²	22	71.5 Å²	71.5	18%	0.182	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-111.6	3.5	177.1	0	0	0	0	0	113.8	S990 G991 R995	S990-A993 PolarHBondContact O-N 2.77Å; S990-A993 VanDerWaalsContact O-N 3.08Å; G991-A993 PolarHBondContact O-N 3.06Å; A993-R995 PolarHBondContact O-N 2.86Å
994	R	39.7	Very low	59.1	Low	207 Å²	207	72.3 Å²	72.3	78%	0.781	41%	0.406	S	S	*	.			trans	-91.1	59.2	-175	-81.3	-170.1	164.5	-168.6	-1.9	114.9	G991	G991-R994 PolarHBondContact O-N 3.28Å; G991-R994 VanDerWaalsContact O-N 3.14Å
995	R	36.7	Very low	57.3	Low	181 Å²	181	66.5 Å²	66.5	68%	0.683	38%	0.382	S	S	*	.	S	Bend	trans	-161.9	162.2	151.6	-101.8	163.3	-141.9	-161.8	15.3	109.8	D447 A993 D997	D447-R995 IonicContact OD1-NH2 3Å; A993-R995 PolarHBondContact O-N 2.86Å; R995-D997 WeakPolarHBondContact CB-OD2 3.48Å; R995-D997 PolarHBondContact O-N 2.88Å; R995-D997 VanDerWaalsContact O-N 3.11Å
996	G	37.7	Very low	55.4	Low	82 Å²	82	62.1 Å²	62.1	85%	0.845	36%	0.363	S	S	*	.			trans	-79.1	19	-171.7	0	0	0	0	0	115.4
997	D	36.7	Very low	53.2	Low	119 Å²	119	60.5 Å²	60.5	64%	0.636	35%	0.347	S	S	*	.			trans	-81.8	146.2	-163.4	-55.3	-44.5	0	0	0	112.7	R995 S999	R995-D997 WeakPolarHBondContact CB-OD2 3.48Å; R995-D997 PolarHBondContact O-N 2.88Å; R995-D997 VanDerWaalsContact O-N 3.11Å; D997-S999 PolarHBondContact O-N 2.76Å
998	S	49	Very low	51.1	Low	61 Å²	61	62.3 Å²	62.3	43%	0.427	36%	0.355	S	S	.	.			trans	-39.5	102.9	-175.5	172.8	0	0	0	0	113.1	T1000 R1003	S998-T1000 PolarHBondContact O-N 3.02Å; S998-T1000 VanDerWaalsContact O-N 3.15Å; S998-R1003 PolarHBondContact O-NH2 3.17Å; S998-R1003 PolarHBondContact OG-NE 2.86Å
999	S	53.8	Low	48.7	Very low	30 Å²	30	64 Å²	64	21%	0.21	37%	0.372	C	S	.	.			trans	-48.8	122	-178.8	167.5	0	0	0	0	110.5	F921 Q963 D997 L1001 A1002 R1003	F921-S999 WeakPolarHBondContact CE2-OG 3.29Å; F921-S999 WeakPolarHBondContact CZ-OG 3.46Å; Q963-S999 PolarHBondContact OE1-OG 2.66Å; D997-S999 PolarHBondContact O-N 2.76Å; S999-L1001 PolarHBondContact O-N 2.86Å; S999-L1001 PolarHBondContact OG-N 3.2Å; S999-A1002 WeakPolarHBondContact O-CA 3.49Å; S999-A1002 WeakPolarHBondContact O-CB 3.44Å; S999-A1002 PolarHBondContact O-N 2.72Å; S999-R1003 PolarHBondContact O-N 3.21Å
1000	T	59.9	Low	46.5	Very low	34 Å²	34	70.8 Å²	70.8	21%	0.209	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-30.4	-179.1	41.8	0	0	0	0	112.3	Q963 S998 Q1008	Q963-T1000 PolarHBondContact NE2-OG1 3.42Å; Q963-T1000 PolarHBondContact OE1-OG1 3.14Å; S998-T1000 PolarHBondContact O-N 3.02Å; S998-T1000 VanDerWaalsContact O-N 3.15Å; T1000-Q1008 PolarHBondContact O-NE2 2.67Å
