A0A5K4F9Q0_SCHMA Loading...

F5/8 type C domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F9Q0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,352 aa.

						>A0A5K4F9Q0_SCHMA|A0A5K4F9Q0
MPGRIIQMEKLERSQFRKIYCKCPAKSNVNSNDNKCTSRSATTILTLFYSLISLVVISDLFASYLCSSVLASSNSGVSFIQNDYDLDKTKCIQSLLVNRHQIPDSAFNATSEVVDPSGAKRYNAHSIRNENTDFAWCPGKRISTECDEYVEIDMGELNIITKVVISGLLAEGGGSRYTPYFYIRYKREINEENWRTYRQLRPTIISRLLGGLDALVPKFVVLDPPLIARWIRIYPYRDTPGFVCIRLEAYGCRFSDDLVEYRIPEGSLAHPPYQAETNLYKSQGSEVFTTEKLNSSQAGGGLPFSDTCYDGHRIEPGSLLDGGLGCLIDLNSANRDTIPSIRQTVGVSSKADSSMNHQFVGWHRDRWKSSQDKDNDVVDMLFRFASVRNFTRLRLYISNNYLEKIRLPRRLEVKFSVGGVHFSGQLPISREFKLENRSLGVFSIILDLSHRIGQVVQLKAFFADDWLLFSEIRFESEKVTTPIKIDELAMLSEKSSNHQSINEEEDLMNTKHESDANKVPSSNDTSVFDDPTTRLSTVVILVLVLLCCFLGLLAGVACFSVTWMHRKRHDLEREKHQVHKTLLIRGEDALNVCTTTGLRSNGDVNLIGSGGDGGYATVRPNMYPFLLSAAKPEIGVSTVLPNGGLQSYHQIVLSSNTSTESPNSVSNEKNSSQQQAQLRQTSQSNVGMIIGQQSNTIVNRLSGDTIGPSDGVTSETEAFCDNNNNKHNDDNDETHPHHRYSLSLFNNHQYHHNHQFRKQHSSVLSSLLCISKMKKHRRKQCSVKINNNNRTISQFDHTNNIHGNINSKEIDHITATTTTTTTTNTTNNNSNNNTEFLNTVNNFSIVNQLVSSQSGHNLGLCSTDLLNAHLRGQTSVQAANGLLQIDLSRGHPSMLINGRPLMRISASSNPSDVTDNSWLLQTGYRNNNAVCCTSSMGMNLLNSEPGVYTTVSGAESDVDSNGASTMSPEYASTSMLHDYPILAATLAQLNQQRLAATLTPSMNIQPNLYPCSNPLNIGSSSNCSVNFNILSNPPLNSPFSNNSNIINNSSTYGNINSHKNNFLISMNTIQQPLLFTNPHSMYDMMMMLTTKTTTTATAAITTSPVTKLSNGIQSSQIGLLTETHGNNNSNNHRYGVESDIVQNVFQQNNYQSQNQQIYDAYNLPTPSAPIYYPTTHQIIPSTIGQYFPCIITSTQTTGLSFISASSSGIAPHTVLSPSSSSKSNGNTMNNTATATANNNNNNLTLLGRGGHINNEYKSPKRNDVVNIEQSHKRSDVNKLDFNVKSSLTTNTCLSKSNYRVSNHNPWIKVSNSNRYGELEPAQRRQHDENLLPPTPSSPPPPLPRTITTTKHH
					

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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	30.9	Very low	30.3	Very low	241 Å²	241	159.5 Å²	159.5	100%	1.187	81%	0.805	S	S	*	*				0	157.9	0	-62	-178.1	171.6	0	0	108.3
2	P	32.9	Very low	30.1	Very low	136 Å²	136	157.6 Å²	157.6	88%	0.883	79%	0.791	S	S	*	*				-119.2	174.3	-74.6	32.4	-16	0	0	0	111.7
3	G	34.4	Very low	29.7	Very low	64 Å²	64	159.8 Å²	159.8	66%	0.66	79%	0.785	S	S	*	*			cis	153.3	158.5	-5.9	0	0	0	0	0	112.5
4	R	30.7	Very low	29.5	Very low	235 Å²	235	156.7 Å²	156.7	89%	0.887	79%	0.787	S	S	*	*			trans	70.1	152.3	-176.3	-49.2	176.4	175.3	172.6	-2.4	112.3
5	I	36.4	Very low	29.3	Very low	155 Å²	155	156.7 Å²	156.7	80%	0.795	78%	0.783	S	S	*	*			cis	-141.4	124.5	25.1	-72.2	168.2	0	0	0	106.1
6	I	30.5	Very low	29.3	Very low	128 Å²	128	159.8 Å²	159.8	66%	0.656	79%	0.791	S	S	*	*				64.1	116.6	65.7	-58.6	171.5	0	0	0	110.3
7	Q	30.3	Very low	29.1	Very low	160 Å²	160	163.5 Å²	163.5	75%	0.748	79%	0.794	S	S	*	*			cis	-171.1	175.3	44.3	-145.8	163.9	0.7	0	0	110.8
8	M	29.2	Very low	29	Very low	167 Å²	167	164.6 Å²	164.6	82%	0.823	79%	0.794	S	S	*	*			trans	60.1	118.5	166.1	-60.5	178.1	179.6	0	0	116.3
9	E	27.5	Very low	29	Very low	149 Å²	149	163.1 Å²	163.1	70%	0.696	79%	0.789	S	S	*	*			cis	79.9	99.8	26.2	-156.1	-178.6	-172.1	0	0	117.2
10	K	25.7	Very low	29.2	Very low	166 Å²	166	163.9 Å²	163.9	72%	0.722	78%	0.784	S	S	*	*			trans	63.2	157.8	147.3	-70.6	174.1	-171	148.9	0	121.9
11	L	24.9	Very low	29	Very low	153 Å²	153	162.3 Å²	162.3	80%	0.801	79%	0.789	S	S	*	*			trans	78.4	140.9	159.8	-109.1	72.4	0	0	0	117.4
12	E	27.3	Very low	29	Very low	137 Å²	137	158.9 Å²	158.9	64%	0.64	77%	0.768	S	S	*	*			trans	67.1	150	169.4	-56.4	-151.6	122.6	0	0	116.3
13	R	25.7	Very low	28.8	Very low	186 Å²	186	158 Å²	158	70%	0.702	76%	0.763	S	S	*	*			cis	-148.7	147.7	-4.6	-130.7	167.5	-150.1	164.6	15.6	110.8	Q15	R13-Q15 PolarHBondContact O-N 3.21Å
14	S	25.9	Very low	29	Very low	117 Å²	117	161 Å²	161	82%	0.818	77%	0.771	S	S	*	*			trans	-69.2	102.5	151.8	41.2	0	0	0	0	108.9
15	Q	27.5	Very low	29	Very low	156 Å²	156	154.1 Å²	154.1	73%	0.729	76%	0.764	S	S	*	*			trans	-176.1	108.5	157.9	-90	-113.4	32.6	0	0	111.2	R13	R13-Q15 PolarHBondContact O-N 3.21Å
16	F	29.7	Very low	28.9	Very low	206 Å²	206	156.5 Å²	156.5	90%	0.904	77%	0.769	S	S	*	*			trans	-159.3	68.4	139.4	-111.1	-68.1	0	0	0	110.2
17	R	25.6	Very low	29.1	Very low	223 Å²	223	154.8 Å²	154.8	84%	0.842	77%	0.769	S	S	*	*			trans	-91.2	144.5	159.8	-86.4	-174.9	170.3	-171.4	-1.8	108
18	K	26.7	Very low	29.3	Very low	184 Å²	184	154.4 Å²	154.4	80%	0.8	77%	0.772	S	S	*	*			trans	69.7	151.9	-171.1	-42.5	164.5	-175.5	176.9	0	109.3
19	I	30	Very low	29.4	Very low	135 Å²	135	151.7 Å²	151.7	69%	0.692	76%	0.764	S	S	*	*			cis	-149.3	142.5	32.8	-69.9	175.5	0	0	0	106.4
20	Y	32.8	Very low	29.8	Very low	180 Å²	180	151.5 Å²	151.5	71%	0.706	77%	0.768	S	S	*	*			cis	-137.7	157.1	0.3	-93.5	-56	0	0	0	109.5	K22	Y20-K22 HydrophobicContact CD1-CB 4.4Å; Y20-K22 HydrophobicContact CE1-CD 4.41Å
21	C	24.5	Very low	30.1	Very low	131 Å²	131	147.4 Å²	147.4	89%	0.885	76%	0.76	S	S	*	*			trans	-121	138.3	130.2	-83.7	0	0	0	0	106.7
22	K	30.5	Very low	30.6	Very low	169 Å²	169	147.1 Å²	147.1	74%	0.735	76%	0.76	S	S	*	*			trans	-146.4	97.2	-178.7	-164	-179.9	-175.6	-175.3	0	111.4	Y20	Y20-K22 HydrophobicContact CD1-CB 4.4Å; Y20-K22 HydrophobicContact CE1-CD 4.41Å
23	C	28.6	Very low	31.1	Very low	117 Å²	117	148.2 Å²	148.2	79%	0.791	77%	0.77	S	S	*	*			trans	-75.9	146.7	177.1	-46.6	0	0	0	0	111.6
24	P	38.5	Very low	31.5	Very low	126 Å²	126	147.1 Å²	147.1	82%	0.818	78%	0.778	S	S	*	*			trans	-82.2	158.7	141.6	34.8	-29.3	0	0	0	110
25	A	31.9	Very low	32	Very low	91 Å²	91	151.3 Å²	151.3	75%	0.752	78%	0.781	S	S	*	*			trans	-143.1	173.1	178.4	0	0	0	0	0	110.3
26	K	33.7	Very low	32.1	Very low	206 Å²	206	149.5 Å²	149.5	90%	0.896	78%	0.784	S	S	*	*			trans	79.8	144.7	-176.1	-58.3	-179.1	179.1	-177.4	0	113.5
27	S	33.9	Very low	32.5	Very low	92 Å²	92	146 Å²	146	64%	0.643	78%	0.78	S	S	*	*			cis	-164.3	155.6	-0.7	34.2	0	0	0	0	112.5
28	N	34.9	Very low	33.3	Very low	152 Å²	152	140 Å²	140	81%	0.813	77%	0.773	S	S	*	*			trans	67.2	155	150.2	-70.8	11.3	0	0	0	118.5
29	V	32.7	Very low	34.1	Very low	109 Å²	109	141.5 Å²	141.5	66%	0.661	77%	0.773	S	S	*	*			cis	-166	153.4	-36.6	107.9	0	0	0	0	106.9
30	N	34.3	Very low	35.1	Very low	146 Å²	146	138.7 Å²	138.7	78%	0.781	77%	0.765	S	S	*	*			trans	62.7	161.4	176.5	-69.4	-3	0	0	0	116.4
31	S	31.6	Very low	36.1	Very low	79 Å²	79	133.2 Å²	133.2	55%	0.552	76%	0.758	S	S	*	*			cis	-179.5	140	-41.6	53.5	0	0	0	0	106.8
32	N	35.6	Very low	37.9	Very low	148 Å²	148	131 Å²	131	79%	0.791	74%	0.74	S	S	*	*			trans	70.3	140.4	-178.7	-40.4	-22.6	0	0	0	112.1
33	D	39.1	Very low	39.7	Very low	159 Å²	159	126.6 Å²	126.6	85%	0.85	73%	0.727	S	S	*	*			cis	-130.5	156.3	17.6	-85.9	-54.3	0	0	0	114.2
34	N	33.9	Very low	41.8	Very low	164 Å²	164	125.6 Å²	125.6	88%	0.877	71%	0.713	S	S	*	*			trans	-97.2	121.1	175.9	-81.6	-48.4	0	0	0	112.3
35	K	35.4	Very low	43.5	Very low	204 Å²	204	124.4 Å²	124.4	89%	0.887	70%	0.7	S	S	*	*			trans	-155.4	102.2	151.2	-118.4	162.6	-171.9	172.2	0	115.4
36	C	30	Very low	45.7	Very low	118 Å²	118	124.4 Å²	124.4	80%	0.797	69%	0.69	S	S	*	*			trans	1	126.4	158.8	-54.6	0	0	0	0	121.3
37	T	38.4	Very low	47.8	Very low	132 Å²	132	119.7 Å²	119.7	81%	0.81	67%	0.674	S	S	*	*			trans	-137.2	54.4	148.8	47.2	0	0	0	0	112.1	R39	T37-R39 PolarHBondContact O-N 3.32Å
38	S	41.6	Very low	50	Low	98 Å²	98	121.9 Å²	121.9	69%	0.685	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	3.5	-173.6	53	0	0	0	0	117.1
39	R	44.3	Very low	52.3	Low	215 Å²	215	121.9 Å²	121.9	81%	0.811	66%	0.662	S	S	*	*	H	α-helix	trans	-74.9	-17.5	177.9	-81.6	-176.7	167.4	177.6	-4.4	115	T37 T42 T43	T37-R39 PolarHBondContact O-N 3.32Å; R39-T42 PolarHBondContact O-OG1 3.46Å; R39-T43 PolarHBondContact O-OG1 3.35Å
40	S	50.8	Low	54.5	Low	76 Å²	76	119.7 Å²	119.7	53%	0.531	65%	0.651	S	S	.	*	H	α-helix	trans	-70.3	-50.6	178.3	-178.7	0	0	0	0	111.6	T42 T43 I44	S40-T42 PolarHBondContact O-N 3.1Å; S40-T43 PolarHBondContact O-N 3.35Å; S40-T43 VanDerWaalsContact O-N 3.09Å; S40-I44 PolarHBondContact O-N 3.36Å
41	A	53.3	Low	56.8	Low	66 Å²	66	117.9 Å²	117.9	55%	0.545	64%	0.641	S	S	.	*	H	α-helix	trans	-60.8	-41	-174.6	0	0	0	0	0	113.3	T43 I44 L45	A41-T43 VanDerWaalsContact C-N 3.33Å; A41-T43 PolarHBondContact O-N 3.32Å; A41-I44 PolarHBondContact O-N 3.16Å; A41-L45 WeakPolarHBondContact O-CB 3.33Å; A41-L45 PolarHBondContact O-N 3.47Å
42	T	62.5	Low	59.3	Low	84 Å²	84	118.1 Å²	118.1	52%	0.515	64%	0.636	S	S	.	*	H	α-helix	trans	-62.9	-39.1	175.8	46.4	0	0	0	0	112.4	R39 S40 L45 T46	R39-T42 PolarHBondContact O-OG1 3.46Å; S40-T42 PolarHBondContact O-N 3.1Å; T42-L45 PolarHBondContact O-N 3.35Å; T42-T46 WeakPolarHBondContact O-CG2 3.24Å; T42-T46 PolarHBondContact O-N 3.39Å; T42-T46 PolarHBondContact O-OG1 3.01Å
43	T	67.9	Low	61.5	Low	76 Å²	76	114.1 Å²	114.1	47%	0.466	62%	0.619	S	S	.	*	H	α-helix	trans	-70.2	-38.4	179.8	-50	0	0	0	0	111.3	R39 S40 A41 T46 L47	R39-T43 PolarHBondContact O-OG1 3.35Å; S40-T43 PolarHBondContact O-N 3.35Å; S40-T43 VanDerWaalsContact O-N 3.09Å; A41-T43 VanDerWaalsContact C-N 3.33Å; A41-T43 PolarHBondContact O-N 3.32Å; T43-T46 PolarHBondContact O-OG1 3.27Å; T43-T46 VanDerWaalsContact O-OG1 3.14Å; T43-L47 HydrophobicContact CG2-CD1 4.38Å; T43-L47 WeakPolarHBondContact O-CB 3.47Å; T43-L47 VanDerWaalsContact O-CG 3.27Å; T43-L47 WeakPolarHBondContact O-CG 3.29Å; T43-L47 PolarHBondContact O-N 3.3Å; T43-L47 VanDerWaalsContact O-N 3.09Å
44	I	73.1	Confident	63.6	Low	97 Å²	97	111.6 Å²	111.6	50%	0.497	61%	0.605	S	S	.	*	H	α-helix	trans	-64.5	-41.9	172.9	-65.5	167.5	0	0	0	110.3	S40 A41 L47 F48	S40-I44 PolarHBondContact O-N 3.36Å; A41-I44 PolarHBondContact O-N 3.16Å; I44-L47 PolarHBondContact O-N 3.46Å; I44-F48 PolarHBondContact O-N 3.19Å
45	L	75.2	Confident	65.9	Low	101 Å²	101	107.7 Å²	107.7	53%	0.529	59%	0.587	S	S	.	*	H	α-helix	trans	-65	-44.7	178.7	-132.9	75.1	0	0	0	112.6	A41 T42 F48 Y49	A41-L45 WeakPolarHBondContact O-CB 3.33Å; A41-L45 PolarHBondContact O-N 3.47Å; T42-L45 PolarHBondContact O-N 3.35Å; L45-F48 WeakPolarHBondContact O-CB 3.41Å; L45-F48 PolarHBondContact O-N 3.31Å; L45-Y49 HydrophobicContact CD2-CE2 4.02Å; L45-Y49 HydrophobicContact CG-CD2 4.32Å; L45-Y49 HydrophobicContact CG-CE2 3.98Å; L45-Y49 VanDerWaalsContact O-CD2 3.24Å; L45-Y49 WeakPolarHBondContact O-CD2 3.36Å; L45-Y49 PolarHBondContact O-N 3.38Å
46	T	77.1	Confident	68.2	Low	91 Å²	91	101.6 Å²	101.6	56%	0.558	57%	0.567	S	S	*	*	H	α-helix	trans	-66.9	-35.7	178.3	52.2	0	0	0	0	112.3	T42 T43 S50	T42-T46 WeakPolarHBondContact O-CG2 3.24Å; T42-T46 PolarHBondContact O-N 3.39Å; T42-T46 PolarHBondContact O-OG1 3.01Å; T43-T46 PolarHBondContact O-OG1 3.27Å; T43-T46 VanDerWaalsContact O-OG1 3.14Å; T46-S50 VanDerWaalsContact O-CB 3.23Å; T46-S50 WeakPolarHBondContact O-CB 3.45Å; T46-S50 PolarHBondContact O-N 3.48Å
47	L	78.3	Confident	70.7	Confident	106 Å²	106	100.4 Å²	100.4	56%	0.555	55%	0.552	S	S	*	*	H	α-helix	trans	-63.2	-40.5	170.3	-72.2	170	0	0	0	111.7	T43 I44 S50 L51	T43-L47 HydrophobicContact CG2-CD1 4.38Å; T43-L47 WeakPolarHBondContact O-CB 3.47Å; T43-L47 VanDerWaalsContact O-CG 3.27Å; T43-L47 WeakPolarHBondContact O-CG 3.29Å; T43-L47 PolarHBondContact O-N 3.3Å; T43-L47 VanDerWaalsContact O-N 3.09Å; I44-L47 PolarHBondContact O-N 3.46Å; L47-S50 PolarHBondContact O-N 2.98Å; L47-L51 WeakPolarHBondContact O-CB 3.3Å; L47-L51 WeakPolarHBondContact O-CG 3.5Å; L47-L51 PolarHBondContact O-N 2.95Å
48	F	80.2	Confident	72.7	Confident	138 Å²	138	97.2 Å²	97.2	61%	0.605	53%	0.534	S	S	*	.	H	α-helix	trans	-63.8	-46.3	176.4	-129.6	-88.4	0	0	0	112.4	I44 L45 L51 I52	I44-F48 PolarHBondContact O-N 3.19Å; L45-F48 WeakPolarHBondContact O-CB 3.41Å; L45-F48 PolarHBondContact O-N 3.31Å; F48-L51 PolarHBondContact O-N 3.34Å; F48-I52 HydrophobicContact CD1-CD1 3.98Å; F48-I52 WeakPolarHBondContact O-CG1 3.48Å; F48-I52 PolarHBondContact O-N 3.42Å
49	Y	83.4	Confident	74.4	Confident	153 Å²	153	97.3 Å²	97.3	60%	0.6	53%	0.527	S	S	*	.	H	α-helix	trans	-67.5	-33	175.7	-78.2	-66.5	0	0	0	113.2	L45 S53	L45-Y49 HydrophobicContact CD2-CE2 4.02Å; L45-Y49 HydrophobicContact CG-CD2 4.32Å; L45-Y49 HydrophobicContact CG-CE2 3.98Å; L45-Y49 VanDerWaalsContact O-CD2 3.24Å; L45-Y49 WeakPolarHBondContact O-CD2 3.36Å; L45-Y49 PolarHBondContact O-N 3.38Å; Y49-S53 WeakPolarHBondContact O-CB 3.4Å; Y49-S53 PolarHBondContact O-N 2.89Å; Y49-S53 PolarHBondContact O-OG 2.92Å
50	S	79.3	Confident	76.1	Confident	62 Å²	62	92.3 Å²	92.3	43%	0.434	52%	0.516	S	S	.	.	H	α-helix	trans	-65.8	-44.7	173.7	-175	0	0	0	0	111.2	T46 L47 S53 L54	T46-S50 VanDerWaalsContact O-CB 3.23Å; T46-S50 WeakPolarHBondContact O-CB 3.45Å; T46-S50 PolarHBondContact O-N 3.48Å; L47-S50 PolarHBondContact O-N 2.98Å; S50-S53 PolarHBondContact O-N 3.47Å; S50-L54 WeakPolarHBondContact O-CB 3.34Å; S50-L54 WeakPolarHBondContact O-CG 3.42Å; S50-L54 PolarHBondContact O-N 2.9Å
51	L	82.1	Confident	77.4	Confident	108 Å²	108	95 Å²	95	57%	0.565	52%	0.519	S	S	*	.	H	α-helix	trans	-62.4	-45.7	174.9	-76.5	166.2	0	0	0	112.2	L47 F48 S53 L54 V55	L47-L51 WeakPolarHBondContact O-CB 3.3Å; L47-L51 WeakPolarHBondContact O-CG 3.5Å; L47-L51 PolarHBondContact O-N 2.95Å; F48-L51 PolarHBondContact O-N 3.34Å; L51-S53 VanDerWaalsContact C-N 3.33Å; L51-S53 PolarHBondContact O-N 3.2Å; L51-L54 PolarHBondContact O-N 3.33Å; L51-V55 WeakPolarHBondContact O-CG2 3.31Å; L51-V55 PolarHBondContact O-N 2.98Å
52	I	83.8	Confident	78.5	Confident	85 Å²	85	94.5 Å²	94.5	44%	0.436	51%	0.514	S	S	.	.	H	α-helix	trans	-60.6	-43.6	175.3	-69.1	166.1	0	0	0	110.9	F48 L54 V55 V56	F48-I52 HydrophobicContact CD1-CD1 3.98Å; F48-I52 WeakPolarHBondContact O-CG1 3.48Å; F48-I52 PolarHBondContact O-N 3.42Å; I52-L54 PolarHBondContact O-N 2.93Å; I52-V55 PolarHBondContact O-N 2.7Å; I52-V56 HydrophobicContact CG2-CG2 4.5Å; I52-V56 WeakPolarHBondContact O-CG2 3.35Å; I52-V56 PolarHBondContact O-N 2.91Å
53	S	82.5	Confident	79.1	Confident	64 Å²	64	93.3 Å²	93.3	45%	0.448	51%	0.509	S	S	.	.	H	α-helix	trans	-62.4	-41.6	176.8	-57.5	0	0	0	0	112	Y49 S50 L51 V56 I57	Y49-S53 WeakPolarHBondContact O-CB 3.4Å; Y49-S53 PolarHBondContact O-N 2.89Å; Y49-S53 PolarHBondContact O-OG 2.92Å; S50-S53 PolarHBondContact O-N 3.47Å; L51-S53 VanDerWaalsContact C-N 3.33Å; L51-S53 PolarHBondContact O-N 3.2Å; S53-V56 PolarHBondContact O-N 3.4Å; S53-I57 WeakPolarHBondContact O-CB 3.43Å; S53-I57 WeakPolarHBondContact O-CD1 3.39Å; S53-I57 WeakPolarHBondContact O-CG1 3.43Å; S53-I57 PolarHBondContact O-N 2.91Å
54	L	82	Confident	79.4	Confident	105 Å²	105	97.6 Å²	97.6	55%	0.55	52%	0.518	S	S	.	.	H	α-helix	trans	-64.1	-40.3	175.9	-79.6	165.5	0	0	0	112.3	S50 L51 I52 S58	S50-L54 WeakPolarHBondContact O-CB 3.34Å; S50-L54 WeakPolarHBondContact O-CG 3.42Å; S50-L54 PolarHBondContact O-N 2.9Å; L51-L54 PolarHBondContact O-N 3.33Å; I52-L54 PolarHBondContact O-N 2.93Å; L54-S58 WeakPolarHBondContact O-CB 3.5Å; L54-S58 PolarHBondContact O-N 3.42Å; L54-S58 PolarHBondContact O-OG 2.9Å
55	V	83.5	Confident	79.2	Confident	82 Å²	82	97.5 Å²	97.5	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-62.5	-51	174.5	171.8	0	0	0	0	110.4	L51 I52 I57 S58 D59	L51-V55 WeakPolarHBondContact O-CG2 3.31Å; L51-V55 PolarHBondContact O-N 2.98Å; I52-V55 PolarHBondContact O-N 2.7Å; V55-I57 VanDerWaalsContact C-N 3.34Å; V55-I57 PolarHBondContact O-N 3.36Å; V55-S58 CarbonylContact O-C 3.56Å; V55-S58 WeakPolarHBondContact O-CA 3.32Å; V55-S58 WeakPolarHBondContact O-CB 3.36Å; V55-S58 PolarHBondContact O-N 2.92Å; V55-S58 PolarHBondContact O-OG 3.37Å; V55-D59 PolarHBondContact O-N 2.96Å
56	V	83.4	Confident	78.8	Confident	76 Å²	76	96 Å²	96	46%	0.461	52%	0.515	S	S	.	.	H	α-helix	trans	-61.4	-40.5	178.9	172.9	0	0	0	0	111.9	I52 S53 S58 D59 L60	I52-V56 HydrophobicContact CG2-CG2 4.5Å; I52-V56 WeakPolarHBondContact O-CG2 3.35Å; I52-V56 PolarHBondContact O-N 2.91Å; S53-V56 PolarHBondContact O-N 3.4Å; V56-S58 VanDerWaalsContact C-N 3.32Å; V56-S58 PolarHBondContact O-N 3.35Å; V56-D59 PolarHBondContact O-N 3.35Å; V56-L60 HydrophobicContact CG1-CD1 3.99Å; V56-L60 HydrophobicContact CG1-CG 4.49Å; V56-L60 WeakPolarHBondContact O-CB 3.33Å; V56-L60 VanDerWaalsContact O-CG 3.26Å; V56-L60 WeakPolarHBondContact O-CG 3.31Å; V56-L60 PolarHBondContact O-N 3.32Å
57	I	82.4	Confident	78.2	Confident	94 Å²	94	95.2 Å²	95.2	48%	0.482	51%	0.513	S	S	.	.	H	α-helix	trans	-63.7	-38.5	173.3	-70.5	164.9	0	0	0	110.7	S53 V55 L60 F61	S53-I57 WeakPolarHBondContact O-CB 3.43Å; S53-I57 WeakPolarHBondContact O-CD1 3.39Å; S53-I57 WeakPolarHBondContact O-CG1 3.43Å; S53-I57 PolarHBondContact O-N 2.91Å; V55-I57 VanDerWaalsContact C-N 3.34Å; V55-I57 PolarHBondContact O-N 3.36Å; I57-L60 PolarHBondContact O-N 3.44Å; I57-F61 WeakPolarHBondContact O-CB 3.47Å; I57-F61 PolarHBondContact O-N 2.94Å
58	S	79.7	Confident	77.2	Confident	64 Å²	64	92.4 Å²	92.4	45%	0.448	50%	0.503	S	S	.	.	H	α-helix	trans	-68.7	-37.1	177.3	76.4	0	0	0	0	113	L54 V55 V56 F61 A62	L54-S58 WeakPolarHBondContact O-CB 3.5Å; L54-S58 PolarHBondContact O-N 3.42Å; L54-S58 PolarHBondContact O-OG 2.9Å; V55-S58 CarbonylContact O-C 3.56Å; V55-S58 WeakPolarHBondContact O-CA 3.32Å; V55-S58 WeakPolarHBondContact O-CB 3.36Å; V55-S58 PolarHBondContact O-N 2.92Å; V55-S58 PolarHBondContact O-OG 3.37Å; V56-S58 VanDerWaalsContact C-N 3.32Å; V56-S58 PolarHBondContact O-N 3.35Å; S58-F61 PolarHBondContact O-N 2.97Å; S58-A62 WeakPolarHBondContact O-CB 3.5Å; S58-A62 PolarHBondContact O-N 3.39Å
59	D	78.5	Confident	75.8	Confident	101 Å²	101	90 Å²	90	54%	0.54	50%	0.499	S	S	.	.	H	α-helix	trans	-70.4	-35.7	173.6	-76.6	-39.5	0	0	0	111.8	V55 V56 A62 S63	V55-D59 PolarHBondContact O-N 2.96Å; V56-D59 PolarHBondContact O-N 3.35Å; D59-A62 PolarHBondContact O-N 3.39Å; D59-S63 VanDerWaalsContact O-CB 3.29Å; D59-S63 WeakPolarHBondContact O-CB 3.29Å; D59-S63 PolarHBondContact O-N 3.38Å; D59-S63 PolarHBondContact O-OG 3.39Å
60	L	79	Confident	74.1	Confident	109 Å²	109	87.2 Å²	87.2	57%	0.571	49%	0.494	S	S	*	.	H	α-helix	trans	-66.7	-41.4	171.6	-73.5	169.6	0	0	0	111.7	V56 I57 S63 Y64	V56-L60 HydrophobicContact CG1-CD1 3.99Å; V56-L60 HydrophobicContact CG1-CG 4.49Å; V56-L60 WeakPolarHBondContact O-CB 3.33Å; V56-L60 VanDerWaalsContact O-CG 3.26Å; V56-L60 WeakPolarHBondContact O-CG 3.31Å; V56-L60 PolarHBondContact O-N 3.32Å; I57-L60 PolarHBondContact O-N 3.44Å; L60-S63 WeakPolarHBondContact CA-OG 3.29Å; L60-S63 PolarHBondContact O-OG 2.94Å; L60-Y64 VanDerWaalsContact O-CB 3.25Å; L60-Y64 WeakPolarHBondContact O-CB 3.47Å; L60-Y64 PolarHBondContact O-N 3.39Å
61	F	78.2	Confident	72.5	Confident	134 Å²	134	87.6 Å²	87.6	59%	0.588	50%	0.501	S	S	*	.	H	α-helix	trans	-67.5	-40.9	173.4	-116.9	-87	0	0	0	111.9	I57 S58 Y64 L65	I57-F61 WeakPolarHBondContact O-CB 3.47Å; I57-F61 PolarHBondContact O-N 2.94Å; S58-F61 PolarHBondContact O-N 2.97Å; F61-Y64 PolarHBondContact O-N 3.46Å; F61-L65 HydrophobicContact CD1-CD1 4.14Å; F61-L65 HydrophobicContact CD1-CG 4.38Å; F61-L65 VanDerWaalsContact O-CB 3.22Å; F61-L65 WeakPolarHBondContact O-CB 3.37Å; F61-L65 WeakPolarHBondContact O-CG 3.4Å; F61-L65 PolarHBondContact O-N 3.46Å
62	A	75.9	Confident	70.8	Confident	55 Å²	55	86.2 Å²	86.2	46%	0.455	50%	0.501	S	S	.	.	H	α-helix	trans	-66.3	-38.6	177.4	0	0	0	0	0	111.9	S58 D59 C66	S58-A62 WeakPolarHBondContact O-CB 3.5Å; S58-A62 PolarHBondContact O-N 3.39Å; D59-A62 PolarHBondContact O-N 3.39Å; A62-C66 WeakPolarHBondContact O-CB 3.39Å; A62-C66 PolarHBondContact O-N 2.93Å
63	S	74.7	Confident	68.7	Low	58 Å²	58	85.5 Å²	85.5	41%	0.406	50%	0.503	S	S	.	.	H	α-helix	trans	-74.8	-33.3	175	55.1	0	0	0	0	112.9	D59 L60 S67	D59-S63 VanDerWaalsContact O-CB 3.29Å; D59-S63 WeakPolarHBondContact O-CB 3.29Å; D59-S63 PolarHBondContact O-N 3.38Å; D59-S63 PolarHBondContact O-OG 3.39Å; L60-S63 WeakPolarHBondContact CA-OG 3.29Å; L60-S63 PolarHBondContact O-OG 2.94Å; S63-S67 VanDerWaalsContact O-CB 3.26Å; S63-S67 WeakPolarHBondContact O-CB 3.34Å; S63-S67 PolarHBondContact O-N 3.26Å; S63-S67 PolarHBondContact O-OG 2.91Å
64	Y	74.7	Confident	66.6	Low	167 Å²	167	88.4 Å²	88.4	66%	0.655	51%	0.513	S	S	*	.	H	α-helix	trans	-69	-40.7	170.8	-172.1	-95.2	0	0	0	112.2	L60 F61 S67 S68	L60-Y64 VanDerWaalsContact O-CB 3.25Å; L60-Y64 WeakPolarHBondContact O-CB 3.47Å; L60-Y64 PolarHBondContact O-N 3.39Å; F61-Y64 PolarHBondContact O-N 3.46Å; Y64-S67 PolarHBondContact O-N 2.94Å; Y64-S68 WeakPolarHBondContact O-CB 3.29Å; Y64-S68 PolarHBondContact O-N 3.39Å; Y64-S68 PolarHBondContact O-OG 2.94Å
65	L	70.2	Confident	64.5	Low	94 Å²	94	87.7 Å²	87.7	49%	0.492	52%	0.517	S	S	.	.	H	α-helix	trans	-65.8	-41.9	171.9	-74.5	169.7	0	0	0	111.4	F61 S67 S68 V69	F61-L65 HydrophobicContact CD1-CD1 4.14Å; F61-L65 HydrophobicContact CD1-CG 4.38Å; F61-L65 VanDerWaalsContact O-CB 3.22Å; F61-L65 WeakPolarHBondContact O-CB 3.37Å; F61-L65 WeakPolarHBondContact O-CG 3.4Å; F61-L65 PolarHBondContact O-N 3.46Å; L65-S67 VanDerWaalsContact C-N 3.34Å; L65-S67 PolarHBondContact O-N 3.3Å; L65-S68 WeakPolarHBondContact CA-OG 3.16Å; L65-S68 PolarHBondContact O-N 3.28Å; L65-S68 PolarHBondContact O-OG 2.93Å; L65-V69 VanDerWaalsContact O-CB 3.25Å; L65-V69 WeakPolarHBondContact O-CB 3.48Å; L65-V69 WeakPolarHBondContact O-CG2 3.47Å; L65-V69 PolarHBondContact O-N 3.48Å
66	C	65.6	Low	62.1	Low	70 Å²	70	86 Å²	86	47%	0.473	52%	0.516	S	S	.	.	H	α-helix	trans	-62.5	-42.4	173.6	-168.4	0	0	0	0	111.1	A62 V69 L70	A62-C66 WeakPolarHBondContact O-CB 3.39Å; A62-C66 PolarHBondContact O-N 2.93Å; C66-V69 PolarHBondContact O-N 3.28Å; C66-L70 VanDerWaalsContact O-CB 3.28Å; C66-L70 WeakPolarHBondContact O-CB 3.34Å; C66-L70 WeakPolarHBondContact O-CG 3.44Å; C66-L70 PolarHBondContact O-N 3.44Å
67	S	64.1	Low	59.9	Low	74 Å²	74	86 Å²	86	52%	0.517	52%	0.517	S	S	.	.	H	α-helix	trans	-65.2	-39.9	177.3	-60	0	0	0	0	112.6	S63 Y64 L65 A71	S63-S67 VanDerWaalsContact O-CB 3.26Å; S63-S67 WeakPolarHBondContact O-CB 3.34Å; S63-S67 PolarHBondContact O-N 3.26Å; S63-S67 PolarHBondContact O-OG 2.91Å; Y64-S67 PolarHBondContact O-N 2.94Å; L65-S67 VanDerWaalsContact C-N 3.34Å; L65-S67 PolarHBondContact O-N 3.3Å; S67-A71 VanDerWaalsContact O-CB 3.29Å; S67-A71 WeakPolarHBondContact O-CB 3.49Å; S67-A71 PolarHBondContact O-N 3.45Å
68	S	58.3	Low	57.6	Low	48 Å²	48	84.8 Å²	84.8	34%	0.336	52%	0.516	S	S	.	.	H	α-helix	trans	-78.1	-29.1	177.5	51.3	0	0	0	0	113.3	Y64 L65 S72	Y64-S68 WeakPolarHBondContact O-CB 3.29Å; Y64-S68 PolarHBondContact O-N 3.39Å; Y64-S68 PolarHBondContact O-OG 2.94Å; L65-S68 WeakPolarHBondContact CA-OG 3.16Å; L65-S68 PolarHBondContact O-N 3.28Å; L65-S68 PolarHBondContact O-OG 2.93Å; S68-S72 WeakPolarHBondContact O-CB 3.42Å; S68-S72 PolarHBondContact O-N 3.34Å; S68-S72 PolarHBondContact O-OG 2.62Å
69	V	51.6	Low	55.6	Low	87 Å²	87	85.7 Å²	85.7	53%	0.527	51%	0.512	S	S	.	.	H	α-helix	trans	-70.3	-39	168.1	169.7	0	0	0	0	110.9	L65 C66 S72 S73	L65-V69 VanDerWaalsContact O-CB 3.25Å; L65-V69 WeakPolarHBondContact O-CB 3.48Å; L65-V69 WeakPolarHBondContact O-CG2 3.47Å; L65-V69 PolarHBondContact O-N 3.48Å; C66-V69 PolarHBondContact O-N 3.28Å; V69-S72 WeakPolarHBondContact CA-OG 3.16Å; V69-S72 PolarHBondContact O-OG 2.88Å; V69-S73 VanDerWaalsContact O-CB 3.26Å; V69-S73 WeakPolarHBondContact O-CB 3.38Å; V69-S73 PolarHBondContact O-N 3.29Å; V69-S73 PolarHBondContact O-OG 2.81Å
70	L	46	Very low	53.7	Low	94 Å²	94	86.2 Å²	86.2	49%	0.492	51%	0.514	S	S	.	.	H	α-helix	trans	-65.8	-42.6	171.3	-74.9	166.2	0	0	0	111.3	C66 S72 S73 N74	C66-L70 VanDerWaalsContact O-CB 3.28Å; C66-L70 WeakPolarHBondContact O-CB 3.34Å; C66-L70 WeakPolarHBondContact O-CG 3.44Å; C66-L70 PolarHBondContact O-N 3.44Å; L70-S72 PolarHBondContact O-N 3.42Å; L70-S73 PolarHBondContact O-OG 3.46Å; L70-N74 VanDerWaalsContact O-CB 3.22Å; L70-N74 WeakPolarHBondContact O-CB 3.49Å; L70-N74 PolarHBondContact O-N 2.85Å; L70-N74 PolarHBondContact O-ND2 3.28Å
71	A	46.7	Very low	51.7	Low	71 Å²	71	86.1 Å²	86.1	59%	0.587	51%	0.511	S	S	*	.	H	α-helix	trans	-63.7	-40.6	176.1	0	0	0	0	0	112.9	S67	S67-A71 VanDerWaalsContact O-CB 3.29Å; S67-A71 WeakPolarHBondContact O-CB 3.49Å; S67-A71 PolarHBondContact O-N 3.45Å
72	S	45.2	Very low	49.6	Very low	79 Å²	79	87 Å²	87	55%	0.552	52%	0.521	S	S	*	.	H	α-helix	trans	-79	-30.8	179.2	53.5	0	0	0	0	113.8	S68 V69 L70 S75	S68-S72 WeakPolarHBondContact O-CB 3.42Å; S68-S72 PolarHBondContact O-N 3.34Å; S68-S72 PolarHBondContact O-OG 2.62Å; V69-S72 WeakPolarHBondContact CA-OG 3.16Å; V69-S72 PolarHBondContact O-OG 2.88Å; L70-S72 PolarHBondContact O-N 3.42Å; S72-S75 PolarHBondContact O-OG 3.44Å
73	S	40.7	Very low	47.7	Very low	69 Å²	69	88 Å²	88	48%	0.483	52%	0.519	S	S	.	.	H	α-helix	trans	-77.1	-19.7	171.4	59.3	0	0	0	0	113.6	V69 L70 S75 G76	V69-S73 VanDerWaalsContact O-CB 3.26Å; V69-S73 WeakPolarHBondContact O-CB 3.38Å; V69-S73 PolarHBondContact O-N 3.29Å; V69-S73 PolarHBondContact O-OG 2.81Å; L70-S73 PolarHBondContact O-OG 3.46Å; S73-S75 PolarHBondContact O-N 3.37Å; S73-G76 PolarHBondContact O-N 2.69Å
74	N	37.7	Very low	46	Very low	125 Å²	125	89.2 Å²	89.2	67%	0.668	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	19.5	169.4	-78.1	-17.5	0	0	0	114.6	L70 G76	L70-N74 VanDerWaalsContact O-CB 3.22Å; L70-N74 WeakPolarHBondContact O-CB 3.49Å; L70-N74 PolarHBondContact O-N 2.85Å; L70-N74 PolarHBondContact O-ND2 3.28Å; N74-G76 PolarHBondContact O-N 3.46Å
75	S	37.9	Very low	44.7	Very low	90 Å²	90	86 Å²	86	63%	0.629	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-4.4	156.7	50.4	0	0	0	0	113.1	S72 S73	S72-S75 PolarHBondContact O-OG 3.44Å; S73-S75 PolarHBondContact O-N 3.37Å
76	G	34.6	Very low	43.3	Very low	47 Å²	47	86.1 Å²	86.1	49%	0.485	51%	0.51	S	S	.	.	S	Bend	trans	-53.3	146.3	169.4	0	0	0	0	0	113.2	S73 N74 S78	S73-G76 PolarHBondContact O-N 2.69Å; N74-G76 PolarHBondContact O-N 3.46Å; G76-S78 PolarHBondContact O-N 3.37Å; G76-S78 VanDerWaalsContact O-N 3.15Å
77	V	36.6	Very low	42.7	Very low	77 Å²	77	86 Å²	86	47%	0.467	51%	0.505	S	S	.	.			trans	-75.4	109.6	-177.1	-171.5	0	0	0	0	109.8	F79	V77-F79 HydrophobicContact CB-CD2 4.04Å; V77-F79 HydrophobicContact CB-CE1 4.25Å; V77-F79 HydrophobicContact CB-CE2 3.73Å; V77-F79 HydrophobicContact CB-CG 4.45Å; V77-F79 HydrophobicContact CB-CZ 3.84Å; V77-F79 HydrophobicContact CG1-CD1 3.64Å; V77-F79 HydrophobicContact CG1-CD2 3.98Å; V77-F79 HydrophobicContact CG1-CE1 3.48Å; V77-F79 VanDerWaalsContact CG1-CE1 3.48Å; V77-F79 HydrophobicContact CG1-CE2 3.85Å; V77-F79 HydrophobicContact CG1-CG 3.89Å; V77-F79 HydrophobicContact CG1-CZ 3.6Å; V77-F79 HydrophobicContact CG2-CE2 4.48Å; V77-F79 HydrophobicContact CG2-CZ 4.32Å; V77-F79 PolarHBondContact O-N 3.38Å
78	S	35	Very low	42.2	Very low	67 Å²	67	86.8 Å²	86.8	47%	0.469	50%	0.499	S	S	.	.			trans	-67.7	77.6	163.8	42.5	0	0	0	0	110.1	G76 I80	G76-S78 PolarHBondContact O-N 3.37Å; G76-S78 VanDerWaalsContact O-N 3.15Å; S78-I80 PolarHBondContact O-N 3.26Å
79	F	36.1	Very low	42.2	Very low	84 Å²	84	88.3 Å²	88.3	37%	0.368	51%	0.506	S	S	.	.			trans	-68.2	75.9	165.1	-62.9	-66.5	0	0	0	109	V77 Q81 F442	V77-F79 HydrophobicContact CB-CD2 4.04Å; V77-F79 HydrophobicContact CB-CE1 4.25Å; V77-F79 HydrophobicContact CB-CE2 3.73Å; V77-F79 HydrophobicContact CB-CG 4.45Å; V77-F79 HydrophobicContact CB-CZ 3.84Å; V77-F79 HydrophobicContact CG1-CD1 3.64Å; V77-F79 HydrophobicContact CG1-CD2 3.98Å; V77-F79 HydrophobicContact CG1-CE1 3.48Å; V77-F79 VanDerWaalsContact CG1-CE1 3.48Å; V77-F79 HydrophobicContact CG1-CE2 3.85Å; V77-F79 HydrophobicContact CG1-CG 3.89Å; V77-F79 HydrophobicContact CG1-CZ 3.6Å; V77-F79 HydrophobicContact CG2-CE2 4.48Å; V77-F79 HydrophobicContact CG2-CZ 4.32Å; V77-F79 PolarHBondContact O-N 3.38Å; F79-Q81 PolarHBondContact O-N 2.9Å; F79-F442 HydrophobicContact CD1-CD1 4.25Å; F79-F442 HydrophobicContact CD1-CE1 4.47Å; F79-F442 AromaticContact CE1-CD1 3.73Å; F79-F442 HydrophobicContact CE1-CD1 3.73Å; F79-F442 AromaticContact CE1-CE1 3.77Å; F79-F442 HydrophobicContact CE1-CE1 3.77Å; F79-F442 HydrophobicContact CZ-CE1 4.47Å
80	I	39	Very low	43	Very low	112 Å²	112	89.3 Å²	89.3	57%	0.574	50%	0.503	S	S	*	.			trans	-64.5	109.3	177.8	-59.6	-173.2	0	0	0	108	S78 I445	S78-I80 PolarHBondContact O-N 3.26Å; I80-I445 HydrophobicContact CD1-CD1 4.1Å
81	Q	37	Very low	45	Very low	107 Å²	107	84.9 Å²	84.9	50%	0.5	48%	0.48	S	S	.	.			trans	-73	141	163.7	-72.5	174.7	-106.1	0	0	108.5	F79 H1079	F79-Q81 PolarHBondContact O-N 2.9Å; Q81-H1079 PolarHBondContact OE1-CE1 2.7Å; Q81-H1079 VanDerWaalsContact OE1-CE1 3.27Å; Q81-H1079 PolarHBondContact OE1-ND1 2.86Å
82	N	33.4	Very low	46.9	Very low	151 Å²	151	86.3 Å²	86.3	81%	0.807	48%	0.477	S	S	*	.			trans	72.8	65.4	166.8	-49.6	-1.5	0	0	0	116.4
83	D	37.4	Very low	49	Very low	76 Å²	76	87.9 Å²	87.9	41%	0.406	48%	0.476	S	S	.	.			trans	-139.2	47.7	149.9	-161.9	24	0	0	0	110.5	R394	D83-R394 IonicContact OD2-CZ 3.6Å; D83-R394 IonicContact OD2-NH1 3.46Å; D83-R394 PolarHBondContact OD2-NH1 2.83Å; D83-R394 IonicContact OD2-NH2 3.88Å; D83-R394 PolarHBondContact OD2-NH2 2.99Å
84	Y	38.2	Very low	51.3	Low	84 Å²	84	85.3 Å²	85.3	33%	0.329	46%	0.458	S	S	.	.	S	Bend	trans	-94.5	145.2	172.5	-107.8	-91.9	0	0	0	109.8	L86 A333 R335 Y396	Y84-L86 VanDerWaalsContact C-N 3.27Å; Y84-L86 PolarHBondContact O-N 3.21Å; Y84-A333 PolarHBondContact OH-O 3.1Å; Y84-R335 HydrophobicContact CE2-CB 4.33Å; Y84-R335 PolarHBondContact OH-N 2.79Å; Y84-Y396 HydrophobicContact CE2-CE1 4.45Å
85	D	46.7	Very low	53.8	Low	99 Å²	99	79.5 Å²	79.5	53%	0.529	43%	0.427	S	S	.	.	S	Bend	trans	64.1	1.9	163.3	-151.4	34.7	0	0	0	119.3	D87 T89	D85-D87 PolarHBondContact O-N 3.46Å; D85-T89 WeakPolarHBondContact O-CG2 3.44Å; D85-T89 PolarHBondContact O-OG1 3.39Å
86	L	41.1	Very low	56.1	Low	97 Å²	97	75.2 Å²	75.2	51%	0.508	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-11.2	175.2	-173.4	57	0	0	0	114.1	Y84 K90	Y84-L86 VanDerWaalsContact C-N 3.27Å; Y84-L86 PolarHBondContact O-N 3.21Å; L86-K90 WeakPolarHBondContact O-CD 3.48Å; L86-K90 WeakPolarHBondContact O-CE 3.37Å; L86-K90 VanDerWaalsContact O-CG 3.3Å; L86-K90 WeakPolarHBondContact O-CG 3.36Å
87	D	52.9	Low	57.9	Low	69 Å²	69	75.9 Å²	75.9	37%	0.369	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-45.2	-174.1	-170.6	53.3	0	0	0	112.8	D85 T89 K90 C91 R473	D85-D87 PolarHBondContact O-N 3.46Å; D87-T89 PolarHBondContact O-N 3.45Å; D87-K90 WeakPolarHBondContact O-CA 3.42Å; D87-K90 WeakPolarHBondContact O-CB 3.39Å; D87-K90 PolarHBondContact O-N 3.44Å; D87-C91 PolarHBondContact O-N 3.26Å; D87-R473 IonicContact OD2-CZ 3.91Å; D87-R473 IonicContact OD2-NH1 2.71Å; D87-R473 PolarHBondContact OD2-NH1 3.01Å; D87-R473 IonicContact OD2-NH2 2.82Å
88	K	54.4	Low	59.2	Low	89 Å²	89	78.3 Å²	78.3	39%	0.387	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-35.2	176	-162.8	168.2	-169	146.8	0	111.9	K90 L330 N331	K88-K90 VanDerWaalsContact C-N 3.28Å; K88-K90 PolarHBondContact O-N 2.9Å; K88-L330 PolarHBondContact NZ-O 2.95Å; K88-N331 PolarHBondContact NZ-OD1 2.78Å
89	T	58.1	Low	60.2	Low	81 Å²	81	78.9 Å²	78.9	50%	0.497	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-14.5	173.2	50.6	0	0	0	0	114.6	D85 D87	D85-T89 WeakPolarHBondContact O-CG2 3.44Å; D85-T89 PolarHBondContact O-OG1 3.39Å; D87-T89 PolarHBondContact O-N 3.45Å
90	K	68.7	Low	61	Low	107 Å²	107	84.8 Å²	84.8	47%	0.465	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-18.4	176.8	-69.5	175.7	-172.9	166.8	0	114.1	L86 D87 K88 I92 Q93	L86-K90 WeakPolarHBondContact O-CD 3.48Å; L86-K90 WeakPolarHBondContact O-CE 3.37Å; L86-K90 VanDerWaalsContact O-CG 3.3Å; L86-K90 WeakPolarHBondContact O-CG 3.36Å; D87-K90 WeakPolarHBondContact O-CA 3.42Å; D87-K90 WeakPolarHBondContact O-CB 3.39Å; D87-K90 PolarHBondContact O-N 3.44Å; K88-K90 VanDerWaalsContact C-N 3.28Å; K88-K90 PolarHBondContact O-N 2.9Å; K90-I92 PolarHBondContact O-N 2.97Å; K90-Q93 PolarHBondContact O-NE2 2.97Å
91	C	86.9	Confident	62	Low	1 Å²	1	87.8 Å²	87.8	1%	0.007	43%	0.434	C	S	.	.			trans	-83.6	49.3	-175.9	-157.6	0	0	0	0	113.3	D87 T161 G251 C252 L330	D87-C91 PolarHBondContact O-N 3.26Å; C91-T161 HydrophobicContact CB-CG2 4.29Å; C91-T161 WeakPolarHBondContact O-CG2 3.29Å; C91-T161 PolarHBondContact O-OG1 3.2Å; C91-G251 CarbonylContact C-O 3.51Å; C91-G251 VanDerWaalsContact C-O 3.24Å; C91-G251 WeakPolarHBondContact O-CA 3.1Å; C91-G251 VanDerWaalsContact SG-C 3.52Å; C91-C252 HydrophobicContact CB-CB 3.88Å; C91-C252 WeakPolarHBondContact CB-SG 3.23Å; C91-C252 WeakPolarHBondContact SG-CB 3.41Å; C91-C252 PolarHBondContact SG-N 2.99Å; C91-C252 CovalentContact SG-SG 2.05Å; C91-C252 PolarHBondContact SG-SG 3.2Å; C91-L330 HydrophobicContact CB-CD1 4.25Å
92	I	87.4	Confident	64	Low	101 Å²	101	83.5 Å²	83.5	52%	0.518	41%	0.414	S	S	.	.			trans	-134.5	24.7	-178.8	59.8	169.5	0	0	0	112.2	K90 G251	K90-I92 PolarHBondContact O-N 2.97Å; I92-G251 PolarHBondContact N-O 3.37Å
93	Q	88.8	Confident	66.5	Low	113 Å²	113	79.6 Å²	79.6	53%	0.528	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	144.3	179.5	-65.6	161.5	55.5	0	0	110.3	K90 Y250 G251	K90-Q93 PolarHBondContact O-NE2 2.97Å; Q93-Y250 CarbonylContact O-C 3.56Å; Q93-Y250 VanDerWaalsContact O-CA 3.26Å; Q93-Y250 WeakPolarHBondContact O-CA 3.32Å; Q93-G251 PolarHBondContact N-O 3.31Å; Q93-G251 PolarHBondContact O-N 3.41Å
94	S	89.9	Confident	68.7	Low	15 Å²	15	80.8 Å²	80.8	11%	0.105	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	133.3	170.3	152.8	0	0	0	0	110.3	V97 N98 E248	S94-V97 PolarHBondContact OG-N 3.37Å; S94-N98 WeakPolarHBondContact CB-ND2 3.46Å; S94-N98 PolarHBondContact OG-N 2.83Å; S94-N98 VanDerWaalsContact OG-N 3.17Å; S94-N98 PolarHBondContact OG-ND2 3.16Å; S94-E248 VanDerWaalsContact CA-OE1 3.27Å; S94-E248 WeakPolarHBondContact CA-OE1 3.36Å; S94-E248 WeakPolarHBondContact CB-OE1 3.4Å; S94-E248 PolarHBondContact OG-OE1 2.89Å
95	L	89.5	Confident	71	Confident	3 Å²	3	82.2 Å²	82.2	2%	0.016	43%	0.425	C	S	.	.	S	Bend	trans	-101.6	-28.6	-176.4	-61.9	176.2	0	0	0	112.7	I102 M154 N158 I160 E248 A249	L95-I102 WeakPolarHBondContact O-CD1 3.46Å; L95-M154 HydrophobicContact CD1-SD 4.23Å; L95-N158 HydrophobicContact CD1-CB 4.3Å; L95-I160 HydrophobicContact CD1-CG1 4Å; L95-E248 PolarHBondContact N-OE1 2.87Å; L95-A249 HydrophobicContact CB-CB 4.34Å; L95-A249 VanDerWaalsContact CB-O 3.28Å; L95-A249 WeakPolarHBondContact CB-O 3.4Å; L95-A249 HydrophobicContact CD1-CB 4.27Å; L95-A249 WeakPolarHBondContact CG-O 3.5Å; L95-A249 PolarHBondContact N-O 2.87Å
96	L	86.1	Confident	73.1	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	41%	0.405	C	S	.	.	S	Bend	trans	-101.8	-27.6	-172.8	-47.3	179.9	0	0	0	113.9	I102 R128 I152 M154 L247 E248 A249	L96-I102 HydrophobicContact CD2-CD1 4.45Å; L96-R128 HydrophobicContact CB-CB 4.15Å; L96-R128 WeakPolarHBondContact O-CD 3.27Å; L96-R128 PolarHBondContact O-NH1 3.24Å; L96-I152 HydrophobicContact CD1-CD1 3.93Å; L96-I152 HydrophobicContact CD2-CG2 3.95Å; L96-M154 HydrophobicContact CD2-CG 4.37Å; L96-L247 HydrophobicContact CD1-CD2 4.14Å; L96-L247 HydrophobicContact CD1-CG 4.45Å; L96-E248 WeakPolarHBondContact CB-OE2 3.48Å; L96-E248 PolarHBondContact N-OE1 3.31Å; L96-E248 VanDerWaalsContact N-OE1 3.15Å; L96-A249 HydrophobicContact CD1-CB 4.21Å; L96-A249 HydrophobicContact CG-CB 4.14Å
97	V	73	Confident	75.5	Confident	60 Å²	60	74.2 Å²	74.2	36%	0.364	38%	0.384	S	S	.	.	S	Bend	trans	-96.6	-51.7	177	172.6	0	0	0	0	112.6	S94 R99 E248	S94-V97 PolarHBondContact OG-N 3.37Å; V97-R99 VanDerWaalsContact C-N 3.26Å; V97-R99 PolarHBondContact O-N 3.09Å; V97-E248 WeakPolarHBondContact CG2-OE2 3.48Å
98	N	63.4	Low	77.5	Confident	128 Å²	128	75.3 Å²	75.3	68%	0.684	39%	0.39	S	S	*	.	S	Bend	trans	-82.4	31.4	-166	-83.6	-72.4	0	0	0	116.5	S94	S94-N98 WeakPolarHBondContact CB-ND2 3.46Å; S94-N98 PolarHBondContact OG-N 2.83Å; S94-N98 VanDerWaalsContact OG-N 3.17Å; S94-N98 PolarHBondContact OG-ND2 3.16Å
99	R	56.8	Low	79.4	Confident	79 Å²	79	72 Å²	72	30%	0.298	38%	0.379	S	S	.	.			trans	-133.6	128.6	169.6	-57.6	-166.1	-166.3	-163.3	18	111	V97 Q101 E156 N158	V97-R99 VanDerWaalsContact C-N 3.26Å; V97-R99 PolarHBondContact O-N 3.09Å; R99-Q101 PolarHBondContact O-N 3.07Å; R99-E156 IonicContact CZ-OE1 2.79Å; R99-E156 IonicContact NH1-OE1 3.7Å; R99-E156 PolarHBondContact NH1-OE1 2.75Å; R99-E156 IonicContact NH2-OE1 2.7Å; R99-N158 PolarHBondContact NH2-OD1 3.47Å
100	H	51.9	Low	81.1	Confident	208 Å²	208	70.7 Å²	70.7	96%	0.963	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	26.1	-178.5	-56.5	-64.4	0	0	0	115.1
101	Q	61	Low	82.2	Confident	176 Å²	176	67.1 Å²	67.1	82%	0.822	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-153.7	1.7	-156.3	-108.8	166.1	7.5	0	0	117.6	R99 P103	R99-Q101 PolarHBondContact O-N 3.07Å; Q101-P103 VanDerWaalsContact O-CD 3.23Å; Q101-P103 WeakPolarHBondContact O-CD 3.46Å
102	I	79.1	Confident	82.4	Confident	16 Å²	16	69.7 Å²	69.7	8%	0.082	37%	0.372	C	S	.	.			trans	-91.2	104.4	169.9	-58.5	-176.9	0	0	0	108.6	L95 L96 A106 F107 R128	L95-I102 WeakPolarHBondContact O-CD1 3.46Å; L96-I102 HydrophobicContact CD2-CD1 4.45Å; I102-A106 HydrophobicContact CG2-CB 3.64Å; I102-F107 HydrophobicContact CG2-CE2 3.62Å; I102-F107 HydrophobicContact CG2-CZ 3.99Å; I102-R128 PolarHBondContact O-NH1 3.14Å; I102-R128 PolarHBondContact O-NH2 3.09Å
103	P	85.3	Confident	82.3	Confident	69 Å²	69	66.2 Å²	66.2	45%	0.448	36%	0.355	S	S	.	.			trans	-75.2	167.7	-176.2	34.8	-38.5	0	0	0	111.6	Q101 S105 A106	Q101-P103 VanDerWaalsContact O-CD 3.23Å; Q101-P103 WeakPolarHBondContact O-CD 3.46Å; P103-S105 WeakPolarHBondContact CG-OG 3.39Å; P103-S105 PolarHBondContact O-N 2.94Å; P103-A106 HydrophobicContact CG-CB 4.22Å; P103-A106 WeakPolarHBondContact O-CB 3.19Å; P103-A106 PolarHBondContact O-N 3.47Å
104	D	82.7	Confident	81.7	Confident	102 Å²	102	64.8 Å²	64.8	55%	0.545	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-64.9	-30.3	-180	-56.3	-15.1	0	0	0	111.9	A106 F107 H125 R128	D104-A106 PolarHBondContact O-N 2.97Å; D104-A106 VanDerWaalsContact O-N 3.12Å; D104-F107 PolarHBondContact O-N 3.09Å; D104-F107 VanDerWaalsContact O-N 3.1Å; D104-H125 VanDerWaalsContact CG-ND1 3.28Å; D104-H125 IonicContact OD1-CE1 3.19Å; D104-H125 PolarHBondContact OD1-CE1 3.15Å; D104-H125 IonicContact OD1-CG 3.24Å; D104-H125 IonicContact OD1-ND1 3.65Å; D104-H125 PolarHBondContact OD1-ND1 3.17Å; D104-H125 IonicContact OD2-ND1 3.51Å; D104-R128 IonicContact OD1-NH2 3.39Å; D104-R128 PolarHBondContact OD1-NH2 3.47Å
105	S	87.7	Confident	80.8	Confident	113 Å²	113	64.8 Å²	64.8	79%	0.79	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-66.9	-4	173	63.7	0	0	0	0	114.8	P103	P103-S105 WeakPolarHBondContact CG-OG 3.39Å; P103-S105 PolarHBondContact O-N 2.94Å
106	A	90.5	Very high	79.9	Confident	13 Å²	13	71.1 Å²	71.1	11%	0.107	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-88.1	-9.8	172.1	0	0	0	0	0	113.1	I102 P103 D104 I152 D153	I102-A106 HydrophobicContact CG2-CB 3.64Å; P103-A106 HydrophobicContact CG-CB 4.22Å; P103-A106 WeakPolarHBondContact O-CB 3.19Å; P103-A106 PolarHBondContact O-N 3.47Å; D104-A106 PolarHBondContact O-N 2.97Å; D104-A106 VanDerWaalsContact O-N 3.12Å; A106-I152 WeakPolarHBondContact O-CA 3.4Å; A106-D153 HydrophobicContact CB-CB 4.43Å; A106-D153 WeakPolarHBondContact CB-O 3.49Å; A106-D153 PolarHBondContact O-N 2.87Å
107	F	91.6	Very high	79	Confident	15 Å²	15	74.8 Å²	74.8	7%	0.066	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126.5	177.8	-61.8	-92.6	0	0	0	109.6	I102 D104 A124 I127 R128 I152	I102-F107 HydrophobicContact CG2-CE2 3.62Å; I102-F107 HydrophobicContact CG2-CZ 3.99Å; D104-F107 PolarHBondContact O-N 3.09Å; D104-F107 VanDerWaalsContact O-N 3.1Å; F107-A124 HydrophobicContact CB-CB 4.12Å; F107-I127 HydrophobicContact CD1-CG2 3.59Å; F107-I127 HydrophobicContact CE1-CG2 3.62Å; F107-R128 HydrophobicContact CE1-CG 4.38Å; F107-R128 VanDerWaalsContact CE2-CZ 3.45Å; F107-R128 HydrophobicContact CZ-CG 4.06Å; F107-I152 HydrophobicContact CD1-CD1 4.34Å; F107-I152 HydrophobicContact CD1-CG1 3.94Å; F107-I152 HydrophobicContact CD1-CG2 4.29Å; F107-I152 HydrophobicContact CE1-CD1 4.09Å; F107-I152 HydrophobicContact CE1-CG1 4.09Å; F107-I152 HydrophobicContact CE1-CG2 3.93Å; F107-I152 HydrophobicContact CZ-CG2 4.4Å
108	N	93.8	Very high	78.5	Confident	92 Å²	92	74.6 Å²	74.6	49%	0.492	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	157.7	-179.6	-171.6	19.7	0	0	0	109.9	V150 E151	N108-V150 CarbonylContact O-C 2.89Å; N108-V150 WeakPolarHBondContact O-CA 3.32Å; N108-V150 WeakPolarHBondContact O-CG2 3.43Å; N108-E151 HydrophobicContact CB-CB 4.4Å; N108-E151 PolarHBondContact N-O 3.46Å; N108-E151 PolarHBondContact O-N 2.88Å
109	A	94.4	Very high	78.6	Confident	20 Å²	20	70 Å²	70	17%	0.165	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	158.2	178.3	0	0	0	0	0	112	A124 W136 Y149 V150	A109-A124 HydrophobicContact CB-CB 3.99Å; A109-W136 HydrophobicContact CB-CZ2 4.09Å; A109-Y149 WeakPolarHBondContact CA-O 3.23Å; A109-V150 HydrophobicContact CB-CB 4.46Å