1001	L	65.3	Low	44.6	Very low	1 Å²	1	74.2 Å²	74.2	1%	0.005	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-19.9	173	-73.5	-179.7	0	0	0	114.4	R871 F921 Y960 Q963 V964 S999	R871-L1001 PolarHBondContact NH2-O 3.1Å; F921-L1001 HydrophobicContact CB-CB 4.26Å; F921-L1001 HydrophobicContact CB-CD1 3.73Å; F921-L1001 HydrophobicContact CD1-CB 3.64Å; F921-L1001 HydrophobicContact CD2-CB 3.94Å; F921-L1001 HydrophobicContact CD2-CD1 3.87Å; F921-L1001 HydrophobicContact CE1-CB 3.86Å; F921-L1001 HydrophobicContact CE2-CB 4.14Å; F921-L1001 HydrophobicContact CG-CB 3.69Å; F921-L1001 HydrophobicContact CG-CD1 3.84Å; F921-L1001 HydrophobicContact CG-CG 4.42Å; F921-L1001 HydrophobicContact CZ-CB 4.12Å; Y960-L1001 HydrophobicContact CD1-CD1 4.34Å; Y960-L1001 HydrophobicContact CD1-CD2 3.98Å; Y960-L1001 HydrophobicContact CD1-CG 3.87Å; Y960-L1001 HydrophobicContact CD2-CD1 4.44Å; Y960-L1001 HydrophobicContact CD2-CD2 3.47Å; Y960-L1001 VanDerWaalsContact CD2-CD2 3.47Å; Y960-L1001 HydrophobicContact CD2-CG 4.17Å; Y960-L1001 HydrophobicContact CE1-CD2 4Å; Y960-L1001 HydrophobicContact CE1-CG 4.16Å; Y960-L1001 HydrophobicContact CE2-CD2 3.49Å; Y960-L1001 VanDerWaalsContact CE2-CD2 3.49Å; Y960-L1001 HydrophobicContact CE2-CG 4.44Å; Y960-L1001 HydrophobicContact CG-CD1 4Å; Y960-L1001 HydrophobicContact CG-CD2 3.73Å; Y960-L1001 HydrophobicContact CG-CG 3.88Å; Q963-L1001 HydrophobicContact CB-CD1 4.18Å; V964-L1001 HydrophobicContact CG2-CD1 4.38Å; S999-L1001 PolarHBondContact O-N 2.86Å; S999-L1001 PolarHBondContact OG-N 3.2Å
1002	A	55.2	Low	43.3	Very low	61 Å²	61	79 Å²	79	50%	0.504	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-17.6	174.3	0	0	0	0	0	113.7	F921 S999	F921-A1002 HydrophobicContact CE1-CB 4Å; F921-A1002 HydrophobicContact CZ-CB 4.17Å; S999-A1002 WeakPolarHBondContact O-CA 3.49Å; S999-A1002 WeakPolarHBondContact O-CB 3.44Å; S999-A1002 PolarHBondContact O-N 2.72Å
1003	R	57.1	Low	42.2	Very low	102 Å²	102	81.2 Å²	81.2	39%	0.385	42%	0.422	S	S	.	.	S	Bend	trans	-69.3	136.4	178.3	-62.2	-173.4	-171.6	176.7	5	111.3	R871 S998 S999 Q1008	R871-R1003 PolarHBondContact NH2-O 3.2Å; S998-R1003 PolarHBondContact O-NH2 3.17Å; S998-R1003 PolarHBondContact OG-NE 2.86Å; S999-R1003 PolarHBondContact O-N 3.21Å; R1003-Q1008 PolarHBondContact O-NE2 3.41Å
1004	P	47.8	Very low	41.2	Very low	24 Å²	24	85 Å²	85	16%	0.156	45%	0.448	C	S	.	.			trans	-58.8	141.5	177.5	-23.5	33.4	0	0	0	112.5	A754 S1006 S1007	A754-P1004 HydrophobicContact CB-CG 4.39Å; P1004-S1006 PolarHBondContact O-N 3.45Å; P1004-S1007 WeakPolarHBondContact O-CB 3.16Å; P1004-S1007 PolarHBondContact O-N 2.96Å; P1004-S1007 PolarHBondContact O-OG 3.36Å