110	T	94.2	Very high	79.1	Confident	54 Å²	54	72.1 Å²	72.1	33%	0.331	42%	0.421	S	S	.	.	S	Bend	trans	-64.4	-40.9	173	43.2	0	0	0	0	112.9	E148 Y149	T110-E148 VanDerWaalsContact CB-OE2 3.32Å; T110-E148 WeakPolarHBondContact CB-OE2 3.45Å; T110-E148 VanDerWaalsContact OG1-CA 3.31Å; T110-E148 WeakPolarHBondContact OG1-CA 3.34Å; T110-E148 PolarHBondContact OG1-OE2 2.97Å; T110-Y149 HydrophobicContact CG2-CD1 3.28Å; T110-Y149 HydrophobicContact CG2-CD2 4.22Å; T110-Y149 HydrophobicContact CG2-CE1 3.14Å; T110-Y149 HydrophobicContact CG2-CE2 4.1Å; T110-Y149 HydrophobicContact CG2-CG 3.84Å; T110-Y149 PolarHBondContact N-O 3.48Å; T110-Y149 PolarHBondContact OG1-N 3.31Å; T110-Y149 PolarHBondContact OG1-O 3.48Å
111	S	92.7	Very high	80.1	Confident	32 Å²	32	66.8 Å²	66.8	22%	0.224	39%	0.392	C	S	.	.			trans	-155.5	162.9	176.7	70	0	0	0	0	111.1	W136 G139 E148	S111-W136 PolarHBondContact O-NE1 2.78Å; S111-G139 PolarHBondContact OG-N 3.44Å; S111-E148 WeakPolarHBondContact CB-OE2 3.36Å; S111-E148 PolarHBondContact OG-OE2 3.43Å
112	E	89.9	Confident	81.1	Confident	54 Å²	54	58.7 Å²	58.7	25%	0.252	36%	0.355	S	S	.	.			trans	-134.4	138.9	177.2	-58.7	-178.9	139.9	0	0	108.9	V114 K120 N123 A124 C137	E112-V114 PolarHBondContact O-N 2.82Å; E112-K120 WeakPolarHBondContact OE2-CE 3.45Å; E112-K120 IonicContact OE2-NZ 2.68Å; E112-K120 PolarHBondContact OE2-NZ 2.89Å; E112-N123 WeakPolarHBondContact OE1-CA 3.5Å; E112-N123 VanDerWaalsContact OE1-CB 3.29Å; E112-N123 WeakPolarHBondContact OE1-CB 3.35Å; E112-A124 PolarHBondContact OE1-N 3.4Å; E112-C137 CarbonylContact C-O 3.59Å
113	V	85.3	Confident	81.3	Confident	28 Å²	28	60 Å²	60	17%	0.17	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-70.2	122.2	166.1	176.8	0	0	0	0	109.1	Y122 C137 P138	V113-Y122 HydrophobicContact CB-CD2 3.88Å; V113-Y122 HydrophobicContact CG1-CD2 3.83Å; V113-Y122 HydrophobicContact CG1-CE2 4.28Å; V113-C137 HydrophobicContact CB-CB 4.09Å; V113-C137 HydrophobicContact CG2-CB 3.72Å; V113-C137 PolarHBondContact N-O 2.7Å; V113-P138 WeakPolarHBondContact CG2-O 3.25Å
114	V	77.8	Confident	81.2	Confident	84 Å²	84	57 Å²	57	51%	0.509	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-88.9	133.1	166.4	-174.9	0	0	0	0	108.3	E112	E112-V114 PolarHBondContact O-N 2.82Å
115	D	70.7	Confident	81.2	Confident	15 Å²	15	55.3 Å²	55.3	8%	0.08	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-66.3	153.8	175.2	-73.7	-67.9	0	0	0	111.6	S117 G118 A119 R121 Y122	D115-S117 VanDerWaalsContact CB-OG 3.25Å; D115-S117 WeakPolarHBondContact CB-OG 3.41Å; D115-S117 PolarHBondContact O-N 2.99Å; D115-G118 PolarHBondContact O-N 3.34Å; D115-A119 HydrophobicContact CB-CB 4.24Å; D115-A119 WeakPolarHBondContact CB-O 3.47Å; D115-A119 PolarHBondContact N-O 2.92Å; D115-R121 WeakPolarHBondContact OD2-CB 3.35Å; D115-R121 WeakPolarHBondContact OD2-CD 3.24Å; D115-R121 WeakPolarHBondContact OD2-CG 3.23Å; D115-R121 PolarHBondContact OD2-N 2.92Å; D115-Y122 WeakPolarHBondContact OD1-CE2 3.5Å; D115-Y122 PolarHBondContact OD1-OH 2.93Å; D115-Y122 VanDerWaalsContact OD1-OH 3.04Å
116	P	70.2	Confident	81	Confident	135 Å²	135	50.1 Å²	50.1	88%	0.877	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-16.7	168.3	-24.6	35	0	0	0	114.4	G118	P116-G118 VanDerWaalsContact C-N 3.31Å
117	S	67.1	Low	80.9	Confident	78 Å²	78	49.5 Å²	49.5	55%	0.545	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-2.8	172.5	60.3	0	0	0	0	114.1	D115 A119	D115-S117 VanDerWaalsContact CB-OG 3.25Å; D115-S117 WeakPolarHBondContact CB-OG 3.41Å; D115-S117 PolarHBondContact O-N 2.99Å; S117-A119 PolarHBondContact O-N 3.3Å; S117-A119 WeakPolarHBondContact OG-CB 3.49Å; S117-A119 PolarHBondContact OG-N 3Å
118	G	63.3	Low	80.5	Confident	56 Å²	56	50.7 Å²	50.7	58%	0.577	29%	0.294	S	S	*	.	S	Bend	trans	76.7	-1.7	-170.7	0	0	0	0	0	114.3	D115 P116	D115-G118 PolarHBondContact O-N 3.34Å; P116-G118 VanDerWaalsContact C-N 3.31Å
119	A	63.9	Low	79.8	Confident	32 Å²	32	49 Å²	49	26%	0.264	29%	0.285	S	S	.	.			trans	-71.2	146.7	176.7	0	0	0	0	0	111.7	D115 S117 R121	D115-A119 HydrophobicContact CB-CB 4.24Å; D115-A119 WeakPolarHBondContact CB-O 3.47Å; D115-A119 PolarHBondContact N-O 2.92Å; S117-A119 PolarHBondContact O-N 3.3Å; S117-A119 WeakPolarHBondContact OG-CB 3.49Å; S117-A119 PolarHBondContact OG-N 3Å; A119-R121 HydrophobicContact CB-CG 4.06Å
120	K	68.7	Low	78.8	Confident	122 Å²	122	55.7 Å²	55.7	53%	0.53	31%	0.312	S	S	.	.			trans	-98	57.7	169.2	-73.2	-165.3	165.3	-148	0	110.8	E112 Y122 N123	E112-K120 WeakPolarHBondContact OE2-CE 3.45Å; E112-K120 IonicContact OE2-NZ 2.68Å; E112-K120 PolarHBondContact OE2-NZ 2.89Å; K120-Y122 PolarHBondContact O-N 3.43Å; K120-N123 HydrophobicContact CB-CB 4.42Å; K120-N123 PolarHBondContact O-ND2 3.12Å
121	R	73.3	Confident	77.8	Confident	96 Å²	96	56 Å²	56	36%	0.362	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-18.5	177.1	-64.8	177.6	174.7	174.7	-0.6	112.7	D115 A119 F134 E171	D115-R121 WeakPolarHBondContact OD2-CB 3.35Å; D115-R121 WeakPolarHBondContact OD2-CD 3.24Å; D115-R121 WeakPolarHBondContact OD2-CG 3.23Å; D115-R121 PolarHBondContact OD2-N 2.92Å; A119-R121 HydrophobicContact CB-CG 4.06Å; R121-F134 HydrophobicContact CB-CD1 4.46Å; R121-F134 HydrophobicContact CB-CE1 4.43Å; R121-F134 HydrophobicContact CG-CE1 4.42Å; R121-F134 WeakPolarHBondContact O-CD1 3.44Å; R121-E171 IonicContact CZ-OE1 3.76Å; R121-E171 VanDerWaalsContact NH1-CD 3.29Å; R121-E171 IonicContact NH1-OE1 2.64Å; R121-E171 PolarHBondContact NH1-OE1 3.39Å; R121-E171 IonicContact NH1-OE2 3.28Å; R121-E171 PolarHBondContact NH1-OE2 2.66Å
122	Y	80.6	Confident	76.9	Confident	7 Å²	7	57.6 Å²	57.6	3%	0.027	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	34.8	-174.3	-42.5	-52.6	0	0	0	115	V113 D115 K120 A135 C137 L168 E171	V113-Y122 HydrophobicContact CB-CD2 3.88Å; V113-Y122 HydrophobicContact CG1-CD2 3.83Å; V113-Y122 HydrophobicContact CG1-CE2 4.28Å; D115-Y122 WeakPolarHBondContact OD1-CE2 3.5Å; D115-Y122 PolarHBondContact OD1-OH 2.93Å; D115-Y122 VanDerWaalsContact OD1-OH 3.04Å; K120-Y122 PolarHBondContact O-N 3.43Å; Y122-A135 CarbonylContact C-O 3.18Å; Y122-A135 WeakPolarHBondContact CA-O 3.22Å; Y122-A135 VanDerWaalsContact CB-O 3.22Å; Y122-A135 WeakPolarHBondContact CB-O 3.29Å; Y122-C137 HydrophobicContact CG-CB 4.23Å; Y122-C137 PolarHBondContact O-N 2.88Å; Y122-L168 HydrophobicContact CD1-CD1 4.47Å; Y122-L168 HydrophobicContact CD1-CD2 3.73Å; Y122-L168 HydrophobicContact CE1-CD1 4.17Å; Y122-L168 HydrophobicContact CE1-CD2 3.33Å; Y122-L168 HydrophobicContact CE1-CG 4.39Å; Y122-E171 PolarHBondContact OH-OE1 3.09Å
123	N	83.3	Confident	76.3	Confident	44 Å²	44	59.4 Å²	59.4	24%	0.235	33%	0.332	C	S	.	.			trans	-71	164.8	-179.2	63.8	47.7	0	0	0	113.7	E112 K120 H125 S126	E112-N123 WeakPolarHBondContact OE1-CA 3.5Å; E112-N123 VanDerWaalsContact OE1-CB 3.29Å; E112-N123 WeakPolarHBondContact OE1-CB 3.35Å; K120-N123 HydrophobicContact CB-CB 4.42Å; K120-N123 PolarHBondContact O-ND2 3.12Å; N123-H125 VanDerWaalsContact C-N 3.32Å; N123-H125 PolarHBondContact O-N 3.25Å; N123-H125 WeakPolarHBondContact OD1-CB 3.26Å; N123-H125 PolarHBondContact OD1-N 3.2Å; N123-S126 VanDerWaalsContact O-CB 3.3Å; N123-S126 WeakPolarHBondContact O-CB 3.32Å; N123-S126 PolarHBondContact O-N 3.01Å; N123-S126 WeakPolarHBondContact OD1-CB 3.22Å; N123-S126 PolarHBondContact OD1-N 3.17Å; N123-S126 PolarHBondContact OD1-OG 3.39Å
124	A	83.1	Confident	76.3	Confident	5 Å²	5	61.3 Å²	61.3	4%	0.041	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-58.6	-36.9	-179.9	0	0	0	0	0	113.9	F107 A109 E112 S126 I127 V150	F107-A124 HydrophobicContact CB-CB 4.12Å; A109-A124 HydrophobicContact CB-CB 3.99Å; E112-A124 PolarHBondContact OE1-N 3.4Å; A124-S126 VanDerWaalsContact C-N 3.27Å; A124-S126 PolarHBondContact O-N 3.45Å; A124-I127 WeakPolarHBondContact O-CB 3.2Å; A124-I127 VanDerWaalsContact O-CG2 3.22Å; A124-I127 WeakPolarHBondContact O-CG2 3.25Å; A124-I127 PolarHBondContact O-N 2.98Å; A124-V150 HydrophobicContact CB-CG2 4.29Å
125	H	82.6	Confident	76.9	Confident	66 Å²	66	57.3 Å²	57.3	31%	0.306	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-60.6	-35.7	174.9	166.9	118.7	0	0	0	112	D104 N123 I127 R128	D104-H125 VanDerWaalsContact CG-ND1 3.28Å; D104-H125 IonicContact OD1-CE1 3.19Å; D104-H125 PolarHBondContact OD1-CE1 3.15Å; D104-H125 IonicContact OD1-CG 3.24Å; D104-H125 IonicContact OD1-ND1 3.65Å; D104-H125 PolarHBondContact OD1-ND1 3.17Å; D104-H125 IonicContact OD2-ND1 3.51Å; N123-H125 VanDerWaalsContact C-N 3.32Å; N123-H125 PolarHBondContact O-N 3.25Å; N123-H125 WeakPolarHBondContact OD1-CB 3.26Å; N123-H125 PolarHBondContact OD1-N 3.2Å; H125-I127 PolarHBondContact O-N 3.34Å; H125-R128 PolarHBondContact CE1-NH2 3.33Å; H125-R128 PolarHBondContact ND1-NH2 3.04Å; H125-R128 WeakPolarHBondContact O-CG 3.22Å; H125-R128 PolarHBondContact O-N 3.41Å
126	S	84.8	Confident	77.9	Confident	4 Å²	4	56.6 Å²	56.6	3%	0.028	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-63.3	-10	-176.4	-62	0	0	0	0	113.3	N123 A124 R128 N129	N123-S126 VanDerWaalsContact O-CB 3.3Å; N123-S126 WeakPolarHBondContact O-CB 3.32Å; N123-S126 PolarHBondContact O-N 3.01Å; N123-S126 WeakPolarHBondContact OD1-CB 3.22Å; N123-S126 PolarHBondContact OD1-N 3.17Å; N123-S126 PolarHBondContact OD1-OG 3.39Å; A124-S126 VanDerWaalsContact C-N 3.27Å; A124-S126 PolarHBondContact O-N 3.45Å; S126-R128 VanDerWaalsContact C-N 3.25Å; S126-R128 PolarHBondContact O-N 2.82Å; S126-N129 WeakPolarHBondContact O-CB 3.46Å; S126-N129 PolarHBondContact O-N 2.98Å
127	I	87	Confident	79	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-55.5	-37.6	173.9	-152.2	-168.9	0	0	0	112.7	F107 A124 H125 N129 W136 V150 I152 I245 R246 L247	F107-I127 HydrophobicContact CD1-CG2 3.59Å; F107-I127 HydrophobicContact CE1-CG2 3.62Å; A124-I127 WeakPolarHBondContact O-CB 3.2Å; A124-I127 VanDerWaalsContact O-CG2 3.22Å; A124-I127 WeakPolarHBondContact O-CG2 3.25Å; A124-I127 PolarHBondContact O-N 2.98Å; H125-I127 PolarHBondContact O-N 3.34Å; I127-N129 VanDerWaalsContact C-N 3.35Å; I127-N129 PolarHBondContact O-N 3.02Å; I127-W136 HydrophobicContact CB-CB 4.38Å; I127-W136 HydrophobicContact CG1-CB 4.49Å; I127-V150 HydrophobicContact CD1-CB 4.35Å; I127-V150 HydrophobicContact CD1-CG1 3.47Å; I127-V150 VanDerWaalsContact CD1-CG1 3.47Å; I127-V150 HydrophobicContact CD1-CG2 3.96Å; I127-I152 HydrophobicContact CD1-CD1 4.17Å; I127-I152 HydrophobicContact CG2-CD1 4.35Å; I127-I245 HydrophobicContact CD1-CG2 3.95Å; I127-I245 HydrophobicContact CG1-CG2 3.82Å; I127-R246 CarbonylContact O-C 3.31Å; I127-R246 WeakPolarHBondContact O-CA 3.46Å; I127-R246 WeakPolarHBondContact O-CB 3.45Å; I127-L247 HydrophobicContact CD1-CB 3.47Å; I127-L247 VanDerWaalsContact CD1-CB 3.47Å; I127-L247 HydrophobicContact CD1-CD2 3.99Å; I127-L247 HydrophobicContact CD1-CG 4.37Å; I127-L247 HydrophobicContact CG1-CB 3.65Å; I127-L247 PolarHBondContact O-N 2.96Å
128	R	84.2	Confident	80.3	Confident	41 Å²	41	46.6 Å²	46.6	16%	0.155	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-89.5	8.8	-178.2	62.1	161.8	168.1	-159.9	-6.6	114.5	L96 I102 D104 F107 H125 S126	L96-R128 HydrophobicContact CB-CB 4.15Å; L96-R128 WeakPolarHBondContact O-CD 3.27Å; L96-R128 PolarHBondContact O-NH1 3.24Å; I102-R128 PolarHBondContact O-NH1 3.14Å; I102-R128 PolarHBondContact O-NH2 3.09Å; D104-R128 IonicContact OD1-NH2 3.39Å; D104-R128 PolarHBondContact OD1-NH2 3.47Å; F107-R128 HydrophobicContact CE1-CG 4.38Å; F107-R128 VanDerWaalsContact CE2-CZ 3.45Å; F107-R128 HydrophobicContact CZ-CG 4.06Å; H125-R128 PolarHBondContact CE1-NH2 3.33Å; H125-R128 PolarHBondContact ND1-NH2 3.04Å; H125-R128 WeakPolarHBondContact O-CG 3.22Å; H125-R128 PolarHBondContact O-N 3.41Å; S126-R128 VanDerWaalsContact C-N 3.25Å; S126-R128 PolarHBondContact O-N 2.82Å
129	N	78	Confident	81.5	Confident	55 Å²	55	45.8 Å²	45.8	29%	0.294	24%	0.235	S	C	.	.			trans	-84	127.9	-174.4	-163.3	-16.5	0	0	0	111	S126 I127 N131 F134 R246	S126-N129 WeakPolarHBondContact O-CB 3.46Å; S126-N129 PolarHBondContact O-N 2.98Å; I127-N129 VanDerWaalsContact C-N 3.35Å; I127-N129 PolarHBondContact O-N 3.02Å; N129-N131 VanDerWaalsContact C-N 3.28Å; N129-N131 WeakPolarHBondContact OD1-CB 3.15Å; N129-N131 PolarHBondContact OD1-N 3.15Å; N129-F134 HydrophobicContact CB-CB 4.2Å; N129-F134 WeakPolarHBondContact ND2-CB 3.28Å; N129-R246 WeakPolarHBondContact O-CD 3.24Å
130	E	73.8	Confident	82.8	Confident	161 Å²	161	47.7 Å²	47.7	75%	0.752	24%	0.237	S	C	*	.			trans	-72.7	-22.4	174.9	-63.3	-170.7	163.1	0	0	112.4	R246	E130-R246 PolarHBondContact O-NH1 3.27Å; E130-R246 VanDerWaalsContact O-NH1 3.16Å
131	N	74.4	Confident	83.9	Confident	62 Å²	62	49.1 Å²	49.1	33%	0.332	24%	0.239	S	C	.	.	S	Bend	trans	-60	146.8	178.7	-167.3	16.7	0	0	0	111.8	N129 D133 F134 R246	N129-N131 VanDerWaalsContact C-N 3.28Å; N129-N131 WeakPolarHBondContact OD1-CB 3.15Å; N129-N131 PolarHBondContact OD1-N 3.15Å; N131-D133 VanDerWaalsContact C-N 3.26Å; N131-D133 PolarHBondContact ND2-OD2 2.65Å; N131-D133 PolarHBondContact O-N 2.9Å; N131-D133 PolarHBondContact OD1-OD2 3.42Å; N131-F134 HydrophobicContact CB-CD2 4.25Å; N131-F134 WeakPolarHBondContact ND2-CD2 3.22Å; N131-R246 PolarHBondContact O-NH1 2.78Å
132	T	72	Confident	84.9	Confident	65 Å²	65	45 Å²	45	40%	0.399	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-21.1	179.2	41.2	0	0	0	0	114.1	L168 L215	T132-L168 WeakPolarHBondContact O-CD1 3.39Å; T132-L215 HydrophobicContact CG2-CD2 4.5Å
133	D	78.8	Confident	85.4	Confident	92 Å²	92	45.8 Å²	45.8	49%	0.492	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-2.1	-163.9	-37.5	-29.7	0	0	0	113	N131 L168	N131-D133 VanDerWaalsContact C-N 3.26Å; N131-D133 PolarHBondContact ND2-OD2 2.65Å; N131-D133 PolarHBondContact O-N 2.9Å; N131-D133 PolarHBondContact OD1-OD2 3.42Å; D133-L168 VanDerWaalsContact C-CD1 3.5Å
134	F	85	Confident	85.7	Confident	68 Å²	68	46.5 Å²	46.5	30%	0.298	24%	0.237	S	C	.	.			trans	-132.9	130.8	-175	-66	-93.6	0	0	0	110.1	R121 N129 N131 R246	R121-F134 HydrophobicContact CB-CD1 4.46Å; R121-F134 HydrophobicContact CB-CE1 4.43Å; R121-F134 HydrophobicContact CG-CE1 4.42Å; R121-F134 WeakPolarHBondContact O-CD1 3.44Å; N129-F134 HydrophobicContact CB-CB 4.2Å; N129-F134 WeakPolarHBondContact ND2-CB 3.28Å; N131-F134 HydrophobicContact CB-CD2 4.25Å; N131-F134 WeakPolarHBondContact ND2-CD2 3.22Å; F134-R246 VanDerWaalsContact O-CD 3.24Å; F134-R246 WeakPolarHBondContact O-CD 3.38Å; F134-R246 WeakPolarHBondContact O-CG 3.37Å
135	A	90	Very high	85.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.259	C	S	.	.			trans	-163	151	178.4	0	0	0	0	0	108.8	Y122 C137 L168 C244 R246	Y122-A135 CarbonylContact C-O 3.18Å; Y122-A135 WeakPolarHBondContact CA-O 3.22Å; Y122-A135 VanDerWaalsContact CB-O 3.22Å; Y122-A135 WeakPolarHBondContact CB-O 3.29Å; A135-C137 PolarHBondContact O-N 3.41Å; A135-L168 HydrophobicContact CB-CB 3.88Å; A135-L168 HydrophobicContact CB-CD1 3.91Å; A135-L168 HydrophobicContact CB-CG 4.42Å; A135-C244 HydrophobicContact CB-CB 4.06Å; A135-R246 HydrophobicContact CB-CG 3.73Å
136	W	92.8	Very high	86.1	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-67.2	133.7	168.3	172.9	60.5	0	0	0	110.1	A109 S111 I127 P138 V150 P235 C244 I245	A109-W136 HydrophobicContact CB-CZ2 4.09Å; S111-W136 PolarHBondContact O-NE1 2.78Å; I127-W136 HydrophobicContact CB-CB 4.38Å; I127-W136 HydrophobicContact CG1-CB 4.49Å; W136-P138 HydrophobicContact CH2-CB 4.4Å; W136-P138 HydrophobicContact CH2-CG 3.67Å; W136-P138 HydrophobicContact CZ2-CB 4.1Å; W136-P138 HydrophobicContact CZ2-CG 3.74Å; W136-P138 HydrophobicContact CZ3-CG 4.11Å; W136-V150 HydrophobicContact CD2-CB 3.72Å; W136-V150 HydrophobicContact CD2-CG1 4.09Å; W136-V150 HydrophobicContact CD2-CG2 4.34Å; W136-V150 HydrophobicContact CE3-CB 3.5Å; W136-V150 HydrophobicContact CE3-CG1 3.37Å; W136-V150 HydrophobicContact CE3-CG2 4.44Å; W136-V150 HydrophobicContact CG-CB 4.37Å; W136-V150 HydrophobicContact CG-CG2 4.49Å; W136-V150 HydrophobicContact CH2-CB 4.04Å; W136-V150 HydrophobicContact CH2-CG1 4.3Å; W136-V150 HydrophobicContact CZ2-CB 4.25Å; W136-V150 HydrophobicContact CZ3-CB 3.66Å; W136-V150 HydrophobicContact CZ3-CG1 3.48Å; W136-V150 VanDerWaalsContact CZ3-CG1 3.48Å; W136-P235 HydrophobicContact CH2-CG 4.38Å; W136-P235 HydrophobicContact CZ3-CG 4.29Å; W136-C244 CarbonylContact O-C 3.38Å; W136-C244 VanDerWaalsContact O-CA 3.23Å; W136-C244 WeakPolarHBondContact O-CA 3.41Å; W136-C244 WeakPolarHBondContact O-CB 3.14Å; W136-I245 HydrophobicContact CE3-CB 4.17Å; W136-I245 HydrophobicContact CE3-CD1 4.02Å; W136-I245 HydrophobicContact CE3-CG1 4.45Å; W136-I245 HydrophobicContact CZ3-CD1 3.84Å; W136-I245 PolarHBondContact N-O 3.48Å; W136-I245 PolarHBondContact O-N 2.86Å
137	C	93.2	Very high	86.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.266	C	S	.	.			trans	-129.9	125.7	173.3	-53.1	0	0	0	0	109.1	E112 V113 Y122 A135 C244	E112-C137 CarbonylContact C-O 3.59Å; V113-C137 HydrophobicContact CB-CB 4.09Å; V113-C137 HydrophobicContact CG2-CB 3.72Å; V113-C137 PolarHBondContact N-O 2.7Å; Y122-C137 HydrophobicContact CG-CB 4.23Å; Y122-C137 PolarHBondContact O-N 2.88Å; A135-C137 PolarHBondContact O-N 3.41Å; C137-C244 HydrophobicContact CB-CB 4.13Å; C137-C244 WeakPolarHBondContact CB-SG 3.28Å; C137-C244 WeakPolarHBondContact SG-CB 3.42Å; C137-C244 CovalentContact SG-SG 2.04Å; C137-C244 PolarHBondContact SG-SG 2.97Å
138	P	93.6	Very high	86.8	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.013	27%	0.272	C	S	.	.			trans	-64.8	142.3	174.6	-16.8	28.5	0	0	0	112.1	V113 W136 I142 E148 P235 V243	V113-P138 WeakPolarHBondContact CG2-O 3.25Å; W136-P138 HydrophobicContact CH2-CB 4.4Å; W136-P138 HydrophobicContact CH2-CG 3.67Å; W136-P138 HydrophobicContact CZ2-CB 4.1Å; W136-P138 HydrophobicContact CZ2-CG 3.74Å; W136-P138 HydrophobicContact CZ3-CG 4.11Å; P138-I142 HydrophobicContact CB-CD1 3.92Å; P138-I142 HydrophobicContact CB-CG1 4.46Å; P138-I142 HydrophobicContact CG-CD1 3.91Å; P138-I142 HydrophobicContact CG-CG1 4.11Å; P138-E148 HydrophobicContact CB-CB 4.16Å; P138-E148 HydrophobicContact CB-CG 4.01Å; P138-E148 HydrophobicContact CG-CB 4.49Å; P138-P235 HydrophobicContact CG-CG 4.21Å; P138-V243 HydrophobicContact CG-CG2 3.72Å
139	G	89.6	Confident	87.3	Confident	40 Å²	40	53.4 Å²	53.4	41%	0.412	27%	0.272	S	S	.	.	S	Bend	trans	-66.4	-34.7	-179.3	0	0	0	0	0	114	S111	S111-G139 PolarHBondContact OG-N 3.44Å
140	K	90.3	Very high	88.1	Confident	71 Å²	71	50.8 Å²	50.8	31%	0.309	26%	0.258	S	S	.	.	S	Bend	trans	-92.7	157.8	171.6	72.4	168.9	175.4	167.1	0	112.6	E145 D147 E148	K140-E145 IonicContact NZ-OE2 2.69Å; K140-E145 PolarHBondContact NZ-OE2 2.88Å; K140-D147 IonicContact NZ-OD2 2.7Å; K140-D147 PolarHBondContact NZ-OD2 3.38Å; K140-E148 HydrophobicContact CD-CG 4.33Å; K140-E148 VanDerWaalsContact CE-OE1 3.26Å; K140-E148 WeakPolarHBondContact CE-OE1 3.42Å; K140-E148 HydrophobicContact CG-CG 3.75Å; K140-E148 WeakPolarHBondContact CG-OE1 3.45Å
141	R	92.2	Very high	89.2	Confident	152 Å²	152	44.8 Å²	44.8	57%	0.574	23%	0.23	S	C	*	.	P	Polyproline II helix	trans	-64.7	137.2	168.5	-67	-178.4	-176.2	178.8	5.4	109	F242	R141-F242 HydrophobicContact CG-CD1 3.94Å; R141-F242 HydrophobicContact CG-CD2 4.3Å; R141-F242 HydrophobicContact CG-CE1 3.68Å; R141-F242 HydrophobicContact CG-CE2 4.07Å; R141-F242 HydrophobicContact CG-CG 4.25Å; R141-F242 HydrophobicContact CG-CZ 3.76Å
142	I	93.7	Very high	90.1	Very high	9 Å²	9	41.8 Å²	41.8	5%	0.046	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-84.9	138.5	178	-59.9	-52.7	0	0	0	109.9	P138 E148 P235 P240 G241 V243	P138-I142 HydrophobicContact CB-CD1 3.92Å; P138-I142 HydrophobicContact CB-CG1 4.46Å; P138-I142 HydrophobicContact CG-CD1 3.91Å; P138-I142 HydrophobicContact CG-CG1 4.11Å; I142-E148 HydrophobicContact CD1-CB 3.61Å; I142-E148 HydrophobicContact CD1-CG 3.55Å; I142-P235 HydrophobicContact CD1-CG 3.97Å; I142-P235 HydrophobicContact CG1-CB 4.25Å; I142-P235 HydrophobicContact CG1-CG 3.94Å; I142-P235 HydrophobicContact CG2-CB 4.22Å; I142-P235 HydrophobicContact CG2-CG 4.46Å; I142-P235 WeakPolarHBondContact CG2-O 3.48Å; I142-P240 CarbonylContact O-C 3.59Å; I142-P240 VanDerWaalsContact O-CA 3.29Å; I142-P240 WeakPolarHBondContact O-CA 3.34Å; I142-G241 PolarHBondContact N-O 2.9Å; I142-G241 PolarHBondContact O-N 2.84Å; I142-V243 HydrophobicContact CB-CG1 3.97Å; I142-V243 HydrophobicContact CB-CG2 4.44Å; I142-V243 HydrophobicContact CG1-CB 4.43Å; I142-V243 HydrophobicContact CG1-CG1 4Å; I142-V243 HydrophobicContact CG1-CG2 3.56Å; I142-V243 HydrophobicContact CG2-CG1 4.49Å
143	S	90.3	Very high	91.1	Very high	24 Å²	24	40.4 Å²	40.4	17%	0.168	20%	0.204	C	C	.	.			trans	-138.2	-159.2	178.6	-170.6	0	0	0	0	107.9	E145 R237	S143-E145 PolarHBondContact O-N 3Å; S143-R237 CarbonylContact C-O 3.49Å; S143-R237 VanDerWaalsContact C-O 3.31Å
144	T	90.3	Very high	91.8	Very high	59 Å²	59	36.7 Å²	36.7	36%	0.362	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	7.7	178.6	62.9	0	0	0	0	114.8	Y236	T144-Y236 HydrophobicContact CG2-CE2 4.08Å
145	E	87.3	Confident	92	Very high	109 Å²	109	35.6 Å²	35.6	51%	0.509	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-25.4	-169.1	-64.1	167.5	173.7	0	0	114.5	K140 S143 D147	K140-E145 IonicContact NZ-OE2 2.69Å; K140-E145 PolarHBondContact NZ-OE2 2.88Å; S143-E145 PolarHBondContact O-N 3Å; E145-D147 PolarHBondContact O-N 3.49Å
146	C	87.2	Confident	91.9	Very high	14 Å²	14	37.5 Å²	37.5	10%	0.095	20%	0.201	C	C	.	.			trans	55.8	20.5	-173.4	-50	0	0	0	0	117	Y234 C720	C146-Y234 HydrophobicContact CB-CD1 4.48Å; C146-Y234 WeakPolarHBondContact O-CD1 3.26Å; C146-Y234 WeakPolarHBondContact O-CE1 3.39Å; C146-C720 HydrophobicContact CB-CB 3.39Å; C146-C720 WeakPolarHBondContact CB-SG 3.47Å; C146-C720 VanDerWaalsContact SG-CA 3.59Å; C146-C720 WeakPolarHBondContact SG-CB 3.19Å; C146-C720 CovalentContact SG-SG 2.04Å; C146-C720 PolarHBondContact SG-SG 3.1Å
147	D	91.1	Very high	91.9	Very high	72 Å²	72	37.9 Å²	37.9	39%	0.385	20%	0.203	S	C	.	.			trans	-71.9	-42.5	180	-66.8	-46.8	0	0	0	113.5	K140 E145	K140-D147 IonicContact NZ-OD2 2.7Å; K140-D147 PolarHBondContact NZ-OD2 3.38Å; E145-D147 PolarHBondContact O-N 3.49Å
148	E	95	Very high	91.9	Very high	23 Å²	23	38 Å²	38	11%	0.107	20%	0.204	C	C	.	.			trans	-79.1	138.8	-171.8	-62	-61.8	137.6	0	0	112.2	T110 S111 P138 K140 I142 Y234 P235	T110-E148 VanDerWaalsContact CB-OE2 3.32Å; T110-E148 WeakPolarHBondContact CB-OE2 3.45Å; T110-E148 VanDerWaalsContact OG1-CA 3.31Å; T110-E148 WeakPolarHBondContact OG1-CA 3.34Å; T110-E148 PolarHBondContact OG1-OE2 2.97Å; S111-E148 WeakPolarHBondContact CB-OE2 3.36Å; S111-E148 PolarHBondContact OG-OE2 3.43Å; P138-E148 HydrophobicContact CB-CB 4.16Å; P138-E148 HydrophobicContact CB-CG 4.01Å; P138-E148 HydrophobicContact CG-CB 4.49Å; K140-E148 HydrophobicContact CD-CG 4.33Å; K140-E148 VanDerWaalsContact CE-OE1 3.26Å; K140-E148 WeakPolarHBondContact CE-OE1 3.42Å; K140-E148 HydrophobicContact CG-CG 3.75Å; K140-E148 WeakPolarHBondContact CG-OE1 3.45Å; I142-E148 HydrophobicContact CD1-CB 3.61Å; I142-E148 HydrophobicContact CD1-CG 3.55Å; E148-Y234 VanDerWaalsContact O-CD1 3.29Å; E148-Y234 WeakPolarHBondContact O-CD1 3.16Å; E148-P235 WeakPolarHBondContact O-CD 3.44Å
149	Y	95.7	Very high	92	Very high	44 Å²	44	38.1 Å²	38.1	17%	0.173	20%	0.204	C	C	.	.			trans	-153.3	158.2	172.2	61.8	-91.3	0	0	0	112.8	A109 T110 E151 R232 I233 Y234	A109-Y149 WeakPolarHBondContact CA-O 3.23Å; T110-Y149 HydrophobicContact CG2-CD1 3.28Å; T110-Y149 HydrophobicContact CG2-CD2 4.22Å; T110-Y149 HydrophobicContact CG2-CE1 3.14Å; T110-Y149 HydrophobicContact CG2-CE2 4.1Å; T110-Y149 HydrophobicContact CG2-CG 3.84Å; T110-Y149 PolarHBondContact N-O 3.48Å; T110-Y149 PolarHBondContact OG1-N 3.31Å; T110-Y149 PolarHBondContact OG1-O 3.48Å; Y149-E151 HydrophobicContact CD2-CB 4.16Å; Y149-E151 HydrophobicContact CE2-CB 4.13Å; Y149-R232 HydrophobicContact CD2-CB 4.27Å; Y149-R232 HydrophobicContact CD2-CG 3.7Å; Y149-R232 HydrophobicContact CE2-CG 4.15Å; Y149-R232 VanDerWaalsContact CE2-NE 3.29Å; Y149-R232 HydrophobicContact CG-CB 4.48Å; Y149-R232 HydrophobicContact CG-CG 4.3Å; Y149-R232 VanDerWaalsContact CZ-NH1 3.27Å; Y149-R232 VanDerWaalsContact OH-CZ 3.31Å; Y149-R232 PolarHBondContact OH-NH1 2.96Å; Y149-R232 PolarHBondContact OH-NH2 3.27Å; Y149-R232 VanDerWaalsContact OH-NH2 3.11Å; Y149-I233 VanDerWaalsContact CA-O 3.29Å; Y149-I233 WeakPolarHBondContact CA-O 3.32Å; Y149-Y234 HydrophobicContact CD1-CD1 4.29Å; Y149-Y234 AromaticContact CD1-CE1 3.43Å; Y149-Y234 HydrophobicContact CD1-CE1 3.43Å; Y149-Y234 VanDerWaalsContact CD1-CE1 3.43Å; Y149-Y234 HydrophobicContact CD1-CE2 4.33Å; Y149-Y234 AromaticContact CD1-CZ 3.44Å; Y149-Y234 VanDerWaalsContact CD1-CZ 3.44Å; Y149-Y234 VanDerWaalsContact CD1-OH 3.31Å; Y149-Y234 WeakPolarHBondContact CD1-OH 3.4Å; Y149-Y234 HydrophobicContact CE1-CE1 4.4Å; Y149-Y234 HydrophobicContact CG-CD1 4.5Å; Y149-Y234 AromaticContact CG-CE1 3.93Å; Y149-Y234 HydrophobicContact CG-CE1 3.93Å; Y149-Y234 HydrophobicContact CG-CE2 4.18Å; Y149-Y234 AromaticContact CG-CZ 3.74Å
150	V	95.1	Very high	92.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	132	162.3	58.2	0	0	0	0	108.9	N108 A109 A124 I127 W136 R232 I233	N108-V150 CarbonylContact O-C 2.89Å; N108-V150 WeakPolarHBondContact O-CA 3.32Å; N108-V150 WeakPolarHBondContact O-CG2 3.43Å; A109-V150 HydrophobicContact CB-CB 4.46Å; A124-V150 HydrophobicContact CB-CG2 4.29Å; I127-V150 HydrophobicContact CD1-CB 4.35Å; I127-V150 HydrophobicContact CD1-CG1 3.47Å; I127-V150 VanDerWaalsContact CD1-CG1 3.47Å; I127-V150 HydrophobicContact CD1-CG2 3.96Å; W136-V150 HydrophobicContact CD2-CB 3.72Å; W136-V150 HydrophobicContact CD2-CG1 4.09Å; W136-V150 HydrophobicContact CD2-CG2 4.34Å; W136-V150 HydrophobicContact CE3-CB 3.5Å; W136-V150 HydrophobicContact CE3-CG1 3.37Å; W136-V150 HydrophobicContact CE3-CG2 4.44Å; W136-V150 HydrophobicContact CG-CB 4.37Å; W136-V150 HydrophobicContact CG-CG2 4.49Å; W136-V150 HydrophobicContact CH2-CB 4.04Å; W136-V150 HydrophobicContact CH2-CG1 4.3Å; W136-V150 HydrophobicContact CZ2-CB 4.25Å; W136-V150 HydrophobicContact CZ3-CB 3.66Å; W136-V150 HydrophobicContact CZ3-CG1 3.48Å; W136-V150 VanDerWaalsContact CZ3-CG1 3.48Å; V150-R232 CarbonylContact O-C 3.55Å; V150-R232 VanDerWaalsContact O-CA 3.26Å; V150-R232 WeakPolarHBondContact O-CA 3.38Å; V150-I233 HydrophobicContact CG1-CB 3.96Å; V150-I233 HydrophobicContact CG1-CG1 4.49Å; V150-I233 PolarHBondContact N-O 3.01Å; V150-I233 PolarHBondContact O-N 2.78Å
151	E	95.2	Very high	92.4	Very high	34 Å²	34	34 Å²	34	16%	0.159	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	140.7	-177.5	-174.7	176.6	118.3	0	0	110.4	N108 Y149 W194 I231 R232	N108-E151 HydrophobicContact CB-CB 4.4Å; N108-E151 PolarHBondContact N-O 3.46Å; N108-E151 PolarHBondContact O-N 2.88Å; Y149-E151 HydrophobicContact CD2-CB 4.16Å; Y149-E151 HydrophobicContact CE2-CB 4.13Å; E151-W194 HydrophobicContact CG-CH2 4.05Å; E151-W194 WeakPolarHBondContact OE2-CZ2 3.48Å; E151-I231 CarbonylContact C-O 3.54Å; E151-I231 WeakPolarHBondContact CA-O 3.5Å; E151-R232 HydrophobicContact CB-CG 3.93Å; E151-R232 HydrophobicContact CG-CG 3.94Å; E151-R232 IonicContact OE2-CZ 3.39Å; E151-R232 IonicContact OE2-NE 2.68Å; E151-R232 PolarHBondContact OE2-NE 3.03Å; E151-R232 IonicContact OE2-NH2 3.22Å; E151-R232 PolarHBondContact OE2-NH2 3.26Å
152	I	94.5	Very high	92.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	123.5	-179.1	-51.9	175.8	0	0	0	109.1	L96 A106 F107 I127 M154 W230 I231 L247	L96-I152 HydrophobicContact CD1-CD1 3.93Å; L96-I152 HydrophobicContact CD2-CG2 3.95Å; A106-I152 WeakPolarHBondContact O-CA 3.4Å; F107-I152 HydrophobicContact CD1-CD1 4.34Å; F107-I152 HydrophobicContact CD1-CG1 3.94Å; F107-I152 HydrophobicContact CD1-CG2 4.29Å; F107-I152 HydrophobicContact CE1-CD1 4.09Å; F107-I152 HydrophobicContact CE1-CG1 4.09Å; F107-I152 HydrophobicContact CE1-CG2 3.93Å; F107-I152 HydrophobicContact CZ-CG2 4.4Å; I127-I152 HydrophobicContact CD1-CD1 4.17Å; I127-I152 HydrophobicContact CG2-CD1 4.35Å; I152-M154 HydrophobicContact CG2-CG 4.47Å; I152-W230 VanDerWaalsContact O-CA 3.29Å; I152-W230 WeakPolarHBondContact O-CA 3.45Å; I152-I231 HydrophobicContact CB-CG1 4Å; I152-I231 HydrophobicContact CD1-CD1 4.31Å; I152-I231 HydrophobicContact CD1-CG1 4.41Å; I152-I231 HydrophobicContact CG1-CG1 4.5Å; I152-I231 PolarHBondContact N-O 3.17Å; I152-I231 PolarHBondContact O-N 2.77Å; I152-L247 HydrophobicContact CD1-CD2 3.68Å
153	D	93.4	Very high	92.4	Very high	36 Å²	36	29.1 Å²	29.1	19%	0.193	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	112.2	167	-173	-5.8	0	0	0	110.4	A106 G155 R229 W230	A106-D153 HydrophobicContact CB-CB 4.43Å; A106-D153 WeakPolarHBondContact CB-O 3.49Å; A106-D153 PolarHBondContact O-N 2.87Å; D153-G155 PolarHBondContact O-N 2.97Å; D153-G155 WeakPolarHBondContact OD1-CA 3.45Å; D153-G155 PolarHBondContact OD1-N 3.3Å; D153-R229 WeakPolarHBondContact OD1-CG 3.44Å; D153-R229 IonicContact OD1-CZ 3.41Å; D153-R229 IonicContact OD1-NE 2.74Å; D153-R229 PolarHBondContact OD1-NE 3.32Å; D153-R229 IonicContact OD1-NH2 3.96Å; D153-R229 PolarHBondContact OD1-NH2 2.93Å; D153-R229 IonicContact OD2-CZ 3.42Å; D153-R229 IonicContact OD2-NE 2.7Å; D153-R229 IonicContact OD2-NH2 2.68Å; D153-R229 PolarHBondContact OD2-NH2 3.38Å; D153-W230 PolarHBondContact OD2-NE1 3.11Å; D153-W230 VanDerWaalsContact OD2-NE1 3.09Å
154	M	91.7	Very high	92.6	Very high	13 Å²	13	28.8 Å²	28.8	6%	0.064	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	3.9	177	-61	178.3	-72.1	0	0	113.4	L95 L96 I152 E156 N158 I160 A228 R229 I231	L95-M154 HydrophobicContact CD1-SD 4.23Å; L96-M154 HydrophobicContact CD2-CG 4.37Å; I152-M154 HydrophobicContact CG2-CG 4.47Å; M154-E156 PolarHBondContact O-N 2.93Å; M154-N158 HydrophobicContact CE-CB 4.04Å; M154-N158 HydrophobicContact SD-CB 4.17Å; M154-I160 HydrophobicContact CE-CD1 3.88Å; M154-I160 HydrophobicContact CE-CG1 4.3Å; M154-I160 HydrophobicContact SD-CD1 4.26Å; M154-A228 HydrophobicContact CE-CB 4.42Å; M154-A228 WeakPolarHBondContact CE-O 3.27Å; M154-R229 WeakPolarHBondContact CB-O 3.41Å; M154-R229 VanDerWaalsContact CE-O 3.28Å; M154-R229 WeakPolarHBondContact CE-O 3.23Å; M154-R229 PolarHBondContact N-O 2.57Å; M154-I231 HydrophobicContact CE-CG2 4.47Å
155	G	89	Confident	92.7	Very high	46 Å²	46	26 Å²	26	47%	0.474	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	75.2	-30.4	178.4	0	0	0	0	0	114.9	D153 R229	D153-G155 PolarHBondContact O-N 2.97Å; D153-G155 WeakPolarHBondContact OD1-CA 3.45Å; D153-G155 PolarHBondContact OD1-N 3.3Å; G155-R229 PolarHBondContact O-NE 3.4Å; G155-R229 PolarHBondContact O-NH1 3.39Å
156	E	89.6	Confident	92.8	Very high	40 Å²	40	21.5 Å²	21.5	19%	0.187	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	170.8	178.4	64.4	-179.7	-153.7	0	0	111.9	R99 M154 N158 R229 R253	R99-E156 IonicContact CZ-OE1 2.79Å; R99-E156 IonicContact NH1-OE1 3.7Å; R99-E156 PolarHBondContact NH1-OE1 2.75Å; R99-E156 IonicContact NH2-OE1 2.7Å; M154-E156 PolarHBondContact O-N 2.93Å; E156-N158 PolarHBondContact O-ND2 2.89Å; E156-R229 WeakPolarHBondContact O-CB 3.44Å; E156-R229 WeakPolarHBondContact O-CG 3.29Å; E156-R253 WeakPolarHBondContact OE1-CB 3.16Å; E156-R253 WeakPolarHBondContact OE1-CD 3.46Å; E156-R253 WeakPolarHBondContact OE1-CG 3.3Å; E156-R253 IonicContact OE1-CZ 2.73Å; E156-R253 IonicContact OE1-NE 3.68Å; E156-R253 IonicContact OE1-NH1 3.91Å; E156-R253 IonicContact OE2-CZ 3.61Å; E156-R253 IonicContact OE2-NE 3.13Å; E156-R253 IonicContact OE2-NH1 3.31Å; E156-R253 PolarHBondContact OE2-NH1 2.94Å; E156-R253 IonicContact OE2-NH2 3.72Å; E156-R253 PolarHBondContact OE2-NH2 2.89Å
157	L	92.7	Very high	93	Very high	7 Å²	7	20.9 Å²	20.9	4%	0.037	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	127.3	179.4	-162.3	63.2	0	0	0	110.2	R187 I227 R229 F254 V259	L157-R187 HydrophobicContact CD1-CB 3.98Å; L157-R187 HydrophobicContact CD1-CG 3.86Å; L157-I227 HydrophobicContact CD1-CG2 4.12Å; L157-I227 HydrophobicContact CD2-CG2 4.13Å; L157-I227 HydrophobicContact CG-CG2 4.01Å; L157-R229 HydrophobicContact CD1-CB 4.29Å; L157-F254 HydrophobicContact CD2-CD1 3.69Å; L157-F254 HydrophobicContact CD2-CE1 4.38Å; L157-F254 HydrophobicContact CG-CB 4.36Å; L157-F254 HydrophobicContact CG-CD1 4.09Å; L157-F254 PolarHBondContact O-N 2.82Å; L157-V259 HydrophobicContact CD2-CG1 4.03Å
158	N	93.3	Very high	93	Very high	2 Å²	2	17.5 Å²	17.5	1%	0.011	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	148.4	-177.2	-70.3	-88.1	0	0	0	110.5	L95 R99 M154 E156 I227 A228 C252 R253	L95-N158 HydrophobicContact CD1-CB 4.3Å; R99-N158 PolarHBondContact NH2-OD1 3.47Å; M154-N158 HydrophobicContact CE-CB 4.04Å; M154-N158 HydrophobicContact SD-CB 4.17Å; E156-N158 PolarHBondContact O-ND2 2.89Å; N158-I227 WeakPolarHBondContact O-CA 3.42Å; N158-A228 PolarHBondContact N-O 2.65Å; N158-A228 PolarHBondContact O-N 3.33Å; N158-C252 CarbonylContact C-O 3.52Å; N158-C252 WeakPolarHBondContact CA-O 3.15Å; N158-R253 WeakPolarHBondContact OD1-CA 3.26Å
159	I	94.3	Very high	92.5	Very high	6 Å²	6	20.4 Å²	20.4	3%	0.031	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	115.8	164	-46.6	-176.7	0	0	0	106.7	T161 P225 I227 G251 C252 F254 L330	I159-T161 HydrophobicContact CG2-CG2 4.4Å; I159-P225 HydrophobicContact CG2-CB 3.7Å; I159-I227 HydrophobicContact CG1-CG1 4.35Å; I159-G251 CarbonylContact O-C 3.46Å; I159-G251 WeakPolarHBondContact O-CA 3.34Å; I159-C252 PolarHBondContact N-O 3.01Å; I159-C252 PolarHBondContact O-N 3.25Å; I159-F254 HydrophobicContact CD1-CB 4.45Å; I159-F254 HydrophobicContact CD1-CD2 3.68Å; I159-F254 HydrophobicContact CD1-CE2 4.22Å; I159-F254 HydrophobicContact CD1-CG 4.24Å; I159-F254 HydrophobicContact CG1-CB 3.76Å; I159-F254 HydrophobicContact CG1-CD2 3.9Å; I159-F254 HydrophobicContact CG1-CG 3.92Å; I159-L330 HydrophobicContact CD1-CD1 3.78Å; I159-L330 HydrophobicContact CD1-CD2 3.75Å; I159-L330 HydrophobicContact CD1-CG 3.96Å; I159-L330 HydrophobicContact CG2-CD1 4.06Å
160	I	94.6	Very high	91.5	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	115.9	173.8	-48.5	176.1	0	0	0	107.8	L95 M154 V163 L222 P225 L226 I231 A249 Y250	L95-I160 HydrophobicContact CD1-CG1 4Å; M154-I160 HydrophobicContact CE-CD1 3.88Å; M154-I160 HydrophobicContact CE-CG1 4.3Å; M154-I160 HydrophobicContact SD-CD1 4.26Å; I160-V163 HydrophobicContact CG2-CG1 3.99Å; I160-L222 HydrophobicContact CB-CD1 4.19Å; I160-L222 HydrophobicContact CG2-CD1 3.86Å; I160-P225 WeakPolarHBondContact O-CA 3.47Å; I160-L226 HydrophobicContact CB-CB 4.31Å; I160-L226 HydrophobicContact CD1-CD2 4.3Å; I160-L226 HydrophobicContact CD1-CG 4.49Å; I160-L226 PolarHBondContact N-O 3.09Å; I160-L226 PolarHBondContact O-N 2.88Å; I160-I231 HydrophobicContact CD1-CD1 4.2Å; I160-I231 HydrophobicContact CD1-CG2 3.71Å; I160-A249 HydrophobicContact CG2-CB 4.2Å; I160-Y250 CarbonylContact C-O 3.56Å; I160-Y250 WeakPolarHBondContact CA-O 3.36Å
161	T	93.9	Very high	90.3	Very high	23 Å²	23	24.9 Å²	24.9	14%	0.141	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-21.2	179.8	54.7	0	0	0	0	112.4	C91 I159 L222 P225 Y250	C91-T161 HydrophobicContact CB-CG2 4.29Å; C91-T161 WeakPolarHBondContact O-CG2 3.29Å; C91-T161 PolarHBondContact O-OG1 3.2Å; I159-T161 HydrophobicContact CG2-CG2 4.4Å; T161-L222 PolarHBondContact O-N 3.01Å; T161-P225 HydrophobicContact CG2-CB 4.26Å; T161-P225 HydrophobicContact CG2-CG 4.44Å; T161-Y250 PolarHBondContact N-O 2.96Å; T161-Y250 PolarHBondContact OG1-O 2.76Å
162	K	93	Very high	88.9	Confident	58 Å²	58	27.6 Å²	27.6	25%	0.252	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	143.3	-173	-178.8	-170.4	-175.3	-163.9	0	110.6	F219 V220 V221 Y250	K162-F219 VanDerWaalsContact CE-CD1 3.47Å; K162-F219 VanDerWaalsContact NZ-CD1 3.29Å; K162-V220 CarbonylContact C-O 3.51Å; K162-V220 WeakPolarHBondContact CA-O 3.41Å; K162-V220 WeakPolarHBondContact CG-O 3.38Å; K162-V221 HydrophobicContact CG-CG2 4.43Å; K162-Y250 PolarHBondContact N-O 2.92Å; K162-Y250 PolarHBondContact O-N 2.89Å
163	V	94.2	Very high	87.6	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	156	167.4	-61.7	0	0	0	0	110.5	I160 F181 I183 V220 L222 L247 E248 A249	I160-V163 HydrophobicContact CG2-CG1 3.99Å; V163-F181 HydrophobicContact CG2-CE2 4.19Å; V163-F181 HydrophobicContact CG2-CZ 3.97Å; V163-I183 HydrophobicContact CG1-CD1 4.4Å; V163-I183 HydrophobicContact CG2-CD1 4.32Å; V163-V220 HydrophobicContact CG2-CB 3.92Å; V163-V220 HydrophobicContact CG2-CG1 4.49Å; V163-V220 PolarHBondContact N-O 2.9Å; V163-V220 PolarHBondContact O-N 2.91Å; V163-V220 VanDerWaalsContact O-O 3.11Å; V163-L222 HydrophobicContact CG1-CD1 4.38Å; V163-L247 HydrophobicContact CB-CD1 4.21Å; V163-E248 CarbonylContact C-O 3.58Å; V163-E248 WeakPolarHBondContact CA-O 3.26Å; V163-A249 HydrophobicContact CG1-CB 4.44Å
164	V	93	Very high	86.8	Confident	16 Å²	16	30.4 Å²	30.4	10%	0.097	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	120.5	179.2	-172	0	0	0	0	108	P217 K218 F219 L247 E248 Y250	V164-P217 HydrophobicContact CG1-CB 3.87Å; V164-K218 CarbonylContact C-O 3.58Å; V164-K218 VanDerWaalsContact CA-O 3.32Å; V164-K218 WeakPolarHBondContact CA-O 3.4Å; V164-F219 HydrophobicContact CB-CD1 4.25Å; V164-F219 HydrophobicContact CG1-CD1 3.79Å; V164-F219 HydrophobicContact CG1-CE1 3.81Å; V164-F219 HydrophobicContact CG1-CG 4.48Å; V164-F219 HydrophobicContact CG1-CZ 4.49Å; V164-F219 HydrophobicContact CG2-CD1 3.43Å; V164-F219 VanDerWaalsContact CG2-CD1 3.43Å; V164-F219 HydrophobicContact CG2-CE1 3.85Å; V164-F219 HydrophobicContact CG2-CG 4.46Å; V164-L247 CarbonylContact O-C 3.48Å; V164-L247 VanDerWaalsContact O-CA 3.25Å; V164-L247 WeakPolarHBondContact O-CA 3.33Å; V164-E248 HydrophobicContact CB-CB 4.48Å; V164-E248 PolarHBondContact N-O 2.94Å; V164-E248 PolarHBondContact O-N 3.27Å; V164-Y250 HydrophobicContact CB-CE2 4.44Å; V164-Y250 HydrophobicContact CG2-CD2 3.84Å; V164-Y250 HydrophobicContact CG2-CE2 3.48Å; V164-Y250 VanDerWaalsContact CG2-CE2 3.48Å
165	I	92.5	Very high	86.5	Confident	1 Å²	1	32 Å²	32	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	132.5	-175.2	-163.2	171.1	0	0	0	110.5	T178 F181 K218 I233 I245 R246	I165-T178 HydrophobicContact CD1-CG2 4.09Å; I165-F181 HydrophobicContact CD1-CD1 3.85Å; I165-F181 HydrophobicContact CD1-CE1 4.15Å; I165-F181 HydrophobicContact CD1-CG 4.05Å; I165-F181 HydrophobicContact CG2-CD1 4.45Å; I165-F181 HydrophobicContact CG2-CE1 3.9Å; I165-F181 HydrophobicContact CG2-CZ 4.44Å; I165-K218 HydrophobicContact CG2-CB 3.88Å; I165-K218 HydrophobicContact CG2-CG 4.29Å; I165-K218 PolarHBondContact N-O 2.84Å; I165-K218 WeakPolarHBondContact O-CB 3.34Å; I165-K218 PolarHBondContact O-N 2.92Å; I165-I233 HydrophobicContact CD1-CG2 4.46Å; I165-I245 HydrophobicContact CD1-CD1 4.27Å; I165-I245 HydrophobicContact CD1-CG1 4.15Å; I165-I245 HydrophobicContact CD1-CG2 4.2Å; I165-I245 HydrophobicContact CG1-CG2 4.04Å; I165-R246 WeakPolarHBondContact CA-O 3.31Å
166	S	90.8	Very high	86.6	Confident	15 Å²	15	33 Å²	33	11%	0.105	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	172.8	174.1	71.6	0	0	0	0	110.7	I245 R246	S166-I245 CarbonylContact O-C 3.54Å; S166-I245 WeakPolarHBondContact O-CA 3.11Å; S166-R246 PolarHBondContact N-O 3.25Å; S166-R246 PolarHBondContact O-N 2.94Å; S166-R246 PolarHBondContact OG-NE 3.34Å; S166-R246 PolarHBondContact OG-NH2 2.83Å
167	G	91.1	Very high	86.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	22%	0.218	C	C	.	.			trans	-108.7	-160.5	-178.6	0	0	0	0	0	113.6	R176 A214 R246	G167-R176 CarbonylContact C-O 3.58Å; G167-R176 WeakPolarHBondContact CA-O 3.42Å; G167-A214 CarbonylContact C-O 3.24Å; G167-A214 PolarHBondContact N-O 3.15Å; G167-A214 VanDerWaalsContact N-O 3.16Å; G167-R246 PolarHBondContact O-NE 3.03Å; G167-R246 PolarHBondContact O-NH2 2.89Å
168	L	89.7	Confident	86.8	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.01	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	134.3	178.1	-175.7	84.3	0	0	0	109.7	Y122 T132 D133 A135 A170 R176 A214 C244	Y122-L168 HydrophobicContact CD1-CD1 4.47Å; Y122-L168 HydrophobicContact CD1-CD2 3.73Å; Y122-L168 HydrophobicContact CE1-CD1 4.17Å; Y122-L168 HydrophobicContact CE1-CD2 3.33Å; Y122-L168 HydrophobicContact CE1-CG 4.39Å; T132-L168 WeakPolarHBondContact O-CD1 3.39Å; D133-L168 VanDerWaalsContact C-CD1 3.5Å; A135-L168 HydrophobicContact CB-CB 3.88Å; A135-L168 HydrophobicContact CB-CD1 3.91Å; A135-L168 HydrophobicContact CB-CG 4.42Å; L168-A170 PolarHBondContact O-N 3.29Å; L168-R176 PolarHBondContact N-O 3.48Å; L168-R176 PolarHBondContact O-N 3.45Å; L168-A214 VanDerWaalsContact O-CB 3.24Å; L168-A214 WeakPolarHBondContact O-CB 3.37Å; L168-C244 HydrophobicContact CB-CB 3.65Å