1005	I	49.6	Very low	40.5	Very low	30 Å²	30	84.5 Å²	84.5	15%	0.154	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-63.7	-29.1	-172.5	-54.1	-165.4	0	0	0	112.4	T868 R871 N872 S1007 Q1008	T868-I1005 HydrophobicContact CG2-CD1 3.44Å; T868-I1005 VanDerWaalsContact CG2-CD1 3.44Å; R871-I1005 VanDerWaalsContact NH1-CD1 3.25Å; N872-I1005 WeakPolarHBondContact OD1-CD1 3.45Å; I1005-S1007 PolarHBondContact O-N 3.35Å; I1005-Q1008 PolarHBondContact O-N 3.29Å
1006	S	44.7	Very low	40	Very low	11 Å²	11	82.9 Å²	82.9	8%	0.077	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-56.8	-22.1	172.4	63.7	0	0	0	0	114	Y749 P1004	Y749-S1006 PolarHBondContact OH-OG 3.3Å; P1004-S1006 PolarHBondContact O-N 3.45Å
1007	S	36.8	Very low	39.5	Very low	39 Å²	39	86 Å²	86	27%	0.273	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-90.9	-14.9	175.5	72.2	0	0	0	0	114.3	P1004 I1005	P1004-S1007 WeakPolarHBondContact O-CB 3.16Å; P1004-S1007 PolarHBondContact O-N 2.96Å; P1004-S1007 PolarHBondContact O-OG 3.36Å; I1005-S1007 PolarHBondContact O-N 3.35Å
1008	Q	39.1	Very low	39	Very low	64 Å²	64	88.4 Å²	88.4	30%	0.299	46%	0.461	S	S	.	.	S	Bend	trans	-85.6	-7.5	-172.7	-64.2	-171.1	-14.4	0	0	114	T1000 R1003 I1005	T1000-Q1008 PolarHBondContact O-NE2 2.67Å; R1003-Q1008 PolarHBondContact O-NE2 3.41Å; I1005-Q1008 PolarHBondContact O-N 3.29Å
1009	G	34.4	Very low	37.9	Very low	35 Å²	35	93.1 Å²	93.1	36%	0.361	48%	0.481	S	S	.	.	S	Bend	trans	-126.6	75.6	176.6	0	0	0	0	0	111.5	R740 E1011	R740-G1009 PolarHBondContact NH2-O 3.32Å; G1009-E1011 PolarHBondContact O-N 3.39Å
1010	R	29.1	Very low	36.5	Very low	215 Å²	215	100.7 Å²	100.7	81%	0.811	51%	0.513	S	S	*	.			trans	-81.4	100.9	176.1	-83.1	-174.7	169.9	-177.5	-3.8	111.6
1011	E	23.9	Very low	34.9	Very low	99 Å²	99	105.3 Å²	105.3	46%	0.463	54%	0.542	S	S	.	.	P	Polyproline II helix		-56.9	137.1	129.2	-68.8	166.4	168.1	0	0	107	R696 G1009	R696-E1011 IonicContact NH2-OE1 3.74Å; R696-E1011 IonicContact NH2-OE2 3.32Å; R696-E1011 PolarHBondContact NH2-OE2 2.64Å; G1009-E1011 PolarHBondContact O-N 3.39Å
1012	R	22.5	Very low	33	Very low	170 Å²	170	113.3 Å²	113.3	64%	0.642	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-78.6	129.3	170	-75.2	-175.6	177.1	-178.3	-0.7	108.2
1013	P	24.1	Very low	31.4	Very low	118 Å²	118	115.9 Å²	115.9	77%	0.766	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-64.2	142	167	-17.7	31.3	0	0	0	110.5
1014	S	22.8	Very low	29.8	Very low	103 Å²	103	116.6 Å²	116.6	72%	0.72	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-72.8	150.8	159.2	53.4	0	0	0	0	109.8	H1016	S1014-H1016 PolarHBondContact O-N 3.25Å
1015	M	23.5	Very low	28.7	Very low	196 Å²	196	119.2 Å²	119.2	97%	0.966	65%	0.65	S	S	*	*	S	Bend	trans	-84	49	-167.1	-165.8	164.7	169.2	0	0	113
1016	H	27.8	Very low	27.4	Very low	147 Å²	147	122 Å²	122	68%	0.681	69%	0.687	S	S	*	*			trans	-129.8	16.9	-168.4	-108.1	-63.1	0	0	0	116	S1014	S1014-H1016 PolarHBondContact O-N 3.25Å
1017	Q	26	Very low	26.4	Very low	146 Å²	146	125.2 Å²	125.2	68%	0.682	72%	0.721	S	S	*	*	S	Bend	trans	-133.1	43.1	177.1	-66.1	-154.8	-39	0	0	114.5
1018	L	26.2	Very low	25.7	Very low	170 Å²	170	135.1 Å²	135.1	89%	0.89	75%	0.754	S	S	*	*	S	Bend	trans	-147.2	67.7	165.1	-80.2	-177.2	0	0	0	111.4
1019	D	25.7	Very low	24.9	Very low	160 Å²	160	135.8 Å²	135.8	86%	0.856	78%	0.779	S	S	*	*			trans	-165.6	75.3	145.5	-120	-21.4	0	0	0	113.6
1020	E	25.6	Very low	24.4	Very low	189 Å²	189	140.2 Å²	140.2	88%	0.883	80%	0.799	S	S	*	*	S	Bend	trans	-147.5	78.8	153.1	-87	-146.3	141.8	0	0	109.9
1021	T	25	Very low	24.1	Very low	132 Å²	132	137.7 Å²	137.7	81%	0.81	80%	0.798	S	S	*	*	S	Bend	trans	163.1	95.4	133.5	36	0	0	0	0	111.9
1022	L	25.2	Very low	24	Very low	168 Å²	168	141.4 Å²	141.4	88%	0.88	82%	0.816	S	S	*	*				173.1	83.7	122.7	-92.5	163.9	0	0	0	110.7
1023	S	22.4	Very low	24.1	Very low	115 Å²	115	138.1 Å²	138.1	80%	0.804	82%	0.819	S	S	*	*			trans	-78.4	156.9	160.9	-171.5	0	0	0	0	110.6
1024	S	24	Very low	24.1	Very low	117 Å²	117	140.1 Å²	140.1	82%	0.818	82%	0.823	S	S	*	*			trans	77.4	123.3	-174.6	78.4	0	0	0	0	116.9
1025	G	23.4	Very low	24.3	Very low	79 Å²	79	142.4 Å²	142.4	81%	0.814	83%	0.827	S	S	*	*			cis	163.1	143	-15.4	0	0	0	0	0	116.2
1026	G	23	Very low	24.4	Very low	90 Å²	90	145.3 Å²	145.3	93%	0.928	83%	0.827	S	S	*	*			trans	90.5	147.3	157.6	0	0	0	0	0	117.2
1027	G	23.2	Very low	24.3	Very low	78 Å²	78	143.4 Å²	143.4	80%	0.804	84%	0.837	S	S	*	*			trans	128.5	67.5	167.1	0	0	0	0	0	116.2
1028	Y	22.9	Very low	24.3	Very low	246 Å²	246	139.6 Å²	139.6	97%	0.965	84%	0.837	S	S	*	*			trans	-67.5	141.7	169.2	-79.5	-95.9	0	0	0	111.6
1029	G	23.1	Very low	24.3	Very low	79 Å²	79	137.9 Å²	137.9	81%	0.814	83%	0.834	S	S	*	*			trans	-161.6	92.8	176.8	0	0	0	0	0	112.5
1030	T	21.9	Very low	24.2	Very low	128 Å²	128	138.6 Å²	138.6	79%	0.785	84%	0.837	S	S	*	*			trans	-71	142.5	-178.1	49.8	0	0	0	0	113.7
1031	M	23.5	Very low	24	Very low	162 Å²	162	140.8 Å²	140.8	80%	0.798	84%	0.837	S	S	*	*				-176.8	131.7	107.3	-100.8	177.1	169.4	0	0	115.1