169	L	86.2	Confident	86.8	Confident	83 Å²	83	34.8 Å²	34.8	44%	0.435	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	105.4	164	-178	62.6	0	0	0	107.7	L215	L169-L215 HydrophobicContact CB-CD2 4.22Å
170	A	73.7	Confident	86.8	Confident	8 Å²	8	37.8 Å²	37.8	7%	0.066	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	146.8	-175.6	0	0	0	0	0	111.9	L168 G172 G173 G174 R176	L168-A170 PolarHBondContact O-N 3.29Å; A170-G172 PolarHBondContact O-N 3.5Å; A170-G173 PolarHBondContact O-N 3.32Å; A170-G174 VanDerWaalsContact CB-O 3.28Å; A170-G174 WeakPolarHBondContact CB-O 3.02Å; A170-G174 PolarHBondContact N-O 2.8Å; A170-G174 PolarHBondContact O-N 2.72Å; A170-R176 HydrophobicContact CB-CG 4.17Å
171	E	70	Confident	86.8	Confident	131 Å²	131	37.8 Å²	37.8	61%	0.612	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.8	122.9	171.9	-65.1	175.2	-133.9	0	0	110	R121 Y122	R121-E171 IonicContact CZ-OE1 3.76Å; R121-E171 VanDerWaalsContact NH1-CD 3.29Å; R121-E171 IonicContact NH1-OE1 2.64Å; R121-E171 PolarHBondContact NH1-OE1 3.39Å; R121-E171 IonicContact NH1-OE2 3.28Å; R121-E171 PolarHBondContact NH1-OE2 2.66Å; Y122-E171 PolarHBondContact OH-OE1 3.09Å
172	G	66.2	Low	86.8	Confident	90 Å²	90	37 Å²	37	93%	0.928	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	99	-0.1	-167.9	0	0	0	0	0	115.7	A170	A170-G172 PolarHBondContact O-N 3.5Å
173	G	67	Low	86.9	Confident	58 Å²	58	34.3 Å²	34.3	60%	0.598	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.8	11.8	169.3	0	0	0	0	0	116.1	A170	A170-G173 PolarHBondContact O-N 3.32Å
174	G	76.7	Confident	87	Confident	37 Å²	37	35.2 Å²	35.2	38%	0.381	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	119.7	178.6	0	0	0	0	0	113	A170 R176	A170-G174 VanDerWaalsContact CB-O 3.28Å; A170-G174 WeakPolarHBondContact CB-O 3.02Å; A170-G174 PolarHBondContact N-O 2.8Å; A170-G174 PolarHBondContact O-N 2.72Å; G174-R176 PolarHBondContact O-N 2.83Å
175	S	85.2	Confident	87.1	Confident	48 Å²	48	35 Å²	35	34%	0.336	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	117.1	175.2	-169.7	0	0	0	0	111	D213 A214	S175-D213 PolarHBondContact OG-OD1 3.02Å; S175-A214 VanDerWaalsContact OG-CB 3.25Å; S175-A214 WeakPolarHBondContact OG-CB 3.37Å; S175-A214 PolarHBondContact OG-N 2.81Å; S175-A214 VanDerWaalsContact OG-N 3.11Å
176	R	90.5	Very high	87.3	Confident	65 Å²	65	36.3 Å²	36.3	25%	0.245	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	105.9	177.6	-65.1	-176.4	-175	170.8	4.3	110.3	G167 L168 A170 G174 C244	G167-R176 CarbonylContact C-O 3.58Å; G167-R176 WeakPolarHBondContact CA-O 3.42Å; L168-R176 PolarHBondContact N-O 3.48Å; L168-R176 PolarHBondContact O-N 3.45Å; A170-R176 HydrophobicContact CB-CG 4.17Å; G174-R176 PolarHBondContact O-N 2.83Å; R176-C244 HydrophobicContact CB-CB 4.12Å; R176-C244 WeakPolarHBondContact CD-SG 3.23Å
177	Y	92.2	Very high	87.5	Confident	71 Å²	71	36 Å²	36	28%	0.278	22%	0.218	S	C	.	.			trans	-134.5	164.1	-176.7	60.7	-96.5	0	0	0	112.7	P179 G211 D213 R237	Y177-P179 HydrophobicContact CD2-CB 4.44Å; Y177-P179 HydrophobicContact CE2-CB 4.21Å; Y177-P179 WeakPolarHBondContact O-CD 3.3Å; Y177-G211 WeakPolarHBondContact CD2-O 3.05Å; Y177-D213 WeakPolarHBondContact CB-O 3.43Å; Y177-R237 PolarHBondContact O-NH2 3.4Å
178	T	94.5	Very high	87.5	Confident	3 Å²	3	38.1 Å²	38.1	2%	0.018	23%	0.228	C	C	.	.			trans	-107.4	102.8	179.8	-63.5	0	0	0	0	109.7	I165 Y180 F181 G210 G211 P235 C244 I245	I165-T178 HydrophobicContact CD1-CG2 4.09Å; T178-Y180 WeakPolarHBondContact CG2-O 3.43Å; T178-F181 HydrophobicContact CG2-CB 4.09Å; T178-G210 CarbonylContact O-C 3.55Å; T178-G210 WeakPolarHBondContact O-CA 3.4Å; T178-G211 CarbonylContact C-O 3.57Å; T178-G211 PolarHBondContact O-N 3.35Å; T178-P235 HydrophobicContact CG2-CB 3.77Å; T178-C244 PolarHBondContact OG1-O 3.38Å; T178-C244 VanDerWaalsContact OG1-O 3.11Å; T178-I245 HydrophobicContact CG2-CD1 4.21Å; T178-I245 HydrophobicContact CG2-CG1 4.37Å; T178-I245 WeakPolarHBondContact OG1-CG1 3.47Å
179	P	93.3	Very high	87.5	Confident	13 Å²	13	44.4 Å²	44.4	8%	0.084	26%	0.26	C	S	.	.	S	Bend	trans	-74.8	-31.4	-175.9	28.3	-32.6	0	0	0	113.2	Y177 G210 G211 R237	Y177-P179 HydrophobicContact CD2-CB 4.44Å; Y177-P179 HydrophobicContact CE2-CB 4.21Å; Y177-P179 WeakPolarHBondContact O-CD 3.3Å; P179-G210 WeakPolarHBondContact O-CA 3.48Å; P179-G210 PolarHBondContact O-N 2.79Å; P179-G211 WeakPolarHBondContact CA-O 3.22Å; P179-R237 HydrophobicContact CG-CB 4.28Å; P179-R237 HydrophobicContact CG-CG 3.84Å
180	Y	94.1	Very high	87.5	Confident	70 Å²	70	47.4 Å²	47.4	28%	0.275	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	153.8	174.1	-58.5	-73.5	0	0	0	110.3	T178 R207 L208 L209 Y236 D238	T178-Y180 WeakPolarHBondContact CG2-O 3.43Å; Y180-R207 HydrophobicContact CD1-CG 3.92Å; Y180-R207 HydrophobicContact CG-CG 4.05Å; Y180-L208 CarbonylContact C-O 3.58Å; Y180-L208 VanDerWaalsContact CA-O 3.27Å; Y180-L208 WeakPolarHBondContact CA-O 3.18Å; Y180-L209 HydrophobicContact CD1-CD1 4.13Å; Y180-L209 HydrophobicContact CE1-CD1 3.69Å; Y180-Y236 HydrophobicContact CD2-CD1 4.3Å; Y180-Y236 HydrophobicContact CG-CD1 4.48Å; Y180-Y236 PolarHBondContact N-O 3.22Å; Y180-Y236 PolarHBondContact O-N 3.14Å; Y180-Y236 VanDerWaalsContact O-O 3.07Å; Y180-D238 WeakPolarHBondContact CD2-OD2 3.09Å; Y180-D238 WeakPolarHBondContact CE2-OD2 3.43Å
181	F	94.8	Very high	88.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	161	174.2	65.6	-76.8	0	0	0	111.7	V163 I165 T178 I183 L208 V220 I233 Y234	V163-F181 HydrophobicContact CG2-CE2 4.19Å; V163-F181 HydrophobicContact CG2-CZ 3.97Å; I165-F181 HydrophobicContact CD1-CD1 3.85Å; I165-F181 HydrophobicContact CD1-CE1 4.15Å; I165-F181 HydrophobicContact CD1-CG 4.05Å; I165-F181 HydrophobicContact CG2-CD1 4.45Å; I165-F181 HydrophobicContact CG2-CE1 3.9Å; I165-F181 HydrophobicContact CG2-CZ 4.44Å; T178-F181 HydrophobicContact CG2-CB 4.09Å; F181-I183 HydrophobicContact CD2-CG1 4.1Å; F181-I183 HydrophobicContact CE2-CD1 4.07Å; F181-I183 HydrophobicContact CE2-CG1 3.8Å; F181-L208 HydrophobicContact CD1-CB 4.18Å; F181-L208 HydrophobicContact CD2-CB 4.39Å; F181-L208 HydrophobicContact CD2-CD1 4.43Å; F181-L208 HydrophobicContact CE1-CB 3.81Å; F181-L208 HydrophobicContact CE2-CB 4.07Å; F181-L208 HydrophobicContact CE2-CD1 3.73Å; F181-L208 HydrophobicContact CG-CB 4.45Å; F181-L208 HydrophobicContact CZ-CB 3.76Å; F181-L208 HydrophobicContact CZ-CD1 3.92Å; F181-L208 PolarHBondContact N-O 2.57Å; F181-L208 WeakPolarHBondContact O-CB 3.47Å; F181-L208 PolarHBondContact O-N 3.15Å; F181-V220 HydrophobicContact CE1-CG2 4.15Å; F181-V220 HydrophobicContact CZ-CB 4.5Å; F181-V220 HydrophobicContact CZ-CG2 4.07Å; F181-I233 HydrophobicContact CB-CG2 4.19Å; F181-I233 HydrophobicContact CD2-CG2 3.95Å; F181-I233 HydrophobicContact CG-CG2 4.36Å; F181-Y234 CarbonylContact C-O 3.57Å; F181-Y234 WeakPolarHBondContact CA-O 3.2Å; F181-Y234 WeakPolarHBondContact CB-O 3.31Å
182	Y	94.5	Very high	88.8	Confident	7 Å²	7	50.3 Å²	50.3	3%	0.027	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	145.4	168.7	-57.4	-99.4	0	0	0	109.3	S206 R207 Y234 Y236 C720	Y182-S206 VanDerWaalsContact CD1-C 3.46Å; Y182-S206 VanDerWaalsContact CD1-O 3.25Å; Y182-S206 WeakPolarHBondContact CD1-O 3.3Å; Y182-R207 HydrophobicContact CD1-CB 4.47Å; Y182-R207 HydrophobicContact CE1-CB 3.7Å; Y182-R207 HydrophobicContact CE2-CB 4.5Å; Y182-Y234 PolarHBondContact N-O 3.4Å; Y182-Y234 PolarHBondContact O-N 2.8Å; Y182-Y236 AromaticContact CE2-CD2 3.59Å; Y182-Y236 HydrophobicContact CE2-CD2 3.59Å; Y182-Y236 HydrophobicContact CE2-CE2 4.26Å; Y182-Y236 AromaticContact CE2-CG 3.75Å; Y182-Y236 HydrophobicContact CE2-CG 3.75Å; Y182-C720 WeakPolarHBondContact CD2-SG 3.16Å; Y182-C720 VanDerWaalsContact CE2-SG 3.56Å
183	I	95.6	Very high	89.7	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	129	168.2	-55.8	173.5	0	0	0	108.2	V163 F181 Y197 L208 L222 L226 R232 I233	V163-I183 HydrophobicContact CG1-CD1 4.4Å; V163-I183 HydrophobicContact CG2-CD1 4.32Å; F181-I183 HydrophobicContact CD2-CG1 4.1Å; F181-I183 HydrophobicContact CE2-CD1 4.07Å; F181-I183 HydrophobicContact CE2-CG1 3.8Å; I183-Y197 WeakPolarHBondContact O-CB 3.42Å; I183-Y197 PolarHBondContact O-N 3.16Å; I183-L208 HydrophobicContact CD1-CD1 3.61Å; I183-L208 HydrophobicContact CG1-CD1 3.86Å; I183-L222 HydrophobicContact CD1-CD1 4.36Å; I183-L222 HydrophobicContact CD1-CD2 3.98Å; I183-L226 HydrophobicContact CG2-CD2 3.72Å; I183-R232 WeakPolarHBondContact CA-O 3.48Å; I183-I233 HydrophobicContact CG1-CD1 3.89Å; I183-I233 HydrophobicContact CG2-CD1 4.49Å
184	R	95.3	Very high	90.9	Very high	20 Å²	20	49.5 Å²	49.5	8%	0.075	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	154.3	163	-85.6	176	163.3	163	-7.4	110.4	W194 R195 T196 I231 R232 Y234 C720 D721	R184-W194 HydrophobicContact CB-CB 4.29Å; R184-W194 HydrophobicContact CB-CE3 4.31Å; R184-W194 HydrophobicContact CG-CB 4.49Å; R184-R195 CarbonylContact C-O 3.5Å; R184-R195 WeakPolarHBondContact CA-O 3.5Å; R184-T196 HydrophobicContact CG-CG2 4.42Å; R184-T196 PolarHBondContact NE-OG1 2.91Å; R184-I231 CarbonylContact O-C 3.56Å; R184-I231 WeakPolarHBondContact O-CA 3.27Å; R184-R232 HydrophobicContact CB-CB 4.19Å; R184-R232 PolarHBondContact N-O 2.77Å; R184-R232 PolarHBondContact O-N 2.87Å; R184-Y234 HydrophobicContact CB-CD2 4.31Å; R184-Y234 HydrophobicContact CB-CE2 3.9Å; R184-Y234 HydrophobicContact CG-CD2 4.43Å; R184-Y234 HydrophobicContact CG-CE2 4.11Å; R184-C720 VanDerWaalsContact CZ-O 3.29Å; R184-C720 PolarHBondContact NH1-O 3.22Å; R184-C720 PolarHBondContact NH2-O 3.05Å; R184-D721 IonicContact CZ-OD1 2.71Å; R184-D721 IonicContact NE-OD1 3.93Å; R184-D721 VanDerWaalsContact NH2-CA 3.27Å; R184-D721 IonicContact NH2-OD1 2.7Å; R184-D721 PolarHBondContact NH2-OD1 3.01Å
185	Y	96.4	Very high	91.6	Very high	10 Å²	10	49.8 Å²	49.8	4%	0.039	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	164.5	-175.2	63.3	-83.1	0	0	0	113.9	W194 R195 L226 A228 W230 D310	Y185-W194 VanDerWaalsContact C-CE3 3.48Å; Y185-R195 HydrophobicContact CD1-CB 4.06Å; Y185-R195 VanDerWaalsContact CD1-O 3.23Å; Y185-R195 WeakPolarHBondContact CD1-O 3.49Å; Y185-R195 HydrophobicContact CD2-CB 4.15Å; Y185-R195 HydrophobicContact CE1-CB 3.6Å; Y185-R195 HydrophobicContact CE2-CB 3.71Å; Y185-R195 HydrophobicContact CE2-CG 4.24Å; Y185-R195 HydrophobicContact CG-CB 4.31Å; Y185-R195 VanDerWaalsContact CZ-CB 3.41Å; Y185-R195 PolarHBondContact N-O 2.63Å; Y185-R195 PolarHBondContact O-N 3.44Å; Y185-L226 HydrophobicContact CD1-CD1 3.51Å; Y185-L226 HydrophobicContact CD1-CD2 4.25Å; Y185-L226 HydrophobicContact CD2-CD1 3.6Å; Y185-L226 HydrophobicContact CE1-CD1 3.58Å; Y185-L226 HydrophobicContact CE2-CD1 3.64Å; Y185-L226 HydrophobicContact CG-CD1 3.52Å; Y185-L226 HydrophobicContact CG-CD2 4.42Å; Y185-L226 HydrophobicContact CG-CG 4.5Å; Y185-A228 HydrophobicContact CD2-CB 4.19Å; Y185-A228 HydrophobicContact CG-CB 4.31Å; Y185-W230 WeakPolarHBondContact CA-O 3.36Å; Y185-W230 WeakPolarHBondContact CB-O 3.42Å; Y185-D310 VanDerWaalsContact OH-CB 3.31Å; Y185-D310 WeakPolarHBondContact OH-CB 3.48Å; Y185-D310 PolarHBondContact OH-OD2 2.7Å; Y185-D310 VanDerWaalsContact OH-OD2 3.13Å
186	K	95.2	Very high	91.9	Very high	29 Å²	29	48.3 Å²	48.3	13%	0.126	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	152.4	168.9	-75.2	-178.7	175	-176.1	0	110.9	E191 E192 N193 W194 R229 W230	K186-E191 VanDerWaalsContact CA-OE2 3.29Å; K186-E191 WeakPolarHBondContact CA-OE2 3.39Å; K186-E191 WeakPolarHBondContact CB-OE2 3.34Å; K186-E191 HydrophobicContact CD-CB 4.31Å; K186-E191 WeakPolarHBondContact CD-O 3.4Å; K186-E191 WeakPolarHBondContact CE-O 3.41Å; K186-E191 HydrophobicContact CG-CB 4.41Å; K186-E191 HydrophobicContact CG-CG 4.41Å; K186-E191 PolarHBondContact NZ-O 3.42Å; K186-E192 WeakPolarHBondContact CE-O 3.24Å; K186-E192 PolarHBondContact NZ-O 3.42Å; K186-N193 WeakPolarHBondContact CE-O 3.4Å; K186-W194 HydrophobicContact CB-CE3 4.45Å; K186-W194 HydrophobicContact CB-CZ3 4.38Å; K186-W194 HydrophobicContact CD-CD2 3.92Å; K186-W194 HydrophobicContact CD-CE3 4.28Å; K186-W194 HydrophobicContact CD-CG 4.36Å; K186-W194 HydrophobicContact CD-CH2 4.38Å; K186-W194 HydrophobicContact CD-CZ2 4.02Å; K186-W194 HydrophobicContact CD-CZ3 4.5Å; K186-W194 VanDerWaalsContact CE-CD1 3.47Å; K186-W194 HydrophobicContact CG-CD2 3.85Å; K186-W194 HydrophobicContact CG-CE3 3.81Å; K186-W194 HydrophobicContact CG-CG 4.31Å; K186-W194 HydrophobicContact CG-CZ3 4.16Å; K186-R229 PolarHBondContact O-N 3.33Å; K186-W230 HydrophobicContact CB-CB 4.38Å; K186-W230 HydrophobicContact CB-CE3 4.05Å; K186-W230 PolarHBondContact N-O 2.89Å; K186-W230 PolarHBondContact O-N 2.74Å
187	R	94.8	Very high	92.1	Very high	9 Å²	9	45.5 Å²	45.5	3%	0.034	21%	0.214	C	C	.	.	S	Bend	trans	-102.6	-31.7	173.9	-69.3	-166.6	-84	-88.2	2.6	113	L157 E191 I227 V259 D310	L157-R187 HydrophobicContact CD1-CB 3.98Å; L157-R187 HydrophobicContact CD1-CG 3.86Å; R187-E191 PolarHBondContact N-OE2 2.92Å; R187-I227 WeakPolarHBondContact CG-O 3.23Å; R187-I227 PolarHBondContact NH1-O 3.48Å; R187-V259 HydrophobicContact CB-CG1 4.24Å; R187-V259 PolarHBondContact NE-O 2.84Å; R187-V259 PolarHBondContact NH2-O 3.15Å; R187-D310 IonicContact CZ-OD1 3.99Å; R187-D310 IonicContact CZ-OD2 3.45Å; R187-D310 IonicContact NH1-OD1 2.84Å; R187-D310 IonicContact NH1-OD2 2.74Å; R187-D310 PolarHBondContact NH1-OD2 3.47Å; R187-D310 IonicContact NH2-OD1 3.74Å; R187-D310 PolarHBondContact NH2-OD1 2.86Å; R187-D310 IonicContact NH2-OD2 3.61Å; R187-D310 PolarHBondContact NH2-OD2 2.81Å
188	E	92.8	Very high	91.9	Very high	45 Å²	45	45.8 Å²	45.8	21%	0.21	22%	0.215	C	C	.	.	S	Bend	trans	-129.9	149.4	-176.3	-68	179	113.4	0	0	112.2	N190 E191 W230 V259 R383	E188-N190 VanDerWaalsContact C-N 3.27Å; E188-N190 PolarHBondContact O-N 2.84Å; E188-E191 HydrophobicContact CB-CB 4.5Å; E188-E191 WeakPolarHBondContact O-CB 3.48Å; E188-E191 PolarHBondContact O-N 2.71Å; E188-W230 VanDerWaalsContact C-CZ3 3.46Å; E188-V259 HydrophobicContact CG-CB 4.33Å; E188-V259 HydrophobicContact CG-CG1 3.91Å; E188-R383 IonicContact OE1-CZ 2.68Å; E188-R383 IonicContact OE1-NH1 2.68Å; E188-R383 PolarHBondContact OE1-NH1 2.56Å; E188-R383 IonicContact OE2-CZ 3.96Å; E188-R383 VanDerWaalsContact OE2-CZ 3.24Å; E188-R383 IonicContact OE2-NH1 3.71Å; E188-R383 PolarHBondContact OE2-NH1 3.16Å; E188-R383 IonicContact OE2-NH2 2.63Å; E188-R383 PolarHBondContact OE2-NH2 2.95Å
189	I	89.3	Confident	91.3	Very high	133 Å²	133	47.2 Å²	47.2	68%	0.682	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-28.2	-177.6	-169.1	167.3	0	0	0	112.9	E191 W230	I189-E191 VanDerWaalsContact C-N 3.3Å; I189-W230 HydrophobicContact CB-CH2 3.7Å; I189-W230 HydrophobicContact CB-CZ2 4.09Å; I189-W230 HydrophobicContact CG1-CH2 4.45Å; I189-W230 HydrophobicContact CG1-CZ2 4.36Å
190	N	86.2	Confident	90.4	Very high	146 Å²	146	48 Å²	48	78%	0.781	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-0.2	177.9	-63	-7.7	0	0	0	113	E188 E192	E188-N190 VanDerWaalsContact C-N 3.27Å; E188-N190 PolarHBondContact O-N 2.84Å; N190-E192 PolarHBondContact O-N 2.85Å
191	E	86.8	Confident	89	Confident	30 Å²	30	50.1 Å²	50.1	14%	0.14	23%	0.232	C	C	.	.			trans	-73.5	113	178.4	-168	170.5	-153.7	0	0	108.6	K186 R187 E188 I189 R195	K186-E191 VanDerWaalsContact CA-OE2 3.29Å; K186-E191 WeakPolarHBondContact CA-OE2 3.39Å; K186-E191 WeakPolarHBondContact CB-OE2 3.34Å; K186-E191 HydrophobicContact CD-CB 4.31Å; K186-E191 WeakPolarHBondContact CD-O 3.4Å; K186-E191 WeakPolarHBondContact CE-O 3.41Å; K186-E191 HydrophobicContact CG-CB 4.41Å; K186-E191 HydrophobicContact CG-CG 4.41Å; K186-E191 PolarHBondContact NZ-O 3.42Å; R187-E191 PolarHBondContact N-OE2 2.92Å; E188-E191 HydrophobicContact CB-CB 4.5Å; E188-E191 WeakPolarHBondContact O-CB 3.48Å; E188-E191 PolarHBondContact O-N 2.71Å; I189-E191 VanDerWaalsContact C-N 3.3Å; E191-R195 IonicContact OE1-CZ 3.73Å; E191-R195 IonicContact OE1-NE 3.76Å; E191-R195 PolarHBondContact OE1-NE 3.22Å; E191-R195 IonicContact OE1-NH2 2.8Å; E191-R195 PolarHBondContact OE1-NH2 3.02Å
192	E	83.2	Confident	86.9	Confident	171 Å²	171	56.3 Å²	56.3	80%	0.799	27%	0.272	S	S	*	.			trans	-67.3	-54.5	-176.2	-66.2	-178.8	166.8	0	0	111.8	K186 N190	K186-E192 WeakPolarHBondContact CE-O 3.24Å; K186-E192 PolarHBondContact NZ-O 3.42Å; N190-E192 PolarHBondContact O-N 2.85Å
193	N	86	Confident	85	Confident	85 Å²	85	59.5 Å²	59.5	46%	0.455	29%	0.293	S	S	.	.	S	Bend	trans	-83.1	145.9	-175.1	-67.9	-76.8	0	0	0	111.7	K186 N723	K186-N193 WeakPolarHBondContact CE-O 3.4Å; N193-N723 PolarHBondContact OD1-ND2 3.39Å
194	W	91.6	Very high	83.3	Confident	46 Å²	46	63.3 Å²	63.3	17%	0.174	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-88.1	135.9	168.9	-71.7	84	0	0	0	109.9	E151 R184 Y185 K186 W230 R232	E151-W194 HydrophobicContact CG-CH2 4.05Å; E151-W194 WeakPolarHBondContact OE2-CZ2 3.48Å; R184-W194 HydrophobicContact CB-CB 4.29Å; R184-W194 HydrophobicContact CB-CE3 4.31Å; R184-W194 HydrophobicContact CG-CB 4.49Å; Y185-W194 VanDerWaalsContact C-CE3 3.48Å; K186-W194 HydrophobicContact CB-CE3 4.45Å; K186-W194 HydrophobicContact CB-CZ3 4.38Å; K186-W194 HydrophobicContact CD-CD2 3.92Å; K186-W194 HydrophobicContact CD-CE3 4.28Å; K186-W194 HydrophobicContact CD-CG 4.36Å; K186-W194 HydrophobicContact CD-CH2 4.38Å; K186-W194 HydrophobicContact CD-CZ2 4.02Å; K186-W194 HydrophobicContact CD-CZ3 4.5Å; K186-W194 VanDerWaalsContact CE-CD1 3.47Å; K186-W194 HydrophobicContact CG-CD2 3.85Å; K186-W194 HydrophobicContact CG-CE3 3.81Å; K186-W194 HydrophobicContact CG-CG 4.31Å; K186-W194 HydrophobicContact CG-CZ3 4.16Å; W194-W230 HydrophobicContact CH2-CB 3.66Å; W194-W230 HydrophobicContact CH2-CG 4.42Å; W194-W230 HydrophobicContact CZ3-CB 3.85Å; W194-R232 VanDerWaalsContact CE2-CZ 3.42Å; W194-R232 VanDerWaalsContact CE2-NE 3.28Å; W194-R232 HydrophobicContact CE3-CG 4.11Å; W194-R232 HydrophobicContact CH2-CG 3.81Å; W194-R232 HydrophobicContact CZ2-CG 4.27Å; W194-R232 HydrophobicContact CZ3-CB 4.44Å; W194-R232 HydrophobicContact CZ3-CG 3.72Å
195	R	91.6	Very high	81.9	Confident	42 Å²	42	65.4 Å²	65.4	16%	0.158	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	135.6	173.9	-62.7	177.3	-164.2	-106.1	-7.2	109.7	R184 Y185 E191 D310 G322	R184-R195 CarbonylContact C-O 3.5Å; R184-R195 WeakPolarHBondContact CA-O 3.5Å; Y185-R195 HydrophobicContact CD1-CB 4.06Å; Y185-R195 VanDerWaalsContact CD1-O 3.23Å; Y185-R195 WeakPolarHBondContact CD1-O 3.49Å; Y185-R195 HydrophobicContact CD2-CB 4.15Å; Y185-R195 HydrophobicContact CE1-CB 3.6Å; Y185-R195 HydrophobicContact CE2-CB 3.71Å; Y185-R195 HydrophobicContact CE2-CG 4.24Å; Y185-R195 HydrophobicContact CG-CB 4.31Å; Y185-R195 VanDerWaalsContact CZ-CB 3.41Å; Y185-R195 PolarHBondContact N-O 2.63Å; Y185-R195 PolarHBondContact O-N 3.44Å; E191-R195 IonicContact OE1-CZ 3.73Å; E191-R195 IonicContact OE1-NE 3.76Å; E191-R195 PolarHBondContact OE1-NE 3.22Å; E191-R195 IonicContact OE1-NH2 2.8Å; E191-R195 PolarHBondContact OE1-NH2 3.02Å; R195-D310 IonicContact CZ-OD1 2.65Å; R195-D310 PolarHBondContact NH1-O 3.22Å; R195-D310 IonicContact NH1-OD1 3.34Å; R195-D310 PolarHBondContact NH1-OD1 2.83Å; R195-G322 VanDerWaalsContact CZ-O 3.22Å; R195-G322 PolarHBondContact NH1-O 3.4Å; R195-G322 PolarHBondContact NH2-O 2.75Å
196	T	92	Very high	81	Confident	17 Å²	17	65.2 Å²	65.2	10%	0.104	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	125.1	173.8	-55.7	0	0	0	0	109.8	R184 F719 D721	R184-T196 HydrophobicContact CG-CG2 4.42Å; R184-T196 PolarHBondContact NE-OG1 2.91Å; T196-F719 HydrophobicContact CG2-CE1 3.76Å; T196-F719 HydrophobicContact CG2-CZ 4.29Å; T196-D721 PolarHBondContact OG1-OD1 3.32Å