1032	E	22	Very low	25.1	Very low	176 Å²	176	140.2 Å²	140.2	82%	0.822	84%	0.835	S	S	*	*			trans	40.3	140.3	141	-59.3	-169.1	146.6	0	0	124.4
1033	S	24.4	Very low	25	Very low	101 Å²	101	136.7 Å²	136.7	71%	0.706	83%	0.831	S	S	*	*			trans	-72	156.9	172.9	54.5	0	0	0	0	114.6
1034	N	24.7	Very low	25	Very low	161 Å²	161	136.3 Å²	136.3	86%	0.861	83%	0.828	S	S	*	*				-160.1	148.4	113.3	-110.8	-52.6	0	0	0	114.5
1035	N	26.4	Very low	25	Very low	151 Å²	151	134.9 Å²	134.9	81%	0.807	82%	0.823	S	S	*	*			trans	-117.3	126.7	178.5	-130.4	-8.8	0	0	0	108.3
1036	R	25.7	Very low	25.1	Very low	256 Å²	256	137.3 Å²	137.3	97%	0.966	82%	0.823	S	S	*	*			trans	-166.1	156.1	151.2	-112.6	163.6	-170.8	-166.6	1.1	112.9
1037	A	26.4	Very low	25.2	Very low	107 Å²	107	137.8 Å²	137.8	88%	0.884	81%	0.811	S	S	*	*			trans	-101.1	166.4	-172.8	0	0	0	0	0	112.4
1038	G	24.5	Very low	25.3	Very low	66 Å²	66	142.2 Å²	142.2	68%	0.68	81%	0.811	S	S	*	*			trans	152.9	90.7	164.4	0	0	0	0	0	116.2
1039	T	26.2	Very low	25.4	Very low	134 Å²	134	135.9 Å²	135.9	82%	0.822	80%	0.798	S	S	*	*			trans	34.4	150	139.2	50.2	0	0	0	0	123.8
1040	L	23.7	Very low	25.5	Very low	176 Å²	176	139.8 Å²	139.8	92%	0.921	80%	0.799	S	S	*	*			trans	100	142.9	162.7	-61.2	167.1	0	0	0	118.4
1041	R	23.4	Very low	25.5	Very low	235 Å²	235	139.7 Å²	139.7	89%	0.887	79%	0.79	S	S	*	*			trans	-101.1	-177.9	172.5	-71.5	178.6	167.4	-171.7	-1.8	108.6
1042	P	46.7	Very low	25.6	Very low	119 Å²	119	141 Å²	141	77%	0.773	79%	0.786	S	S	*	*				-130.3	176.9	-53	37.8	-23.6	0	0	0	111.2
1043	A	22.7	Very low	25.8	Very low	95 Å²	95	140.9 Å²	140.9	79%	0.785	78%	0.778	S	S	*	*			trans	-171.5	145	141.9	0	0	0	0	0	115.5
1044	S	23.6	Very low	25.8	Very low	107 Å²	107	143.9 Å²	143.9	75%	0.748	78%	0.775	S	S	*	*			trans	-12.2	148.1	157.3	57.8	0	0	0	0	123.9
1045	A	24.4	Very low	25.8	Very low	87 Å²	87	142.4 Å²	142.4	72%	0.719	77%	0.767	S	S	*	*			trans	71.2	155.5	135.5	0	0	0	0	0	118.5
1046	T	25.4	Very low	25.9	Very low	130 Å²	130	144.1 Å²	144.1	80%	0.798	77%	0.77	S	S	*	*			cis	-148.7	132.5	-9.7	0.9	0	0	0	0	106
1047	S	23.5	Very low	26.1	Very low	99 Å²	99	138.2 Å²	138.2	69%	0.692	76%	0.762	S	S	*	*				68	153.7	91.4	-161.3	0	0	0	0	116.3
1048	Q	25.8	Very low	26.8	Very low	172 Å²	172	138.7 Å²	138.7	80%	0.804	76%	0.756	S	S	*	*			trans	73.5	115.7	-176.2	-52.2	-178.3	5.6	0	0	113.3
1049	T	24.8	Very low	27	Very low	113 Å²	113	145.5 Å²	145.5	69%	0.693	76%	0.761	S	S	*	*			cis	75.2	103.6	26.7	-42.8	0	0	0	0	114.4
1050	I	25	Very low	27.1	Very low	161 Å²	161	145.8 Å²	145.8	83%	0.826	76%	0.758	S	S	*	*			trans	174.6	149.1	138.1	-91.9	151.5	0	0	0	107.5
1051	Q	23	Very low	27.1	Very low	126 Å²	126	140.9 Å²	140.9	59%	0.589	75%	0.75	S	S	*	*			cis	151.3	114.9	-32.8	173.8	172.7	-40.5	0	0	109.3
1052	R	25.7	Very low	28.1	Very low	190 Å²	190	135.5 Å²	135.5	72%	0.717	75%	0.745	S	S	*	*			trans	77.5	130.7	154.2	-77.1	176.6	-176.1	-178.7	1.7	122.7
1053	R	25.6	Very low	27.3	Very low	173 Å²	173	135.5 Å²	135.5	65%	0.653	74%	0.743	S	S	*	*				96.4	159.6	119.6	-90.6	-170.8	-173.8	-179	2.8	121.7
1054	Y	24.3	Very low	27.7	Very low	163 Å²	163	141.1 Å²	141.1	64%	0.639	75%	0.745	S	S	*	*			trans	72.7	109.4	170.8	-62.9	-70.3	0	0	0	113.7
1055	D	26.1	Very low	27.9	Very low	131 Å²	131	140.6 Å²	140.6	70%	0.701	74%	0.741	S	S	*	*				83.8	125.7	56.1	-69.2	10.2	0	0	0	111.5
1056	Q	26.7	Very low	28.1	Very low	187 Å²	187	141.3 Å²	141.3	87%	0.874	74%	0.741	S	S	*	*				167.5	163.9	114	-87.9	-170.2	19.8	0	0	112
1057	V	31.7	Very low	28.2	Very low	132 Å²	132	141.5 Å²	141.5	80%	0.8	74%	0.742	S	S	*	*			trans	-128.6	132.6	-178.5	175.3	0	0	0	0	110.1
1058	P	39.5	Very low	28.5	Very low	117 Å²	117	145 Å²	145	76%	0.76	75%	0.747	S	S	*	*			trans	-133.9	169.1	137.2	24.4	-5.7	0	0	0	111.4
1059	R	29.4	Very low	28.8	Very low	209 Å²	209	145.7 Å²	145.7	79%	0.789	75%	0.748	S	S	*	*			cis	172.2	157.4	-33.6	-132.1	-168.3	-170.1	-144.8	7.8	105.9
1060	D	27.9	Very low	29.5	Very low	140 Å²	140	146.2 Å²	146.2	75%	0.749	75%	0.753	S	S	*	*			trans	75.4	150.9	159.8	-50.6	-26.4	0	0	0	119.1
1061	G	24.3	Very low	30.1	Very low	73 Å²	73	143.3 Å²	143.3	75%	0.753	75%	0.747	S	S	*	*			trans	-104.4	-154.5	-165.1	0	0	0	0	0	115.2
1062	P	44.4	Very low	31.4	Very low	122 Å²	122	142.4 Å²	142.4	79%	0.792	75%	0.752	S	S	*	*				-154.7	170.7	55.2	45.5	-25.4	0	0	0	119.5
1063	V	30.8	Very low	31.7	Very low	118 Å²	118	145.2 Å²	145.2	72%	0.715	76%	0.762	S	S	*	*			trans	70.4	119.6	130.3	159.4	0	0	0	0	124.9
1064	Y	29.1	Very low	31.9	Very low	214 Å²	214	140.8 Å²	140.8	84%	0.839	77%	0.771	S	S	*	*			trans	63.2	166.5	149.5	-80.1	-128	0	0	0	118.6
1065	S	28.6	Very low	32.2	Very low	95 Å²	95	137.2 Å²	137.2	66%	0.664	78%	0.783	S	S	*	*			cis	-179.7	158.7	-26.6	58.8	0	0	0	0	109
1066	S	28.3	Very low	32.4	Very low	102 Å²	102	134.7 Å²	134.7	71%	0.713	79%	0.789	S	S	*	*			cis	-174.1	-178.1	-16.9	57.3	0	0	0	0	109.6
1067	V	28.2	Very low	32.5	Very low	135 Å²	135	129.9 Å²	129.9	82%	0.818	79%	0.789	S	S	*	*			trans	70.5	133	175.2	-172.7	0	0	0	0	115.2
1068	Q	29.1	Very low	32.4	Very low	172 Å²	172	127.9 Å²	127.9	80%	0.804	80%	0.795	S	S	*	*			cis	100.4	100.1	22.2	-84.3	-154.6	7.2	0	0	118.5