197	Y	93.2	Very high	80.7	Confident	6 Å²	6	66.6 Å²	66.6	2%	0.024	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-66.5	144.8	178.6	-178.5	-97.4	0	0	0	111.6	I183 Q199 L208 L222 D223 P224 L226	I183-Y197 WeakPolarHBondContact O-CB 3.42Å; I183-Y197 PolarHBondContact O-N 3.16Å; Y197-Q199 HydrophobicContact CE1-CB 4.33Å; Y197-Q199 PolarHBondContact OH-OE1 3.17Å; Y197-L208 HydrophobicContact CD1-CD1 4.18Å; Y197-L208 HydrophobicContact CD1-CD2 4.43Å; Y197-L208 HydrophobicContact CE1-CD1 4.46Å; Y197-L208 HydrophobicContact CE1-CD2 4.31Å; Y197-L222 HydrophobicContact CE1-CD2 3.88Å; Y197-L222 HydrophobicContact CE2-CB 4.45Å; Y197-L222 WeakPolarHBondContact OH-CA 3.4Å; Y197-L222 WeakPolarHBondContact OH-CB 3.23Å; Y197-D223 PolarHBondContact OH-N 3.14Å; Y197-P224 HydrophobicContact CE2-CG 4.46Å; Y197-P224 WeakPolarHBondContact CE2-O 3.44Å; Y197-P224 PolarHBondContact OH-O 3.07Å; Y197-L226 HydrophobicContact CD2-CB 4.18Å; Y197-L226 HydrophobicContact CD2-CD1 4.21Å; Y197-L226 HydrophobicContact CD2-CD2 4.3Å; Y197-L226 HydrophobicContact CD2-CG 4.47Å; Y197-L226 HydrophobicContact CE2-CB 4.13Å
198	R	88.6	Confident	80.5	Confident	78 Å²	78	66.6 Å²	66.6	29%	0.294	33%	0.33	S	S	.	.			trans	-136.8	121	178.6	-57.9	-175.5	-174.7	-165	-2.5	109.1	I204 D721	R198-I204 HydrophobicContact CB-CG2 4.3Å; R198-D721 IonicContact NH2-OD2 3.06Å
199	Q	82.3	Confident	80.4	Confident	32 Å²	32	68.1 Å²	68.1	15%	0.15	34%	0.339	C	S	.	.			trans	-71.7	138.6	175.4	-178.6	73.1	6.2	0	0	109.6	Y197 R201 I204 L208	Y197-Q199 HydrophobicContact CE1-CB 4.33Å; Y197-Q199 PolarHBondContact OH-OE1 3.17Å; Q199-R201 WeakPolarHBondContact CG-O 3.32Å; Q199-R201 PolarHBondContact NE2-O 2.74Å; Q199-R201 VanDerWaalsContact NE2-O 3.07Å; Q199-I204 WeakPolarHBondContact O-CA 3.47Å; Q199-L208 HydrophobicContact CB-CD2 4.23Å
200	L	73.4	Confident	80.4	Confident	31 Å²	31	61.8 Å²	61.8	16%	0.162	31%	0.306	C	S	.	.			trans	-80.3	-34.5	176.6	-85.1	-179.6	0	0	0	113.7	D223 C308	L200-D223 PolarHBondContact N-O 3.02Å; L200-C308 HydrophobicContact CD1-CB 3.87Å; L200-C308 HydrophobicContact CG-CB 4.32Å
201	R	64.6	Low	80.5	Confident	113 Å²	113	55 Å²	55	43%	0.426	27%	0.271	S	S	.	.	S	Bend	trans	-135.5	136.9	-168.8	-52.6	-175.6	-169.9	97.6	4.6	111.2	Q199 D223	Q199-R201 WeakPolarHBondContact CG-O 3.32Å; Q199-R201 PolarHBondContact NE2-O 2.74Å; Q199-R201 VanDerWaalsContact NE2-O 3.07Å; R201-D223 WeakPolarHBondContact CD-OD2 3.46Å; R201-D223 IonicContact CZ-OD1 3.19Å; R201-D223 IonicContact CZ-OD2 3.26Å; R201-D223 IonicContact NE-OD2 3.8Å; R201-D223 IonicContact NH1-OD1 3.57Å; R201-D223 PolarHBondContact NH1-OD1 2.88Å; R201-D223 IonicContact NH1-OD2 2.67Å; R201-D223 PolarHBondContact NH1-OD2 2.94Å
202	P	50.8	Low	80.5	Confident	130 Å²	130	59.7 Å²	59.7	84%	0.844	30%	0.296	S	S	*	.	S	Bend	cis	-80.4	-12.6	4.6	33.2	-36.9	0	0	0	114.8
203	T	55.7	Low	80.7	Confident	75 Å²	75	54 Å²	54	46%	0.46	27%	0.271	S	S	.	.			trans	-146.7	150.1	-174.8	42.3	0	0	0	0	110.3	I205	T203-I205 PolarHBondContact O-N 3.25Å; T203-I205 VanDerWaalsContact OG1-CD1 3.25Å; T203-I205 WeakPolarHBondContact OG1-CD1 3.45Å
204	I	60.1	Low	80.7	Confident	81 Å²	81	49.9 Å²	49.9	42%	0.415	25%	0.249	S	C	.	.			trans	-78.8	71.3	178	-48.4	179.2	0	0	0	110.1	R198 Q199 A298	R198-I204 HydrophobicContact CB-CG2 4.3Å; Q199-I204 WeakPolarHBondContact O-CA 3.47Å; I204-A298 HydrophobicContact CD1-CB 4.43Å
205	I	66.1	Low	80.3	Confident	64 Å²	64	52.2 Å²	52.2	33%	0.328	26%	0.264	S	S	.	.			trans	-112.6	128.4	179.3	-64	176.6	0	0	0	108.4	T203 R207	T203-I205 PolarHBondContact O-N 3.25Å; T203-I205 VanDerWaalsContact OG1-CD1 3.25Å; T203-I205 WeakPolarHBondContact OG1-CD1 3.45Å; I205-R207 VanDerWaalsContact C-N 3.33Å; I205-R207 HydrophobicContact CG2-CB 3.75Å
206	S	77.4	Confident	80.1	Confident	6 Å²	6	54.7 Å²	54.7	4%	0.042	28%	0.284	C	S	.	.	S	Bend	trans	-76.6	-23	177.6	-42.9	0	0	0	0	112.6	Y182 L208 F719	Y182-S206 VanDerWaalsContact CD1-C 3.46Å; Y182-S206 VanDerWaalsContact CD1-O 3.25Å; Y182-S206 WeakPolarHBondContact CD1-O 3.3Å; S206-L208 PolarHBondContact O-N 2.83Å; S206-F719 VanDerWaalsContact OG-CE2 3.22Å; S206-F719 WeakPolarHBondContact OG-CE2 3.49Å; S206-F719 WeakPolarHBondContact OG-CZ 3.46Å
207	R	87.9	Confident	80	Confident	58 Å²	58	56.6 Å²	56.6	22%	0.219	30%	0.297	C	S	.	.			trans	-77.5	106.4	178.6	-179.3	164	51.8	157.1	-16	110.5	Y180 Y182 I205 D238 E717	Y180-R207 HydrophobicContact CD1-CG 3.92Å; Y180-R207 HydrophobicContact CG-CG 4.05Å; Y182-R207 HydrophobicContact CD1-CB 4.47Å; Y182-R207 HydrophobicContact CE1-CB 3.7Å; Y182-R207 HydrophobicContact CE2-CB 4.5Å; I205-R207 VanDerWaalsContact C-N 3.33Å; I205-R207 HydrophobicContact CG2-CB 3.75Å; R207-D238 IonicContact CZ-OD1 3.8Å; R207-D238 IonicContact NH1-OD1 3.12Å; R207-D238 PolarHBondContact NH1-OD1 3.35Å; R207-E717 IonicContact CZ-OE1 3.03Å; R207-E717 IonicContact NE-OE1 3.37Å; R207-E717 IonicContact NH2-OE1 3.85Å; R207-E717 PolarHBondContact NH2-OE1 3.3Å
208	L	90.6	Very high	80	Confident	10 Å²	10	59.6 Å²	59.6	5%	0.052	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	143.8	177	-59.5	179.3	0	0	0	111.1	Y180 F181 I183 Y197 Q199 S206 V220 L222	Y180-L208 CarbonylContact C-O 3.58Å; Y180-L208 VanDerWaalsContact CA-O 3.27Å; Y180-L208 WeakPolarHBondContact CA-O 3.18Å; F181-L208 HydrophobicContact CD1-CB 4.18Å; F181-L208 HydrophobicContact CD2-CB 4.39Å; F181-L208 HydrophobicContact CD2-CD1 4.43Å; F181-L208 HydrophobicContact CE1-CB 3.81Å; F181-L208 HydrophobicContact CE2-CB 4.07Å; F181-L208 HydrophobicContact CE2-CD1 3.73Å; F181-L208 HydrophobicContact CG-CB 4.45Å; F181-L208 HydrophobicContact CZ-CB 3.76Å; F181-L208 HydrophobicContact CZ-CD1 3.92Å; F181-L208 PolarHBondContact N-O 2.57Å; F181-L208 WeakPolarHBondContact O-CB 3.47Å; F181-L208 PolarHBondContact O-N 3.15Å; I183-L208 HydrophobicContact CD1-CD1 3.61Å; I183-L208 HydrophobicContact CG1-CD1 3.86Å; Y197-L208 HydrophobicContact CD1-CD1 4.18Å; Y197-L208 HydrophobicContact CD1-CD2 4.43Å; Y197-L208 HydrophobicContact CE1-CD1 4.46Å; Y197-L208 HydrophobicContact CE1-CD2 4.31Å; Q199-L208 HydrophobicContact CB-CD2 4.23Å; S206-L208 PolarHBondContact O-N 2.83Å; L208-V220 HydrophobicContact CD1-CG1 4.39Å; L208-L222 HydrophobicContact CD1-CD2 4.23Å
209	L	90.7	Very high	80.2	Confident	77 Å²	77	61.4 Å²	61.4	40%	0.403	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	116.6	178.3	178.7	65.5	0	0	0	110.8	Y180 K218 V220	Y180-L209 HydrophobicContact CD1-CD1 4.13Å; Y180-L209 HydrophobicContact CE1-CD1 3.69Å; L209-K218 VanDerWaalsContact O-CE 3.29Å; L209-K218 WeakPolarHBondContact O-CE 3.39Å; L209-V220 WeakPolarHBondContact O-CG2 3.47Å
210	G	90.8	Very high	80.7	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.317	C	S	.	.			trans	-90.5	-151.9	177.8	0	0	0	0	0	114.2	T178 P179 K218	T178-G210 CarbonylContact O-C 3.55Å; T178-G210 WeakPolarHBondContact O-CA 3.4Å; P179-G210 WeakPolarHBondContact O-CA 3.48Å; P179-G210 PolarHBondContact O-N 2.79Å; G210-K218 VanDerWaalsContact O-CD 3.27Å; G210-K218 WeakPolarHBondContact O-CD 3.36Å; G210-K218 WeakPolarHBondContact O-CG 3.37Å
211	G	87.1	Confident	81.5	Confident	3 Å²	3	63.6 Å²	63.6	3%	0.031	34%	0.337	C	S	.	.			trans	-82.4	146.2	-178.9	0	0	0	0	0	112.4	Y177 T178 P179	Y177-G211 WeakPolarHBondContact CD2-O 3.05Å; T178-G211 CarbonylContact C-O 3.57Å; T178-G211 PolarHBondContact O-N 3.35Å; P179-G211 WeakPolarHBondContact CA-O 3.22Å
212	L	87.5	Confident	82.8	Confident	129 Å²	129	58.4 Å²	58.4	68%	0.675	32%	0.317	S	S	*	.	S	Bend	trans	-101.6	1.4	173.4	-59	179.7	0	0	0	112.7
213	D	86.6	Confident	84.6	Confident	50 Å²	50	54 Å²	54	27%	0.267	29%	0.287	S	S	.	.	S	Bend	trans	-150.8	163.1	174.7	175.7	44.2	0	0	0	109.1	S175 Y177 L215 V216	S175-D213 PolarHBondContact OG-OD1 3.02Å; Y177-D213 WeakPolarHBondContact CB-O 3.43Å; D213-L215 WeakPolarHBondContact OD2-CB 3.43Å; D213-L215 PolarHBondContact OD2-N 2.83Å; D213-V216 PolarHBondContact OD2-N 2.86Å
214	A	86.8	Confident	86.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	-74.8	-36.3	175.6	0	0	0	0	0	113.9	G167 L168 S175 R246	G167-A214 CarbonylContact C-O 3.24Å; G167-A214 PolarHBondContact N-O 3.15Å; G167-A214 VanDerWaalsContact N-O 3.16Å; L168-A214 VanDerWaalsContact O-CB 3.24Å; L168-A214 WeakPolarHBondContact O-CB 3.37Å; S175-A214 VanDerWaalsContact OG-CB 3.25Å; S175-A214 WeakPolarHBondContact OG-CB 3.37Å; S175-A214 PolarHBondContact OG-N 2.81Å; S175-A214 VanDerWaalsContact OG-N 3.11Å; A214-R246 PolarHBondContact O-NH2 3.39Å
215	L	82.8	Confident	87.7	Confident	95 Å²	95	48.8 Å²	48.8	50%	0.497	26%	0.259	S	S	.	.	S	Bend	trans	-85.7	-28.7	-172	-58.2	177	0	0	0	112.7	T132 L169 D213 P217	T132-L215 HydrophobicContact CG2-CD2 4.5Å; L169-L215 HydrophobicContact CB-CD2 4.22Å; D213-L215 WeakPolarHBondContact OD2-CB 3.43Å; D213-L215 PolarHBondContact OD2-N 2.83Å; L215-P217 WeakPolarHBondContact O-CD 3.46Å
216	V	88	Confident	89	Confident	94 Å²	94	45.9 Å²	45.9	57%	0.57	25%	0.245	S	C	*	.	S	Bend	trans	-89.1	112.4	-178.3	-176.6	0	0	0	0	111.1	D213 K218	D213-V216 PolarHBondContact OD2-N 2.86Å; V216-K218 PolarHBondContact O-N 3.01Å
217	P	89.5	Confident	89.8	Confident	57 Å²	57	46.2 Å²	46.2	37%	0.37	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-71.2	126.7	177.1	28.8	-34.1	0	0	0	111.8	V164 L215 F219	V164-P217 HydrophobicContact CG1-CB 3.87Å; L215-P217 WeakPolarHBondContact O-CD 3.46Å; P217-F219 HydrophobicContact CG-CE2 4.46Å; P217-F219 HydrophobicContact CG-CZ 4.43Å
218	K	93.5	Very high	90.2	Very high	69 Å²	69	43.4 Å²	43.4	30%	0.3	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	116	172.7	178.1	77.1	173	-167.2	0	110	V164 I165 L209 G210 V216 V220	V164-K218 CarbonylContact C-O 3.58Å; V164-K218 VanDerWaalsContact CA-O 3.32Å; V164-K218 WeakPolarHBondContact CA-O 3.4Å; I165-K218 HydrophobicContact CG2-CB 3.88Å; I165-K218 HydrophobicContact CG2-CG 4.29Å; I165-K218 PolarHBondContact N-O 2.84Å; I165-K218 WeakPolarHBondContact O-CB 3.34Å; I165-K218 PolarHBondContact O-N 2.92Å; L209-K218 VanDerWaalsContact O-CE 3.29Å; L209-K218 WeakPolarHBondContact O-CE 3.39Å; G210-K218 VanDerWaalsContact O-CD 3.27Å; G210-K218 WeakPolarHBondContact O-CD 3.36Å; G210-K218 WeakPolarHBondContact O-CG 3.37Å; V216-K218 PolarHBondContact O-N 3.01Å; K218-V220 HydrophobicContact CG-CG2 3.86Å
219	F	92.1	Very high	90.4	Very high	115 Å²	115	46.2 Å²	46.2	50%	0.504	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	130.4	166.8	-56.2	-81.2	0	0	0	110.3	K162 V164 P217	K162-F219 VanDerWaalsContact CE-CD1 3.47Å; K162-F219 VanDerWaalsContact NZ-CD1 3.29Å; V164-F219 HydrophobicContact CB-CD1 4.25Å; V164-F219 HydrophobicContact CG1-CD1 3.79Å; V164-F219 HydrophobicContact CG1-CE1 3.81Å; V164-F219 HydrophobicContact CG1-CG 4.48Å; V164-F219 HydrophobicContact CG1-CZ 4.49Å; V164-F219 HydrophobicContact CG2-CD1 3.43Å; V164-F219 VanDerWaalsContact CG2-CD1 3.43Å; V164-F219 HydrophobicContact CG2-CE1 3.85Å; V164-F219 HydrophobicContact CG2-CG 4.46Å; P217-F219 HydrophobicContact CG-CE2 4.46Å; P217-F219 HydrophobicContact CG-CZ 4.43Å
220	V	92.2	Very high	90.6	Very high	16 Å²	16	43.7 Å²	43.7	10%	0.097	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	118.2	175.3	-175.6	0	0	0	0	108.4	K162 V163 F181 L208 L209 K218	K162-V220 CarbonylContact C-O 3.51Å; K162-V220 WeakPolarHBondContact CA-O 3.41Å; K162-V220 WeakPolarHBondContact CG-O 3.38Å; V163-V220 HydrophobicContact CG2-CB 3.92Å; V163-V220 HydrophobicContact CG2-CG1 4.49Å; V163-V220 PolarHBondContact N-O 2.9Å; V163-V220 PolarHBondContact O-N 2.91Å; V163-V220 VanDerWaalsContact O-O 3.11Å; F181-V220 HydrophobicContact CE1-CG2 4.15Å; F181-V220 HydrophobicContact CZ-CB 4.5Å; F181-V220 HydrophobicContact CZ-CG2 4.07Å; L208-V220 HydrophobicContact CD1-CG1 4.39Å; L209-V220 WeakPolarHBondContact O-CG2 3.47Å; K218-V220 HydrophobicContact CG-CG2 3.86Å
221	V	91.2	Very high	90.9	Very high	93 Å²	93	43.8 Å²	43.8	56%	0.564	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	135.6	175.1	178.6	0	0	0	0	108.5	K162	K162-V221 HydrophobicContact CG-CG2 4.43Å
222	L	91.6	Very high	91.3	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.021	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	118.7	177.8	-56.4	-175.3	0	0	0	108.9	I160 T161 V163 I183 Y197 L208 P224 L226	I160-L222 HydrophobicContact CB-CD1 4.19Å; I160-L222 HydrophobicContact CG2-CD1 3.86Å; T161-L222 PolarHBondContact O-N 3.01Å; V163-L222 HydrophobicContact CG1-CD1 4.38Å; I183-L222 HydrophobicContact CD1-CD1 4.36Å; I183-L222 HydrophobicContact CD1-CD2 3.98Å; Y197-L222 HydrophobicContact CE1-CD2 3.88Å; Y197-L222 HydrophobicContact CE2-CB 4.45Å; Y197-L222 WeakPolarHBondContact OH-CA 3.4Å; Y197-L222 WeakPolarHBondContact OH-CB 3.23Å; L208-L222 HydrophobicContact CD1-CD2 4.23Å; L222-P224 VanDerWaalsContact C-C 3.46Å; L222-P224 CarbonylContact C-O 3.43Å; L222-P224 CarbonylContact O-C 3.59Å; L222-P224 VanDerWaalsContact O-C 3.31Å; L222-L226 HydrophobicContact CD1-CB 3.77Å; L222-L226 HydrophobicContact CD1-CD2 4.35Å
223	D	87.6	Confident	91.7	Very high	38 Å²	38	39.1 Å²	39.1	20%	0.203	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	95.5	177.7	172.9	34.3	0	0	0	108.1	Y197 L200 R201	Y197-D223 PolarHBondContact OH-N 3.14Å; L200-D223 PolarHBondContact N-O 3.02Å; R201-D223 WeakPolarHBondContact CD-OD2 3.46Å; R201-D223 IonicContact CZ-OD1 3.19Å; R201-D223 IonicContact CZ-OD2 3.26Å; R201-D223 IonicContact NE-OD2 3.8Å; R201-D223 IonicContact NH1-OD1 3.57Å; R201-D223 PolarHBondContact NH1-OD1 2.88Å; R201-D223 IonicContact NH1-OD2 2.67Å; R201-D223 PolarHBondContact NH1-OD2 2.94Å
224	P	89.7	Confident	92.2	Very high	16 Å²	16	37.3 Å²	37.3	10%	0.104	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-74.4	161.2	10.3	35.9	-42.5	0	0	0	113.8	Y197 L222 C308 D329	Y197-P224 HydrophobicContact CE2-CG 4.46Å; Y197-P224 WeakPolarHBondContact CE2-O 3.44Å; Y197-P224 PolarHBondContact OH-O 3.07Å; L222-P224 VanDerWaalsContact C-C 3.46Å; L222-P224 CarbonylContact C-O 3.43Å; L222-P224 CarbonylContact O-C 3.59Å; L222-P224 VanDerWaalsContact O-C 3.31Å; P224-C308 HydrophobicContact CB-CB 4.1Å; P224-C308 HydrophobicContact CG-CB 3.83Å; P224-D329 HydrophobicContact CB-CB 4.36Å
225	P	92.3	Very high	92.6	Very high	30 Å²	30	37.4 Å²	37.4	20%	0.195	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	146.5	163.4	-24.5	36.5	0	0	0	112.1	I159 I160 T161 D329	I159-P225 HydrophobicContact CG2-CB 3.7Å; I160-P225 WeakPolarHBondContact O-CA 3.47Å; T161-P225 HydrophobicContact CG2-CB 4.26Å; T161-P225 HydrophobicContact CG2-CG 4.44Å; P225-D329 WeakPolarHBondContact CD-O 3.48Å; P225-D329 WeakPolarHBondContact CG-O 3.3Å
226	L	93.6	Very high	93.2	Very high	4 Å²	4	33.8 Å²	33.8	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	117.5	-174	168.4	56.9	0	0	0	111.5	I160 I183 Y185 Y197 L222 A228 I231	I160-L226 HydrophobicContact CB-CB 4.31Å; I160-L226 HydrophobicContact CD1-CD2 4.3Å; I160-L226 HydrophobicContact CD1-CG 4.49Å; I160-L226 PolarHBondContact N-O 3.09Å; I160-L226 PolarHBondContact O-N 2.88Å; I183-L226 HydrophobicContact CG2-CD2 3.72Å; Y185-L226 HydrophobicContact CD1-CD1 3.51Å; Y185-L226 HydrophobicContact CD1-CD2 4.25Å; Y185-L226 HydrophobicContact CD2-CD1 3.6Å; Y185-L226 HydrophobicContact CE1-CD1 3.58Å; Y185-L226 HydrophobicContact CE2-CD1 3.64Å; Y185-L226 HydrophobicContact CG-CD1 3.52Å; Y185-L226 HydrophobicContact CG-CD2 4.42Å; Y185-L226 HydrophobicContact CG-CG 4.5Å; Y197-L226 HydrophobicContact CD2-CB 4.18Å; Y197-L226 HydrophobicContact CD2-CD1 4.21Å; Y197-L226 HydrophobicContact CD2-CD2 4.3Å; Y197-L226 HydrophobicContact CD2-CG 4.47Å; Y197-L226 HydrophobicContact CE2-CB 4.13Å; L222-L226 HydrophobicContact CD1-CB 3.77Å; L222-L226 HydrophobicContact CD1-CD2 4.35Å; L226-A228 HydrophobicContact CD1-CB 4.19Å; L226-A228 HydrophobicContact CG-CB 4.05Å; L226-I231 HydrophobicContact CD2-CG2 4.34Å
227	I	94.9	Very high	93.4	Very high	12 Å²	12	31.2 Å²	31.2	6%	0.062	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	106	174.8	-57.2	175.8	0	0	0	109.7	L157 N158 I159 R187 F254 L324 I328	L157-I227 HydrophobicContact CD1-CG2 4.12Å; L157-I227 HydrophobicContact CD2-CG2 4.13Å; L157-I227 HydrophobicContact CG-CG2 4.01Å; N158-I227 WeakPolarHBondContact O-CA 3.42Å; I159-I227 HydrophobicContact CG1-CG1 4.35Å; R187-I227 WeakPolarHBondContact CG-O 3.23Å; R187-I227 PolarHBondContact NH1-O 3.48Å; I227-F254 HydrophobicContact CD1-CD1 4.4Å; I227-F254 HydrophobicContact CD1-CE1 3.93Å; I227-F254 HydrophobicContact CD1-CZ 4.12Å; I227-F254 HydrophobicContact CG2-CD1 3.48Å; I227-F254 VanDerWaalsContact CG2-CD1 3.48Å; I227-F254 HydrophobicContact CG2-CE1 3.78Å; I227-F254 HydrophobicContact CG2-CG 4.38Å; I227-L324 HydrophobicContact CB-CD1 4.06Å; I227-L324 HydrophobicContact CD1-CD1 3.94Å; I227-L324 HydrophobicContact CG2-CD1 3.89Å; I227-I328 HydrophobicContact CD1-CD1 4.43Å
228	A	95.5	Very high	93.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	154.4	-172.5	0	0	0	0	0	113	M154 N158 Y185 L226 I231	M154-A228 HydrophobicContact CE-CB 4.42Å; M154-A228 WeakPolarHBondContact CE-O 3.27Å; N158-A228 PolarHBondContact N-O 2.65Å; N158-A228 PolarHBondContact O-N 3.33Å; Y185-A228 HydrophobicContact CD2-CB 4.19Å; Y185-A228 HydrophobicContact CG-CB 4.31Å; L226-A228 HydrophobicContact CD1-CB 4.19Å; L226-A228 HydrophobicContact CG-CB 4.05Å; A228-I231 HydrophobicContact CB-CG2 3.9Å
229	R	94.3	Very high	93.2	Very high	69 Å²	69	33.7 Å²	33.7	26%	0.26	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	-46.4	164.2	169.2	171.8	163.3	-174.8	-7.6	110.8	D153 M154 G155 E156 L157 K186	D153-R229 WeakPolarHBondContact OD1-CG 3.44Å; D153-R229 IonicContact OD1-CZ 3.41Å; D153-R229 IonicContact OD1-NE 2.74Å; D153-R229 PolarHBondContact OD1-NE 3.32Å; D153-R229 IonicContact OD1-NH2 3.96Å; D153-R229 PolarHBondContact OD1-NH2 2.93Å; D153-R229 IonicContact OD2-CZ 3.42Å; D153-R229 IonicContact OD2-NE 2.7Å; D153-R229 IonicContact OD2-NH2 2.68Å; D153-R229 PolarHBondContact OD2-NH2 3.38Å; M154-R229 WeakPolarHBondContact CB-O 3.41Å; M154-R229 VanDerWaalsContact CE-O 3.28Å; M154-R229 WeakPolarHBondContact CE-O 3.23Å; M154-R229 PolarHBondContact N-O 2.57Å; G155-R229 PolarHBondContact O-NE 3.4Å; G155-R229 PolarHBondContact O-NH1 3.39Å; E156-R229 WeakPolarHBondContact O-CB 3.44Å; E156-R229 WeakPolarHBondContact O-CG 3.29Å; L157-R229 HydrophobicContact CD1-CB 4.29Å; K186-R229 PolarHBondContact O-N 3.33Å
230	W	95.6	Very high	93.2	Very high	24 Å²	24	32.6 Å²	32.6	9%	0.091	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	137.7	172.3	-60.4	-96.9	0	0	0	110.2	I152 D153 Y185 K186 E188 I189 W194	I152-W230 VanDerWaalsContact O-CA 3.29Å; I152-W230 WeakPolarHBondContact O-CA 3.45Å; D153-W230 PolarHBondContact OD2-NE1 3.11Å; D153-W230 VanDerWaalsContact OD2-NE1 3.09Å; Y185-W230 WeakPolarHBondContact CA-O 3.36Å; Y185-W230 WeakPolarHBondContact CB-O 3.42Å; K186-W230 HydrophobicContact CB-CB 4.38Å; K186-W230 HydrophobicContact CB-CE3 4.05Å; K186-W230 PolarHBondContact N-O 2.89Å; K186-W230 PolarHBondContact O-N 2.74Å; E188-W230 VanDerWaalsContact C-CZ3 3.46Å; I189-W230 HydrophobicContact CB-CH2 3.7Å; I189-W230 HydrophobicContact CB-CZ2 4.09Å; I189-W230 HydrophobicContact CG1-CH2 4.45Å; I189-W230 HydrophobicContact CG1-CZ2 4.36Å; W194-W230 HydrophobicContact CH2-CB 3.66Å; W194-W230 HydrophobicContact CH2-CG 4.42Å; W194-W230 HydrophobicContact CZ3-CB 3.85Å
231	I	96.2	Very high	93.2	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	148.1	168.7	59.4	174.1	0	0	0	110.9	E151 I152 M154 I160 R184 L226 A228 L247	E151-I231 CarbonylContact C-O 3.54Å; E151-I231 WeakPolarHBondContact CA-O 3.5Å; I152-I231 HydrophobicContact CB-CG1 4Å; I152-I231 HydrophobicContact CD1-CD1 4.31Å; I152-I231 HydrophobicContact CD1-CG1 4.41Å; I152-I231 HydrophobicContact CG1-CG1 4.5Å; I152-I231 PolarHBondContact N-O 3.17Å; I152-I231 PolarHBondContact O-N 2.77Å; M154-I231 HydrophobicContact CE-CG2 4.47Å; I160-I231 HydrophobicContact CD1-CD1 4.2Å; I160-I231 HydrophobicContact CD1-CG2 3.71Å; R184-I231 CarbonylContact O-C 3.56Å; R184-I231 WeakPolarHBondContact O-CA 3.27Å; L226-I231 HydrophobicContact CD2-CG2 4.34Å; A228-I231 HydrophobicContact CB-CG2 3.9Å; I231-L247 HydrophobicContact CD1-CD2 4.27Å