1069	K	31.8	Very low	31.9	Very low	187 Å²	187	126.2 Å²	126.2	81%	0.813	80%	0.8	S	S	*	*			trans	68	169.4	142	-93.9	-177.9	179.7	-178.6	0	117.5
1070	P	40.3	Very low	32.1	Very low	123 Å²	123	123.8 Å²	123.8	80%	0.799	80%	0.802	S	S	*	*			cis	-136.2	179.1	25	44.7	-26.9	0	0	0	118.8
1071	S	37.3	Very low	32.4	Very low	101 Å²	101	123.6 Å²	123.6	71%	0.706	80%	0.8	S	S	*	*			trans	-102.1	167.3	158.6	-36.9	0	0	0	0	109
1072	P	50.3	Low	32.9	Very low	107 Å²	107	126.8 Å²	126.8	70%	0.695	80%	0.799	S	S	*	*				-159.8	167.2	99	40.5	-21.3	0	0	0	118.4
1073	R	33.1	Very low	32.4	Very low	248 Å²	248	127.9 Å²	127.9	94%	0.936	80%	0.799	S	S	*	*			trans	32.5	149.3	135.5	-55.9	168.4	-176.7	178.8	-0.6	121
1074	G	29.7	Very low	32.7	Very low	81 Å²	81	126.7 Å²	126.7	84%	0.835	80%	0.796	S	S	*	*			cis	147.4	163.4	-1	0	0	0	0	0	113.5
1075	G	29.9	Very low	33.1	Very low	87 Å²	87	128 Å²	128	90%	0.897	80%	0.799	S	S	*	*			trans	108.3	157.8	-177.2	0	0	0	0	0	113
1076	G	30.2	Very low	33.7	Very low	79 Å²	79	133.5 Å²	133.5	81%	0.814	83%	0.828	S	S	*	*			cis	166.7	118.6	-7.5	0	0	0	0	0	112.6
1077	G	29.3	Very low	33.9	Very low	86 Å²	86	135.1 Å²	135.1	89%	0.887	83%	0.834	S	S	*	*			trans	80.5	158.4	-172.8	0	0	0	0	0	113.2
1078	G	29.6	Very low	34.2	Very low	89 Å²	89	135.1 Å²	135.1	92%	0.918	84%	0.835	S	S	*	*			cis	129.6	85.3	-2.6	0	0	0	0	0	112.4
1079	G	29.3	Very low	34.5	Very low	83 Å²	83	133 Å²	133	86%	0.856	84%	0.837	S	S	*	*			trans	-174.1	132.3	-179.6	0	0	0	0	0	111.4
1080	N	32.4	Very low	34.7	Very low	158 Å²	158	129.8 Å²	129.8	85%	0.845	84%	0.838	S	S	*	*			trans	-97.9	177	178.7	-160.2	47.9	0	0	0	109.7
1081	I	33.6	Very low	34.3	Very low	136 Å²	136	130.3 Å²	130.3	70%	0.697	84%	0.841	S	S	*	*			trans	100.9	106.7	162.8	-58.7	163.1	0	0	0	117.1
1082	D	34.6	Very low	34.1	Very low	139 Å²	139	132.2 Å²	132.2	74%	0.743	85%	0.85	S	S	*	*			trans	54.5	153.5	131.8	-53.4	-28.5	0	0	0	126.1
1083	D	34.9	Very low	33	Very low	145 Å²	145	134 Å²	134	78%	0.775	86%	0.861	S	S	*	*			trans	75.1	102.2	146.7	-77.5	-19.9	0	0	0	123.3
1084	S	37.3	Very low	33	Very low	94 Å²	94	125.2 Å²	125.2	66%	0.657	86%	0.855	S	S	*	*				97.3	126.4	114.6	75.7	0	0	0	0	120.7
1085	W	36.3	Very low	33.2	Very low	240 Å²	240	128.9 Å²	128.9	91%	0.909	86%	0.856	S	S	*	*			trans	25.5	110	134.6	-62.5	87.3	0	0	0	119.7
1086	V	41.3	Very low	33.5	Very low	211 Å²	211	132.7 Å²	132.7	100%	1.279	85%	0.853	S	S	*	*				-130.4	0	111.2	-178.3	0	0	0	0	107.8

Retrieved 1,086 of 1,086 residues in 611.2 ms (Link to these results)

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