232	R	96.7	Very high	93.2	Very high	34 Å²	34	31.9 Å²	31.9	13%	0.128	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	129.3	169.4	-74.3	179.9	177.5	-167.4	-4.1	109.8	Y149 V150 E151 I183 R184 W194 Y234	Y149-R232 HydrophobicContact CD2-CB 4.27Å; Y149-R232 HydrophobicContact CD2-CG 3.7Å; Y149-R232 HydrophobicContact CE2-CG 4.15Å; Y149-R232 VanDerWaalsContact CE2-NE 3.29Å; Y149-R232 HydrophobicContact CG-CB 4.48Å; Y149-R232 HydrophobicContact CG-CG 4.3Å; Y149-R232 VanDerWaalsContact CZ-NH1 3.27Å; Y149-R232 VanDerWaalsContact OH-CZ 3.31Å; Y149-R232 PolarHBondContact OH-NH1 2.96Å; Y149-R232 PolarHBondContact OH-NH2 3.27Å; Y149-R232 VanDerWaalsContact OH-NH2 3.11Å; V150-R232 CarbonylContact O-C 3.55Å; V150-R232 VanDerWaalsContact O-CA 3.26Å; V150-R232 WeakPolarHBondContact O-CA 3.38Å; E151-R232 HydrophobicContact CB-CG 3.93Å; E151-R232 HydrophobicContact CG-CG 3.94Å; E151-R232 IonicContact OE2-CZ 3.39Å; E151-R232 IonicContact OE2-NE 2.68Å; E151-R232 PolarHBondContact OE2-NE 3.03Å; E151-R232 IonicContact OE2-NH2 3.22Å; E151-R232 PolarHBondContact OE2-NH2 3.26Å; I183-R232 WeakPolarHBondContact CA-O 3.48Å; R184-R232 HydrophobicContact CB-CB 4.19Å; R184-R232 PolarHBondContact N-O 2.77Å; R184-R232 PolarHBondContact O-N 2.87Å; W194-R232 VanDerWaalsContact CE2-CZ 3.42Å; W194-R232 VanDerWaalsContact CE2-NE 3.28Å; W194-R232 HydrophobicContact CE3-CG 4.11Å; W194-R232 HydrophobicContact CH2-CG 3.81Å; W194-R232 HydrophobicContact CZ2-CG 4.27Å; W194-R232 HydrophobicContact CZ3-CB 4.44Å; W194-R232 HydrophobicContact CZ3-CG 3.72Å; R232-Y234 HydrophobicContact CB-CD2 4.03Å; R232-Y234 HydrophobicContact CB-CE2 3.54Å; R232-Y234 HydrophobicContact CG-CE2 4.34Å; R232-Y234 PolarHBondContact NH1-OH 2.68Å
233	I	96.1	Very high	93.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	115.6	172.5	-52.7	-56.2	0	0	0	108.8	Y149 V150 I165 F181 I183 P235 I245 L247	Y149-I233 VanDerWaalsContact CA-O 3.29Å; Y149-I233 WeakPolarHBondContact CA-O 3.32Å; V150-I233 HydrophobicContact CG1-CB 3.96Å; V150-I233 HydrophobicContact CG1-CG1 4.49Å; V150-I233 PolarHBondContact N-O 3.01Å; V150-I233 PolarHBondContact O-N 2.78Å; I165-I233 HydrophobicContact CD1-CG2 4.46Å; F181-I233 HydrophobicContact CB-CG2 4.19Å; F181-I233 HydrophobicContact CD2-CG2 3.95Å; F181-I233 HydrophobicContact CG-CG2 4.36Å; I183-I233 HydrophobicContact CG1-CD1 3.89Å; I183-I233 HydrophobicContact CG2-CD1 4.49Å; I233-P235 WeakPolarHBondContact O-CD 3.41Å; I233-I245 HydrophobicContact CG2-CD1 3.91Å; I233-L247 HydrophobicContact CD1-CD1 4.36Å; I233-L247 HydrophobicContact CD1-CD2 4.21Å; I233-L247 HydrophobicContact CG1-CD1 4.28Å; I233-L247 HydrophobicContact CG1-CD2 3.79Å
234	Y	96.3	Very high	93.5	Very high	12 Å²	12	30.1 Å²	30.1	5%	0.047	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	104.4	177.3	-74.8	-96.3	0	0	0	109.3	C146 E148 Y149 F181 Y182 R184 R232	C146-Y234 HydrophobicContact CB-CD1 4.48Å; C146-Y234 WeakPolarHBondContact O-CD1 3.26Å; C146-Y234 WeakPolarHBondContact O-CE1 3.39Å; E148-Y234 VanDerWaalsContact O-CD1 3.29Å; E148-Y234 WeakPolarHBondContact O-CD1 3.16Å; Y149-Y234 HydrophobicContact CD1-CD1 4.29Å; Y149-Y234 AromaticContact CD1-CE1 3.43Å; Y149-Y234 HydrophobicContact CD1-CE1 3.43Å; Y149-Y234 VanDerWaalsContact CD1-CE1 3.43Å; Y149-Y234 HydrophobicContact CD1-CE2 4.33Å; Y149-Y234 AromaticContact CD1-CZ 3.44Å; Y149-Y234 VanDerWaalsContact CD1-CZ 3.44Å; Y149-Y234 VanDerWaalsContact CD1-OH 3.31Å; Y149-Y234 WeakPolarHBondContact CD1-OH 3.4Å; Y149-Y234 HydrophobicContact CE1-CE1 4.4Å; Y149-Y234 HydrophobicContact CG-CD1 4.5Å; Y149-Y234 AromaticContact CG-CE1 3.93Å; Y149-Y234 HydrophobicContact CG-CE1 3.93Å; Y149-Y234 HydrophobicContact CG-CE2 4.18Å; Y149-Y234 AromaticContact CG-CZ 3.74Å; F181-Y234 CarbonylContact C-O 3.57Å; F181-Y234 WeakPolarHBondContact CA-O 3.2Å; F181-Y234 WeakPolarHBondContact CB-O 3.31Å; Y182-Y234 PolarHBondContact N-O 3.4Å; Y182-Y234 PolarHBondContact O-N 2.8Å; R184-Y234 HydrophobicContact CB-CD2 4.31Å; R184-Y234 HydrophobicContact CB-CE2 3.9Å; R184-Y234 HydrophobicContact CG-CD2 4.43Å; R184-Y234 HydrophobicContact CG-CE2 4.11Å; R232-Y234 HydrophobicContact CB-CD2 4.03Å; R232-Y234 HydrophobicContact CB-CE2 3.54Å; R232-Y234 HydrophobicContact CG-CE2 4.34Å; R232-Y234 PolarHBondContact NH1-OH 2.68Å
235	P	95.5	Very high	93.6	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.013	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	144.8	172.3	26.1	-33.9	0	0	0	111.5	W136 P138 I142 E148 T178 I233 V243 I245	W136-P235 HydrophobicContact CH2-CG 4.38Å; W136-P235 HydrophobicContact CZ3-CG 4.29Å; P138-P235 HydrophobicContact CG-CG 4.21Å; I142-P235 HydrophobicContact CD1-CG 3.97Å; I142-P235 HydrophobicContact CG1-CB 4.25Å; I142-P235 HydrophobicContact CG1-CG 3.94Å; I142-P235 HydrophobicContact CG2-CB 4.22Å; I142-P235 HydrophobicContact CG2-CG 4.46Å; I142-P235 WeakPolarHBondContact CG2-O 3.48Å; E148-P235 WeakPolarHBondContact O-CD 3.44Å; T178-P235 HydrophobicContact CG2-CB 3.77Å; I233-P235 WeakPolarHBondContact O-CD 3.41Å; P235-V243 HydrophobicContact CB-CG2 3.87Å; P235-V243 HydrophobicContact CG-CG2 4.1Å; P235-I245 HydrophobicContact CB-CD1 4.05Å; P235-I245 HydrophobicContact CG-CD1 4.28Å
236	Y	94	Very high	93.6	Very high	20 Å²	20	29 Å²	29	8%	0.078	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	145.8	177.8	-177.6	-87.6	0	0	0	110.8	T144 Y180 Y182	T144-Y236 HydrophobicContact CG2-CE2 4.08Å; Y180-Y236 HydrophobicContact CD2-CD1 4.3Å; Y180-Y236 HydrophobicContact CG-CD1 4.48Å; Y180-Y236 PolarHBondContact N-O 3.22Å; Y180-Y236 PolarHBondContact O-N 3.14Å; Y180-Y236 VanDerWaalsContact O-O 3.07Å; Y182-Y236 AromaticContact CE2-CD2 3.59Å; Y182-Y236 HydrophobicContact CE2-CD2 3.59Å; Y182-Y236 HydrophobicContact CE2-CE2 4.26Å; Y182-Y236 AromaticContact CE2-CG 3.75Å; Y182-Y236 HydrophobicContact CE2-CG 3.75Å
237	R	92.4	Very high	93.5	Very high	39 Å²	39	29.1 Å²	29.1	15%	0.147	15%	0.146	C	C	.	.			trans	-152.8	132.7	172.5	-163.5	-177.6	-75.6	178.5	2.6	109.6	S143 Y177 P179 T239 F242	S143-R237 CarbonylContact C-O 3.49Å; S143-R237 VanDerWaalsContact C-O 3.31Å; Y177-R237 PolarHBondContact O-NH2 3.4Å; P179-R237 HydrophobicContact CG-CB 4.28Å; P179-R237 HydrophobicContact CG-CG 3.84Å; R237-T239 WeakPolarHBondContact CD-O 3.45Å; R237-T239 WeakPolarHBondContact CG-O 3.22Å; R237-T239 PolarHBondContact O-N 3.18Å; R237-F242 PolarHBondContact NH1-O 3.09Å; R237-F242 PolarHBondContact NH2-O 2.83Å
238	D	90.1	Very high	93.3	Very high	80 Å²	80	29.6 Å²	29.6	43%	0.428	15%	0.148	S	C	.	.	S	Bend	trans	-68.4	-21.3	-179.6	-39.1	-104.5	0	0	0	112	Y180 R207	Y180-D238 WeakPolarHBondContact CD2-OD2 3.09Å; Y180-D238 WeakPolarHBondContact CE2-OD2 3.43Å; R207-D238 IonicContact CZ-OD1 3.8Å; R207-D238 IonicContact NH1-OD1 3.12Å; R207-D238 PolarHBondContact NH1-OD1 3.35Å
239	T	90.3	Very high	93.2	Very high	98 Å²	98	29.6 Å²	29.6	60%	0.601	15%	0.148	S	C	*	.	S	Bend	trans	-117.2	134	173.3	49	0	0	0	0	110.7	R237 G241	R237-T239 WeakPolarHBondContact CD-O 3.45Å; R237-T239 WeakPolarHBondContact CG-O 3.22Å; R237-T239 PolarHBondContact O-N 3.18Å; T239-G241 PolarHBondContact O-N 2.94Å
240	P	92	Very high	93.2	Very high	92 Å²	92	29.7 Å²	29.7	60%	0.597	15%	0.149	S	C	*	.			trans	-61.3	127.9	-177	-26.3	34.4	0	0	0	114	I142	I142-P240 CarbonylContact O-C 3.59Å; I142-P240 VanDerWaalsContact O-CA 3.29Å; I142-P240 WeakPolarHBondContact O-CA 3.34Å
241	G	90.9	Very high	93	Very high	8 Å²	8	28.5 Å²	28.5	8%	0.082	14%	0.144	C	C	.	.	B	Isolated β-bridge	trans	-173.2	172.1	176.7	0	0	0	0	0	116.1	I142 T239	I142-G241 PolarHBondContact N-O 2.9Å; I142-G241 PolarHBondContact O-N 2.84Å; T239-G241 PolarHBondContact O-N 2.94Å
242	F	90.9	Very high	92.8	Very high	87 Å²	87	29.2 Å²	29.2	38%	0.382	15%	0.149	S	C	.	.			trans	-75.9	137.1	177.6	-64	-73	0	0	0	111.6	R141 R237	R141-F242 HydrophobicContact CG-CD1 3.94Å; R141-F242 HydrophobicContact CG-CD2 4.3Å; R141-F242 HydrophobicContact CG-CE1 3.68Å; R141-F242 HydrophobicContact CG-CE2 4.07Å; R141-F242 HydrophobicContact CG-CG 4.25Å; R141-F242 HydrophobicContact CG-CZ 3.76Å; R237-F242 PolarHBondContact NH1-O 3.09Å; R237-F242 PolarHBondContact NH2-O 2.83Å
243	V	92.6	Very high	92.5	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.024	17%	0.167	C	C	.	.			trans	-123	162	172.9	-51.1	0	0	0	0	109.1	P138 I142 P235	P138-V243 HydrophobicContact CG-CG2 3.72Å; I142-V243 HydrophobicContact CB-CG1 3.97Å; I142-V243 HydrophobicContact CB-CG2 4.44Å; I142-V243 HydrophobicContact CG1-CB 4.43Å; I142-V243 HydrophobicContact CG1-CG1 4Å; I142-V243 HydrophobicContact CG1-CG2 3.56Å; I142-V243 HydrophobicContact CG2-CG1 4.49Å; P235-V243 HydrophobicContact CB-CG2 3.87Å; P235-V243 HydrophobicContact CG-CG2 4.1Å
244	C	93	Very high	92.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.17	C	C	.	.			trans	-139.8	161.4	157.9	-62.4	0	0	0	0	108.3	A135 W136 C137 L168 R176 T178	A135-C244 HydrophobicContact CB-CB 4.06Å; W136-C244 CarbonylContact O-C 3.38Å; W136-C244 VanDerWaalsContact O-CA 3.23Å; W136-C244 WeakPolarHBondContact O-CA 3.41Å; W136-C244 WeakPolarHBondContact O-CB 3.14Å; C137-C244 HydrophobicContact CB-CB 4.13Å; C137-C244 WeakPolarHBondContact CB-SG 3.28Å; C137-C244 WeakPolarHBondContact SG-CB 3.42Å; C137-C244 CovalentContact SG-SG 2.04Å; C137-C244 PolarHBondContact SG-SG 2.97Å; L168-C244 HydrophobicContact CB-CB 3.65Å; R176-C244 HydrophobicContact CB-CB 4.12Å; R176-C244 WeakPolarHBondContact CD-SG 3.23Å; T178-C244 PolarHBondContact OG1-O 3.38Å; T178-C244 VanDerWaalsContact OG1-O 3.11Å
245	I	92.9	Very high	91.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-136.7	124.6	-177.5	-67.1	173.2	0	0	0	109.7	I127 W136 I165 S166 T178 I233 P235 L247	I127-I245 HydrophobicContact CD1-CG2 3.95Å; I127-I245 HydrophobicContact CG1-CG2 3.82Å; W136-I245 HydrophobicContact CE3-CB 4.17Å; W136-I245 HydrophobicContact CE3-CD1 4.02Å; W136-I245 HydrophobicContact CE3-CG1 4.45Å; W136-I245 HydrophobicContact CZ3-CD1 3.84Å; W136-I245 PolarHBondContact N-O 3.48Å; W136-I245 PolarHBondContact O-N 2.86Å; I165-I245 HydrophobicContact CD1-CD1 4.27Å; I165-I245 HydrophobicContact CD1-CG1 4.15Å; I165-I245 HydrophobicContact CD1-CG2 4.2Å; I165-I245 HydrophobicContact CG1-CG2 4.04Å; S166-I245 CarbonylContact O-C 3.54Å; S166-I245 WeakPolarHBondContact O-CA 3.11Å; T178-I245 HydrophobicContact CG2-CD1 4.21Å; T178-I245 HydrophobicContact CG2-CG1 4.37Å; T178-I245 WeakPolarHBondContact OG1-CG1 3.47Å; I233-I245 HydrophobicContact CG2-CD1 3.91Å; P235-I245 HydrophobicContact CB-CD1 4.05Å; P235-I245 HydrophobicContact CG-CD1 4.28Å; I245-L247 HydrophobicContact CG2-CB 4.25Å
246	R	91.4	Very high	91.1	Very high	24 Å²	24	38.1 Å²	38.1	9%	0.091	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	147.7	145.2	-68.2	174	-78.5	163.8	4.7	108.8	I127 N129 E130 N131 F134 A135 I165 S166 G167 A214	I127-R246 CarbonylContact O-C 3.31Å; I127-R246 WeakPolarHBondContact O-CA 3.46Å; I127-R246 WeakPolarHBondContact O-CB 3.45Å; N129-R246 WeakPolarHBondContact O-CD 3.24Å; E130-R246 PolarHBondContact O-NH1 3.27Å; E130-R246 VanDerWaalsContact O-NH1 3.16Å; N131-R246 PolarHBondContact O-NH1 2.78Å; F134-R246 VanDerWaalsContact O-CD 3.24Å; F134-R246 WeakPolarHBondContact O-CD 3.38Å; F134-R246 WeakPolarHBondContact O-CG 3.37Å; A135-R246 HydrophobicContact CB-CG 3.73Å; I165-R246 WeakPolarHBondContact CA-O 3.31Å; S166-R246 PolarHBondContact N-O 3.25Å; S166-R246 PolarHBondContact O-N 2.94Å; S166-R246 PolarHBondContact OG-NE 3.34Å; S166-R246 PolarHBondContact OG-NH2 2.83Å; G167-R246 PolarHBondContact O-NE 3.03Å; G167-R246 PolarHBondContact O-NH2 2.89Å; A214-R246 PolarHBondContact O-NH2 3.39Å
247	L	92.3	Very high	90.9	Very high	5 Å²	5	38 Å²	38	3%	0.026	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	129.5	-176.1	-172.7	80.5	0	0	0	110	L96 I127 I152 V163 V164 I231 I233 I245	L96-L247 HydrophobicContact CD1-CD2 4.14Å; L96-L247 HydrophobicContact CD1-CG 4.45Å; I127-L247 HydrophobicContact CD1-CB 3.47Å; I127-L247 VanDerWaalsContact CD1-CB 3.47Å; I127-L247 HydrophobicContact CD1-CD2 3.99Å; I127-L247 HydrophobicContact CD1-CG 4.37Å; I127-L247 HydrophobicContact CG1-CB 3.65Å; I127-L247 PolarHBondContact O-N 2.96Å; I152-L247 HydrophobicContact CD1-CD2 3.68Å; V163-L247 HydrophobicContact CB-CD1 4.21Å; V164-L247 CarbonylContact O-C 3.48Å; V164-L247 VanDerWaalsContact O-CA 3.25Å; V164-L247 WeakPolarHBondContact O-CA 3.33Å; I231-L247 HydrophobicContact CD1-CD2 4.27Å; I233-L247 HydrophobicContact CD1-CD1 4.36Å; I233-L247 HydrophobicContact CD1-CD2 4.21Å; I233-L247 HydrophobicContact CG1-CD1 4.28Å; I233-L247 HydrophobicContact CG1-CD2 3.79Å; I245-L247 HydrophobicContact CG2-CB 4.25Å
248	E	91.4	Very high	91	Very high	23 Å²	23	36.2 Å²	36.2	11%	0.107	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139	156.1	-179.5	57.8	-156.4	0	0	109.5	S94 L95 L96 V97 V163 V164 Y250	S94-E248 VanDerWaalsContact CA-OE1 3.27Å; S94-E248 WeakPolarHBondContact CA-OE1 3.36Å; S94-E248 WeakPolarHBondContact CB-OE1 3.4Å; S94-E248 PolarHBondContact OG-OE1 2.89Å; L95-E248 PolarHBondContact N-OE1 2.87Å; L96-E248 WeakPolarHBondContact CB-OE2 3.48Å; L96-E248 PolarHBondContact N-OE1 3.31Å; L96-E248 VanDerWaalsContact N-OE1 3.15Å; V97-E248 WeakPolarHBondContact CG2-OE2 3.48Å; V163-E248 CarbonylContact C-O 3.58Å; V163-E248 WeakPolarHBondContact CA-O 3.26Å; V164-E248 HydrophobicContact CB-CB 4.48Å; V164-E248 PolarHBondContact N-O 2.94Å; V164-E248 PolarHBondContact O-N 3.27Å; E248-Y250 HydrophobicContact CB-CE2 3.99Å; E248-Y250 HydrophobicContact CG-CD2 3.96Å; E248-Y250 HydrophobicContact CG-CE1 4.47Å; E248-Y250 HydrophobicContact CG-CE2 3.41Å; E248-Y250 VanDerWaalsContact CG-CE2 3.41Å
249	A	93.4	Very high	91.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	133.3	173.7	0	0	0	0	0	109.7	L95 L96 I160 V163	L95-A249 HydrophobicContact CB-CB 4.34Å; L95-A249 VanDerWaalsContact CB-O 3.28Å; L95-A249 WeakPolarHBondContact CB-O 3.4Å; L95-A249 HydrophobicContact CD1-CB 4.27Å; L95-A249 WeakPolarHBondContact CG-O 3.5Å; L95-A249 PolarHBondContact N-O 2.87Å; L96-A249 HydrophobicContact CD1-CB 4.21Å; L96-A249 HydrophobicContact CG-CB 4.14Å; I160-A249 HydrophobicContact CG2-CB 4.2Å; V163-A249 HydrophobicContact CG1-CB 4.44Å
250	Y	92.8	Very high	91.4	Very high	70 Å²	70	30 Å²	30	28%	0.275	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	145.9	179	-67.8	-96.4	0	0	0	111	Q93 I160 T161 K162 V164 E248	Q93-Y250 CarbonylContact O-C 3.56Å; Q93-Y250 VanDerWaalsContact O-CA 3.26Å; Q93-Y250 WeakPolarHBondContact O-CA 3.32Å; I160-Y250 CarbonylContact C-O 3.56Å; I160-Y250 WeakPolarHBondContact CA-O 3.36Å; T161-Y250 PolarHBondContact N-O 2.96Å; T161-Y250 PolarHBondContact OG1-O 2.76Å; K162-Y250 PolarHBondContact N-O 2.92Å; K162-Y250 PolarHBondContact O-N 2.89Å; V164-Y250 HydrophobicContact CB-CE2 4.44Å; V164-Y250 HydrophobicContact CG2-CD2 3.84Å; V164-Y250 HydrophobicContact CG2-CE2 3.48Å; V164-Y250 VanDerWaalsContact CG2-CE2 3.48Å; E248-Y250 HydrophobicContact CB-CE2 3.99Å; E248-Y250 HydrophobicContact CG-CD2 3.96Å; E248-Y250 HydrophobicContact CG-CE1 4.47Å; E248-Y250 HydrophobicContact CG-CE2 3.41Å; E248-Y250 VanDerWaalsContact CG-CE2 3.41Å
251	G	92.7	Very high	91.6	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.3	-139.3	-175.4	0	0	0	0	0	114	C91 I92 Q93 I159	C91-G251 CarbonylContact C-O 3.51Å; C91-G251 VanDerWaalsContact C-O 3.24Å; C91-G251 WeakPolarHBondContact O-CA 3.1Å; C91-G251 VanDerWaalsContact SG-C 3.52Å; I92-G251 PolarHBondContact N-O 3.37Å; Q93-G251 PolarHBondContact N-O 3.31Å; Q93-G251 PolarHBondContact O-N 3.41Å; I159-G251 CarbonylContact O-C 3.46Å; I159-G251 WeakPolarHBondContact O-CA 3.34Å
252	C	91.4	Very high	91.8	Very high	16 Å²	16	30.1 Å²	30.1	11%	0.108	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	161.9	174.8	55.8	0	0	0	0	111.8	C91 N158 I159 F254	C91-C252 HydrophobicContact CB-CB 3.88Å; C91-C252 WeakPolarHBondContact CB-SG 3.23Å; C91-C252 WeakPolarHBondContact SG-CB 3.41Å; C91-C252 PolarHBondContact SG-N 2.99Å; C91-C252 CovalentContact SG-SG 2.05Å; C91-C252 PolarHBondContact SG-SG 3.2Å; N158-C252 CarbonylContact C-O 3.52Å; N158-C252 WeakPolarHBondContact CA-O 3.15Å; I159-C252 PolarHBondContact N-O 3.01Å; I159-C252 PolarHBondContact O-N 3.25Å; C252-F254 PolarHBondContact O-N 2.79Å
253	R	90.3	Very high	91.9	Very high	132 Å²	132	26 Å²	26	50%	0.498	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	133.1	167.3	174.5	-177.3	-176.2	129.4	12.8	109.9	E156 N158 S255	E156-R253 WeakPolarHBondContact OE1-CB 3.16Å; E156-R253 WeakPolarHBondContact OE1-CD 3.46Å; E156-R253 WeakPolarHBondContact OE1-CG 3.3Å; E156-R253 IonicContact OE1-CZ 2.73Å; E156-R253 IonicContact OE1-NE 3.68Å; E156-R253 IonicContact OE1-NH1 3.91Å; E156-R253 IonicContact OE2-CZ 3.61Å; E156-R253 IonicContact OE2-NE 3.13Å; E156-R253 IonicContact OE2-NH1 3.31Å; E156-R253 PolarHBondContact OE2-NH1 2.94Å; E156-R253 IonicContact OE2-NH2 3.72Å; E156-R253 PolarHBondContact OE2-NH2 2.89Å; N158-R253 WeakPolarHBondContact OD1-CA 3.26Å; R253-S255 PolarHBondContact O-N 2.81Å
254	F	90.4	Very high	91.9	Very high	13 Å²	13	26.7 Å²	26.7	6%	0.057	12%	0.123	C	C	.	.			trans	-85.2	96.3	173.2	-170.6	-152.4	0	0	0	110	L157 I159 I227 C252 D256 D257 L258	L157-F254 HydrophobicContact CD2-CD1 3.69Å; L157-F254 HydrophobicContact CD2-CE1 4.38Å; L157-F254 HydrophobicContact CG-CB 4.36Å; L157-F254 HydrophobicContact CG-CD1 4.09Å; L157-F254 PolarHBondContact O-N 2.82Å; I159-F254 HydrophobicContact CD1-CB 4.45Å; I159-F254 HydrophobicContact CD1-CD2 3.68Å; I159-F254 HydrophobicContact CD1-CE2 4.22Å; I159-F254 HydrophobicContact CD1-CG 4.24Å; I159-F254 HydrophobicContact CG1-CB 3.76Å; I159-F254 HydrophobicContact CG1-CD2 3.9Å; I159-F254 HydrophobicContact CG1-CG 3.92Å; I227-F254 HydrophobicContact CD1-CD1 4.4Å; I227-F254 HydrophobicContact CD1-CE1 3.93Å; I227-F254 HydrophobicContact CD1-CZ 4.12Å; I227-F254 HydrophobicContact CG2-CD1 3.48Å; I227-F254 VanDerWaalsContact CG2-CD1 3.48Å; I227-F254 HydrophobicContact CG2-CE1 3.78Å; I227-F254 HydrophobicContact CG2-CG 4.38Å; C252-F254 PolarHBondContact O-N 2.79Å; F254-D256 HydrophobicContact CD2-CB 4.38Å; F254-D256 HydrophobicContact CE2-CB 3.89Å; F254-D256 HydrophobicContact CZ-CB 4.05Å; F254-D256 PolarHBondContact O-N 3.03Å; F254-D257 PolarHBondContact O-N 2.99Å; F254-L258 HydrophobicContact CE1-CB 3.91Å; F254-L258 WeakPolarHBondContact CE1-O 3.45Å; F254-L258 HydrophobicContact CZ-CB 4.01Å
255	S	84.4	Confident	91.7	Very high	70 Å²	70	27.9 Å²	27.9	49%	0.49	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-36	-174.2	44.5	0	0	0	0	114.4	R253 D257 R388	R253-S255 PolarHBondContact O-N 2.81Å; S255-D257 VanDerWaalsContact C-N 3.29Å; S255-D257 PolarHBondContact O-N 3.38Å; S255-R388 PolarHBondContact O-NH2 2.92Å
256	D	84.4	Confident	91.3	Very high	20 Å²	20	28.3 Å²	28.3	11%	0.107	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-24.7	-168.8	-63.8	34	0	0	0	111.7	F254 L258 F384 R388 F474	F254-D256 HydrophobicContact CD2-CB 4.38Å; F254-D256 HydrophobicContact CE2-CB 3.89Å; F254-D256 HydrophobicContact CZ-CB 4.05Å; F254-D256 PolarHBondContact O-N 3.03Å; D256-L258 PolarHBondContact O-N 2.79Å; D256-F384 WeakPolarHBondContact O-CD1 3.13Å; D256-R388 VanDerWaalsContact O-CD 3.26Å; D256-R388 WeakPolarHBondContact O-CD 3.47Å; D256-R388 PolarHBondContact O-NE 3.33Å; D256-R388 PolarHBondContact O-NH1 3.22Å; D256-R388 VanDerWaalsContact O-NH1 3.16Å; D256-F474 PolarHBondContact OD2-N 3.41Å
257	D	89.8	Confident	90.7	Very high	17 Å²	17	27.6 Å²	27.6	9%	0.091	13%	0.132	C	C	.	.			trans	48.5	35.1	-168.5	-58.6	-59.9	0	0	0	113.8	F254 S255 F384 A385 R388	F254-D257 PolarHBondContact O-N 2.99Å; S255-D257 VanDerWaalsContact C-N 3.29Å; S255-D257 PolarHBondContact O-N 3.38Å; D257-F384 CarbonylContact O-C 3.58Å; D257-F384 VanDerWaalsContact O-CA 3.31Å; D257-F384 WeakPolarHBondContact O-CA 3.17Å; D257-A385 HydrophobicContact CB-CB 4.12Å; D257-A385 PolarHBondContact O-N 3.05Å; D257-R388 VanDerWaalsContact CB-NH1 3.33Å; D257-R388 IonicContact OD2-CZ 2.7Å; D257-R388 IonicContact OD2-NH1 2.75Å; D257-R388 PolarHBondContact OD2-NH1 2.83Å
258	L	94.8	Very high	89.5	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	132.1	172.1	-177.2	72.8	0	0	0	109.7	F254 D256 L324 I328 F382 R383 F384	F254-L258 HydrophobicContact CE1-CB 3.91Å; F254-L258 WeakPolarHBondContact CE1-O 3.45Å; F254-L258 HydrophobicContact CZ-CB 4.01Å; D256-L258 PolarHBondContact O-N 2.79Å; L258-L324 HydrophobicContact CD2-CD2 4.11Å; L258-L324 HydrophobicContact CG-CD2 4.02Å; L258-I328 HydrophobicContact CD2-CD1 3.73Å; L258-I328 HydrophobicContact CD2-CG2 4.02Å; L258-F382 HydrophobicContact CD1-CB 3.78Å; L258-F382 HydrophobicContact CD1-CD1 4.06Å; L258-F382 HydrophobicContact CD1-CG 4.43Å; L258-F382 HydrophobicContact CD2-CD1 4.2Å; L258-R383 WeakPolarHBondContact CD1-O 3.24Å; L258-F384 HydrophobicContact CB-CD1 4.01Å; L258-F384 HydrophobicContact CB-CE1 3.82Å; L258-F384 HydrophobicContact CD1-CD1 4.06Å; L258-F384 HydrophobicContact CD1-CD2 4.33Å; L258-F384 HydrophobicContact CD1-CE1 3.7Å; L258-F384 HydrophobicContact CD1-CE2 3.96Å; L258-F384 HydrophobicContact CD1-CG 4.39Å; L258-F384 HydrophobicContact CD1-CZ 3.64Å; L258-F384 HydrophobicContact CG-CE1 4.34Å
259	V	93.8	Very high	87.8	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	-24.7	-172.6	-72.5	0	0	0	0	114.4	L157 R187 E188 R383 A385	L157-V259 HydrophobicContact CD2-CG1 4.03Å; R187-V259 HydrophobicContact CB-CG1 4.24Å; R187-V259 PolarHBondContact NE-O 2.84Å; R187-V259 PolarHBondContact NH2-O 3.15Å; E188-V259 HydrophobicContact CG-CB 4.33Å; E188-V259 HydrophobicContact CG-CG1 3.91Å; V259-R383 HydrophobicContact CG2-CG 4.37Å; V259-R383 VanDerWaalsContact CG2-O 3.22Å; V259-R383 WeakPolarHBondContact CG2-O 3.5Å; V259-R383 PolarHBondContact N-O 2.92Å; V259-A385 HydrophobicContact CG1-CB 3.76Å
260	E	94.7	Very high	85.9	Confident	46 Å²	46	35.2 Å²	35.2	22%	0.215	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	158.2	166.5	62.2	-167.7	-155	0	0	111.4	G323 L324 R383	E260-G323 CarbonylContact C-O 3.51Å; E260-G323 VanDerWaalsContact CA-O 3.31Å; E260-G323 WeakPolarHBondContact CA-O 3.37Å; E260-L324 VanDerWaalsContact CA-CD2 3.44Å; E260-R383 HydrophobicContact CG-CB 3.8Å; E260-R383 PolarHBondContact N-O 3.04Å; E260-R383 PolarHBondContact O-N 3.36Å; E260-R383 IonicContact OE1-CZ 3.55Å; E260-R383 IonicContact OE1-NE 3.99Å; E260-R383 PolarHBondContact OE1-NE 2.83Å; E260-R383 IonicContact OE1-NH2 3.44Å; E260-R383 IonicContact OE2-CZ 2.68Å; E260-R383 IonicContact OE2-NE 2.71Å; E260-R383 PolarHBondContact OE2-NE 3.39Å; E260-R383 IonicContact OE2-NH2 2.78Å; E260-R383 PolarHBondContact OE2-NH2 3.44Å
261	Y	96.2	Very high	83.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	151.1	156.3	57.1	-112.3	0	0	0	111.8	I263 D306 Y309 G323 L324 G325 C326 L327 I328 L381 F382	Y261-I263 HydrophobicContact CD2-CB 4.41Å; Y261-I263 HydrophobicContact CD2-CD1 3.74Å; Y261-I263 HydrophobicContact CD2-CG1 3.8Å; Y261-I263 HydrophobicContact CD2-CG2 3.86Å; Y261-I263 HydrophobicContact CE2-CD1 3.32Å; Y261-I263 HydrophobicContact CE2-CG1 3.79Å; Y261-I263 HydrophobicContact CG-CG2 4.44Å; Y261-D306 PolarHBondContact OH-OD2 2.86Å; Y261-Y309 HydrophobicContact CD2-CD2 4.41Å; Y261-Y309 AromaticContact CD2-CE2 3.67Å; Y261-Y309 HydrophobicContact CD2-CE2 3.67Å; Y261-Y309 AromaticContact CE2-CD2 3.58Å; Y261-Y309 HydrophobicContact CE2-CD2 3.58Å; Y261-Y309 AromaticContact CE2-CE2 3.28Å; Y261-Y309 HydrophobicContact CE2-CE2 3.28Å; Y261-Y309 AromaticContact CZ-CD2 3.95Å; Y261-Y309 AromaticContact CZ-CE2 3.94Å; Y261-Y309 PolarHBondContact O-OH 2.92Å; Y261-G323 PolarHBondContact N-O 2.96Å; Y261-L324 HydrophobicContact CD1-CD2 4.18Å; Y261-G325 WeakPolarHBondContact OH-CA 3.43Å; Y261-G325 PolarHBondContact OH-N 2.8Å; Y261-G325 VanDerWaalsContact OH-N 3.16Å; Y261-C326 PolarHBondContact OH-N 3.09Å; Y261-L327 HydrophobicContact CE1-CB 4.26Å; Y261-I328 HydrophobicContact CD1-CD1 3.87Å; Y261-I328 HydrophobicContact CE1-CD1 3.56Å; Y261-I328 HydrophobicContact CE1-CG1 3.94Å; Y261-L381 CarbonylContact C-O 3.51Å; Y261-L381 WeakPolarHBondContact CA-O 3.18Å; Y261-L381 WeakPolarHBondContact CB-O 3.07Å; Y261-F382 HydrophobicContact CD1-CD1 4.46Å; Y261-F382 HydrophobicContact CD1-CE1 4.2Å; Y261-F382 HydrophobicContact CG-CD1 4.49Å; Y261-F382 HydrophobicContact CG-CE1 4.29Å
262	R	94.4	Very high	80.6	Confident	103 Å²	103	38.7 Å²	38.7	39%	0.389	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	115	171.2	174.8	-174.8	-72.1	-171.8	-4.5	108.7	L319 L320 D321 L381	R262-L319 HydrophobicContact CG-CD1 4Å; R262-L319 HydrophobicContact CG-CD2 4.01Å; R262-L319 HydrophobicContact CG-CG 4.11Å; R262-L320 CarbonylContact C-O 3.6Å; R262-L320 VanDerWaalsContact CA-O 3.22Å; R262-L320 WeakPolarHBondContact CA-O 3.28Å; R262-D321 WeakPolarHBondContact CB-OD1 3.12Å; R262-D321 HydrophobicContact CG-CB 4.5Å; R262-D321 IonicContact CZ-OD1 2.77Å; R262-D321 IonicContact CZ-OD2 3.9Å; R262-D321 IonicContact NE-OD1 2.75Å; R262-D321 PolarHBondContact NE-OD1 2.74Å; R262-D321 IonicContact NE-OD2 3.85Å; R262-D321 PolarHBondContact NE-OD2 2.71Å; R262-D321 VanDerWaalsContact NH2-CG 3.3Å; R262-D321 IonicContact NH2-OD1 3.59Å; R262-D321 PolarHBondContact NH2-OD1 2.92Å; R262-D321 IonicContact NH2-OD2 3.2Å; R262-D321 PolarHBondContact NH2-OD2 3.06Å; R262-L381 HydrophobicContact CB-CB 4.27Å; R262-L381 PolarHBondContact N-O 3.31Å; R262-L381 PolarHBondContact O-N 2.04Å
263	I	93.9	Very high	77.9	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	155.8	-177.2	66.7	179.1	0	0	0	111.1	Y261 L320 L327 W362 M380	Y261-I263 HydrophobicContact CD2-CB 4.41Å; Y261-I263 HydrophobicContact CD2-CD1 3.74Å; Y261-I263 HydrophobicContact CD2-CG1 3.8Å; Y261-I263 HydrophobicContact CD2-CG2 3.86Å; Y261-I263 HydrophobicContact CE2-CD1 3.32Å; Y261-I263 HydrophobicContact CE2-CG1 3.79Å; Y261-I263 HydrophobicContact CG-CG2 4.44Å; I263-L320 HydrophobicContact CD1-CD1 4.18Å; I263-L320 HydrophobicContact CG1-CB 4Å; I263-L320 HydrophobicContact CG1-CD1 3.97Å; I263-L320 HydrophobicContact CG1-CG 4.4Å; I263-L320 PolarHBondContact N-O 3.26Å; I263-L320 WeakPolarHBondContact O-CB 3.18Å; I263-L320 PolarHBondContact O-N 3.23Å; I263-L327 HydrophobicContact CD1-CD1 3.66Å; I263-W362 HydrophobicContact CD1-CZ2 4.15Å; I263-M380 HydrophobicContact CB-CG 4.46Å; I263-M380 HydrophobicContact CG2-CB 3.75Å; I263-M380 HydrophobicContact CG2-CG 3.73Å; I263-M380 HydrophobicContact CG2-SD 4.39Å
264	P	91.7	Very high	75.2	Confident	19 Å²	19	50.4 Å²	50.4	12%	0.123	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	139.1	166.9	-19	32.3	0	0	0	110.6	W362 W367 V378 D379	P264-W362 PolarHBondContact O-NE1 3.27Å; P264-W367 HydrophobicContact CB-CZ2 4.28Å; P264-W367 HydrophobicContact CG-CZ2 4.03Å; P264-V378 HydrophobicContact CG-CG1 4.22Å; P264-D379 WeakPolarHBondContact CD-O 3.48Å
265	E	87.9	Confident	72.3	Confident	25 Å²	25	53.5 Å²	53.5	12%	0.117	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-53.2	152.5	170.7	175.1	60.8	-97	0	0	111.1	S305 R313 S318 L320 W362 R366	E265-S305 PolarHBondContact OE1-OG 3.26Å; E265-R313 IonicContact OE1-NH1 3.76Å; E265-R313 IonicContact OE2-CZ 2.97Å; E265-R313 IonicContact OE2-NE 3.88Å; E265-R313 IonicContact OE2-NH1 3.65Å; E265-R313 PolarHBondContact OE2-NH1 3.47Å; E265-S318 WeakPolarHBondContact CB-O 3.42Å; E265-S318 PolarHBondContact N-O 3.04Å; E265-L320 HydrophobicContact CB-CG 4.39Å; E265-L320 WeakPolarHBondContact OE2-CD2 3.31Å; E265-W362 PolarHBondContact O-NE1 3Å; E265-R366 PolarHBondContact O-NH1 3.31Å; E265-R366 VanDerWaalsContact O-NH1 3.09Å; E265-R366 PolarHBondContact O-NH2 3.03Å
266	G	85.3	Confident	69.8	Low	8 Å²	8	58.7 Å²	58.7	8%	0.082	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-60.1	152	174.9	0	0	0	0	0	112.8	F304 G361 R366	G266-F304 VanDerWaalsContact CA-O 3.31Å; G266-F304 WeakPolarHBondContact CA-O 3.13Å; G266-G361 CarbonylContact C-O 3.57Å; G266-G361 WeakPolarHBondContact CA-O 3.22Å; G266-R366 PolarHBondContact O-NH2 3.49Å
267	S	79.2	Confident	67.3	Low	10 Å²	10	64.1 Å²	64.1	7%	0.07	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-96.5	132.5	178.8	-73.4	0	0	0	0	111.2	A269 G361 H363 R366 W466	S267-A269 PolarHBondContact O-N 3.15Å; S267-G361 PolarHBondContact N-O 2.9Å; S267-H363 PolarHBondContact OG-N 3.21Å; S267-R366 PolarHBondContact OG-NE 3.17Å; S267-R366 PolarHBondContact OG-NH2 3.1Å; S267-W466 WeakPolarHBondContact O-CH2 3.43Å
268	L	67.1	Low	64.5	Low	81 Å²	81	70.3 Å²	70.3	42%	0.424	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-47.2	127.6	168.2	-62.4	174.5	0	0	0	110.7	H270 L302 W466	L268-H270 WeakPolarHBondContact CB-O 3.21Å; L268-H270 CarbonylContact O-C 3.49Å; L268-H270 PolarHBondContact O-N 3.37Å; L268-L302 HydrophobicContact CD2-CB 4.3Å; L268-L302 HydrophobicContact CD2-CD1 3.78Å; L268-L302 HydrophobicContact CD2-CD2 3.62Å; L268-L302 HydrophobicContact CD2-CG 4.1Å; L268-W466 WeakPolarHBondContact O-CH2 3.1Å
269	A	55.9	Low	61.6	Low	3 Å²	3	77.3 Å²	77.3	3%	0.025	40%	0.4	C	S	.	.	S	Bend	trans	-52.3	-27	177.2	0	0	0	0	0	113.3	S267 P303 F304 I341 W466	S267-A269 PolarHBondContact O-N 3.15Å; A269-P303 HydrophobicContact CB-CB 4.21Å; A269-P303 HydrophobicContact CB-CG 3.54Å; A269-F304 HydrophobicContact CB-CD2 4.16Å; A269-F304 HydrophobicContact CB-CE2 3.99Å; A269-I341 HydrophobicContact CB-CG2 4.34Å; A269-I341 WeakPolarHBondContact O-CG2 3.22Å; A269-W466 WeakPolarHBondContact O-CZ2 3.48Å
270	H	52.6	Low	58.6	Low	104 Å²	104	88.2 Å²	88.2	48%	0.481	44%	0.443	S	S	.	.	S	Bend	trans	-111.7	113.3	169.4	-65.3	90.3	0	0	0	110	L268	L268-H270 WeakPolarHBondContact CB-O 3.21Å; L268-H270 CarbonylContact O-C 3.49Å; L268-H270 PolarHBondContact O-N 3.37Å
271	P	40.1	Very low	55.8	Low	37 Å²	37	95.9 Å²	95.9	24%	0.24	48%	0.475	C	S	.	.			trans	-61.3	144.2	171.8	-22.7	33.9	0	0	0	111.2	Y273 H363	P271-Y273 PolarHBondContact O-N 3.04Å; P271-H363 WeakPolarHBondContact CG-ND1 3.13Å
272	P	34	Very low	52.7	Low	105 Å²	105	100.5 Å²	100.5	68%	0.682	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	15.9	-173.3	28.6	-36.1	0	0	0	115.4
273	Y	34.3	Very low	49.9	Very low	215 Å²	215	105.1 Å²	105.1	84%	0.843	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.9	13.6	-175.3	-76.9	-81.5	0	0	0	114.4	P271	P271-Y273 PolarHBondContact O-N 3.04Å
274	Q	34.3	Very low	47	Very low	179 Å²	179	108.5 Å²	108.5	84%	0.836	57%	0.569	S	S	*	*			trans	-120.8	27.6	169	-67.6	-164.3	-6.4	0	0	113.9	E276	Q274-E276 PolarHBondContact O-N 3.3Å
275	A	30.6	Very low	44	Very low	78 Å²	78	113.5 Å²	113.5	65%	0.645	60%	0.604	S	S	*	*	S	Bend	trans	-66.7	121.3	159.6	0	0	0	0	0	109	T277	A275-T277 PolarHBondContact O-N 2.77Å
276	E	30.9	Very low	41.2	Very low	179 Å²	179	119.3 Å²	119.3	84%	0.836	63%	0.631	S	S	*	*			trans	-66.2	108	177.3	-70	-164.9	140.1	0	0	110.4	Q274 N278	Q274-E276 PolarHBondContact O-N 3.3Å; E276-N278 PolarHBondContact O-N 3.49Å
277	T	31.7	Very low	38.6	Very low	134 Å²	134	123.9 Å²	123.9	82%	0.822	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	47.1	-169	40.5	0	0	0	0	114.4	A275	A275-T277 PolarHBondContact O-N 2.77Å
278	N	31.3	Very low	36.2	Very low	147 Å²	147	133.3 Å²	133.3	79%	0.786	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.7	-20.8	170.7	-81.5	-57.4	0	0	0	115.7	E276	E276-N278 PolarHBondContact O-N 3.49Å
279	L	33	Very low	34.3	Very low	148 Å²	148	135.3 Å²	135.3	78%	0.775	71%	0.713	S	S	*	*	S	Bend	trans	-105.9	22.7	-171.3	-148.2	74.8	0	0	0	115.8
280	Y	32.6	Very low	33	Very low	230 Å²	230	141.3 Å²	141.3	90%	0.902	75%	0.75	S	S	*	*	S	Bend	trans	-128.3	23.4	177.6	-100.5	-86.3	0	0	0	113.7
281	K	34.4	Very low	31.9	Very low	207 Å²	207	144.8 Å²	144.8	90%	0.9	77%	0.766	S	S	*	*	S	Bend	trans	-124.7	8.3	-178.1	-93.2	-173.7	174.1	-179.7	0	115.5
282	S	32.5	Very low	31.3	Very low	98 Å²	98	152.3 Å²	152.3	69%	0.685	80%	0.795	S	S	*	*	S	Bend	trans	-142.1	39.5	-171.7	64.9	0	0	0	0	114.9
283	Q	34.3	Very low	31.1	Very low	200 Å²	200	153.1 Å²	153.1	94%	0.935	79%	0.793	S	S	*	*			trans	-152.8	121.2	154	-111.5	168.7	13.5	0	0	108.2
284	G	32.9	Very low	30.7	Very low	71 Å²	71	149.4 Å²	149.4	73%	0.732	79%	0.788	S	S	*	*			trans	-107.7	145.4	178.9	0	0	0	0	0	111
285	S	29.2	Very low	30.4	Very low	124 Å²	124	145.3 Å²	145.3	87%	0.867	78%	0.779	S	S	*	*	S	Bend	trans	49.8	82.2	160.4	-56.1	0	0	0	0	117.5
286	E	30	Very low	30.2	Very low	148 Å²	148	146.5 Å²	146.5	69%	0.692	78%	0.783	S	S	*	*	S	Bend		-169.9	156.6	118	-107.4	177.7	-146.3	0	0	112.1
287	V	29.9	Very low	30.4	Very low	103 Å²	103	145.3 Å²	145.3	62%	0.624	78%	0.777	S	S	*	*	S	Bend	trans	52.4	75.1	173	-162.1	0	0	0	0	117.2
288	F	29.2	Very low	30.3	Very low	209 Å²	209	140 Å²	140	92%	0.917	75%	0.747	S	S	*	*			trans	-152.6	53.1	144.4	-120.4	-71.6	0	0	0	111.1
289	T	26.9	Very low	30.4	Very low	122 Å²	122	133.6 Å²	133.6	75%	0.748	72%	0.715	S	S	*	*			trans	-82.6	123	180	43.4	0	0	0	0	111.8
290	T	27.4	Very low	30.3	Very low	129 Å²	129	128.4 Å²	128.4	79%	0.791	70%	0.698	S	S	*	*			trans	61	59.6	154.9	51.2	0	0	0	0	118.9
291	E	30	Very low	31	Very low	177 Å²	177	120.2 Å²	120.2	83%	0.827	68%	0.683	S	S	*	*			trans	-102.6	60.2	137.6	-78.5	-164.2	170.2	0	0	110.7	L293	E291-L293 PolarHBondContact O-N 3.37Å; E291-L293 VanDerWaalsContact O-N 3.13Å
292	K	27.7	Very low	32.3	Very low	196 Å²	196	114.2 Å²	114.2	85%	0.852	66%	0.661	S	S	*	*			trans	-81.2	59.4	157.1	-88.8	-166.4	170.9	-172.2	0	108.9	N294	K292-N294 PolarHBondContact O-N 3.15Å
293	L	29.6	Very low	33.8	Very low	121 Å²	121	109.9 Å²	109.9	63%	0.634	63%	0.63	S	S	*	*			trans	-82.8	62.4	-171.6	-155	93.9	0	0	0	112.3	E291 S295	E291-L293 PolarHBondContact O-N 3.37Å; E291-L293 VanDerWaalsContact O-N 3.13Å; L293-S295 VanDerWaalsContact C-N 3.27Å; L293-S295 PolarHBondContact O-N 2.89Å
294	N	26.5	Very low	36.3	Very low	138 Å²	138	100.4 Å²	100.4	74%	0.738	59%	0.586	S	S	*	*			trans	42	36.3	162.1	-65.4	-14.1	0	0	0	118	K292 S296	K292-N294 PolarHBondContact O-N 3.15Å; N294-S296 PolarHBondContact O-N 3.07Å
295	S	27.7	Very low	38.8	Very low	93 Å²	93	97.5 Å²	97.5	65%	0.65	55%	0.554	S	S	*	*			trans	-68.8	1.5	176.3	68.4	0	0	0	0	114.1	L293 Q297 A298	L293-S295 VanDerWaalsContact C-N 3.27Å; L293-S295 PolarHBondContact O-N 2.89Å; S295-Q297 VanDerWaalsContact C-N 3.32Å; S295-Q297 PolarHBondContact O-N 3.4Å; S295-Q297 VanDerWaalsContact O-N 3.13Å; S295-A298 VanDerWaalsContact O-O 3.08Å
296	S	27.4	Very low	41.6	Very low	103 Å²	103	91.6 Å²	91.6	72%	0.72	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	53.1	-173.4	56.5	0	0	0	0	113.4	N294	N294-S296 PolarHBondContact O-N 3.07Å
297	Q	33.6	Very low	44.2	Very low	153 Å²	153	85.3 Å²	85.3	72%	0.715	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-165.2	-9.6	159.2	-117.5	175.7	17.4	0	0	115.9	S295	S295-Q297 VanDerWaalsContact C-N 3.32Å; S295-Q297 PolarHBondContact O-N 3.4Å; S295-Q297 VanDerWaalsContact O-N 3.13Å
298	A	31.2	Very low	46.9	Very low	24 Å²	24	81.2 Å²	81.2	20%	0.198	46%	0.46	C	S	.	.	S	Bend	trans	-137.2	151	166.8	0	0	0	0	0	108.8	I204 S295 G300	I204-A298 HydrophobicContact CD1-CB 4.43Å; S295-A298 VanDerWaalsContact O-O 3.08Å; A298-G300 PolarHBondContact O-N 3.05Å
299	G	31.7	Very low	49.9	Very low	11 Å²	11	72 Å²	72	11%	0.113	42%	0.42	C	S	.	.			trans	-71.4	44.3	-170.8	0	0	0	0	0	116	G301	G299-G301 PolarHBondContact O-N 3.4Å
300	G	32.1	Very low	52.9	Low	40 Å²	40	68.3 Å²	68.3	41%	0.412	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	118.7	-169.4	0	0	0	0	0	114.2	A298 L302	A298-G300 PolarHBondContact O-N 3.05Å; G300-L302 PolarHBondContact O-N 2.65Å
301	G	46.3	Very low	55.9	Low	58 Å²	58	63 Å²	63	60%	0.598	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	-1	167.5	0	0	0	0	0	116.7	G299	G299-G301 PolarHBondContact O-N 3.4Å
302	L	61.5	Low	58.7	Low	81 Å²	81	60.8 Å²	60.8	42%	0.424	36%	0.355	S	S	.	.			trans	-91.6	122.5	-177.9	-60.7	-179.1	0	0	0	111.5	L268 G300 F304 S305	L268-L302 HydrophobicContact CD2-CB 4.3Å; L268-L302 HydrophobicContact CD2-CD1 3.78Å; L268-L302 HydrophobicContact CD2-CD2 3.62Å; L268-L302 HydrophobicContact CD2-CG 4.1Å; G300-L302 PolarHBondContact O-N 2.65Å; L302-F304 PolarHBondContact O-N 3.18Å; L302-S305 PolarHBondContact O-N 3.24Å
303	P	65.5	Low	61.6	Low	6 Å²	6	54.8 Å²	54.8	4%	0.039	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	139	177.1	30.2	-37.4	0	0	0	110.2	A269 S305 N356	A269-P303 HydrophobicContact CB-CB 4.21Å; A269-P303 HydrophobicContact CB-CG 3.54Å; P303-S305 PolarHBondContact O-N 3.2Å; P303-N356 HydrophobicContact CB-CB 4.26Å
304	F	85.9	Confident	64.2	Low	2 Å²	2	52.3 Å²	52.3	1%	0.009	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.1	7.2	179.3	-43.6	-50.8	0	0	0	117.1	G266 A269 L302 P339 I341 N356 F359 G361 W466 L468	G266-F304 VanDerWaalsContact CA-O 3.31Å; G266-F304 WeakPolarHBondContact CA-O 3.13Å; A269-F304 HydrophobicContact CB-CD2 4.16Å; A269-F304 HydrophobicContact CB-CE2 3.99Å; L302-F304 PolarHBondContact O-N 3.18Å; F304-P339 HydrophobicContact CE1-CB 4.04Å; F304-P339 HydrophobicContact CZ-CB 4.34Å; F304-I341 HydrophobicContact CE2-CG1 3.92Å; F304-I341 HydrophobicContact CZ-CG1 4.34Å; F304-N356 HydrophobicContact CD1-CB 4.35Å; F304-N356 HydrophobicContact CE1-CB 3.82Å; F304-N356 HydrophobicContact CZ-CB 4.3Å; F304-F359 WeakPolarHBondContact CA-O 3.29Å; F304-F359 HydrophobicContact CD1-CB 4.07Å; F304-F359 HydrophobicContact CE1-CB 4.45Å; F304-G361 PolarHBondContact O-N 2.91Å; F304-W466 HydrophobicContact CD2-CH2 4.2Å; F304-W466 AromaticContact CD2-CZ3 3.92Å; F304-W466 HydrophobicContact CD2-CZ3 3.92Å; F304-L468 HydrophobicContact CB-CD2 4.44Å; F304-L468 HydrophobicContact CD1-CD1 4.28Å; F304-L468 HydrophobicContact CD1-CD2 3.92Å; F304-L468 HydrophobicContact CD2-CD2 4.2Å; F304-L468 HydrophobicContact CE1-CD1 3.8Å; F304-L468 HydrophobicContact CE1-CD2 4.2Å; F304-L468 HydrophobicContact CE2-CD2 4.46Å; F304-L468 HydrophobicContact CG-CD2 3.93Å; F304-L468 HydrophobicContact CZ-CD1 4.03Å; F304-L468 HydrophobicContact CZ-CD2 4.47Å
305	S	86.2	Confident	66.6	Low	10 Å²	10	53.5 Å²	53.5	7%	0.07	32%	0.315	C	S	.	.	S	Bend	trans	-77.2	149.6	165.4	-179.1	0	0	0	0	111.2	E265 L302 P303 T307	E265-S305 PolarHBondContact OE1-OG 3.26Å; L302-S305 PolarHBondContact O-N 3.24Å; P303-S305 PolarHBondContact O-N 3.2Å; S305-T307 VanDerWaalsContact C-N 3.3Å; S305-T307 PolarHBondContact O-N 2.95Å
306	D	88.4	Confident	68.4	Low	0 Å²	0	55.3 Å²	55.3	0%	0	32%	0.324	C	S	.	.			trans	-73.9	85.2	171.6	-168.8	-16	0	0	0	109.5	Y261 C308 Y309 R313 L320 C326 V360	Y261-D306 PolarHBondContact OH-OD2 2.86Å; D306-C308 VanDerWaalsContact C-N 3.3Å; D306-C308 PolarHBondContact O-N 3.46Å; D306-Y309 PolarHBondContact O-N 2.9Å; D306-Y309 PolarHBondContact OD1-N 2.81Å; D306-R313 PolarHBondContact O-NH1 2.96Å; D306-R313 VanDerWaalsContact O-NH1 3.1Å; D306-R313 PolarHBondContact O-NH2 2.95Å; D306-L320 HydrophobicContact CB-CD1 3.61Å; D306-C326 WeakPolarHBondContact OD1-CB 3.5Å; D306-C326 PolarHBondContact OD1-N 3.24Å; D306-V360 HydrophobicContact CB-CG1 4.12Å; D306-V360 HydrophobicContact CB-CG2 3.87Å
307	T	83.8	Confident	70	Confident	15 Å²	15	53.3 Å²	53.3	9%	0.092	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-27.4	-171.2	60.6	0	0	0	0	113.7	S305	S305-T307 VanDerWaalsContact C-N 3.3Å; S305-T307 PolarHBondContact O-N 2.95Å
308	C	86.9	Confident	72.3	Confident	18 Å²	18	48.4 Å²	48.4	12%	0.122	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	10.6	179.9	58.9	0	0	0	0	114.9	L200 P224 D306 D310 G325 C326	L200-C308 HydrophobicContact CD1-CB 3.87Å; L200-C308 HydrophobicContact CG-CB 4.32Å; P224-C308 HydrophobicContact CB-CB 4.1Å; P224-C308 HydrophobicContact CG-CB 3.83Å; D306-C308 VanDerWaalsContact C-N 3.3Å; D306-C308 PolarHBondContact O-N 3.46Å; C308-D310 PolarHBondContact O-N 3.43Å; C308-G325 VanDerWaalsContact SG-C 3.57Å; C308-C326 WeakPolarHBondContact CB-SG 3.43Å; C308-C326 PolarHBondContact N-SG 3.09Å; C308-C326 WeakPolarHBondContact SG-CA 3.44Å; C308-C326 WeakPolarHBondContact SG-CB 3.13Å; C308-C326 PolarHBondContact SG-N 2.86Å; C308-C326 CovalentContact SG-SG 2.04Å; C308-C326 PolarHBondContact SG-SG 3.17Å
309	Y	91.1	Very high	75	Confident	15 Å²	15	50 Å²	50	6%	0.059	31%	0.308	C	S	.	.			trans	-60	121.5	176.8	-163.5	-106.4	0	0	0	113.1	Y261 D306 L320 D321 G322 G323 L324	Y261-Y309 HydrophobicContact CD2-CD2 4.41Å; Y261-Y309 AromaticContact CD2-CE2 3.67Å; Y261-Y309 HydrophobicContact CD2-CE2 3.67Å; Y261-Y309 AromaticContact CE2-CD2 3.58Å; Y261-Y309 HydrophobicContact CE2-CD2 3.58Å; Y261-Y309 AromaticContact CE2-CE2 3.28Å; Y261-Y309 HydrophobicContact CE2-CE2 3.28Å; Y261-Y309 AromaticContact CZ-CD2 3.95Å; Y261-Y309 AromaticContact CZ-CE2 3.94Å; Y261-Y309 PolarHBondContact O-OH 2.92Å; D306-Y309 PolarHBondContact O-N 2.9Å; D306-Y309 PolarHBondContact OD1-N 2.81Å; Y309-L320 HydrophobicContact CD1-CB 4Å; Y309-L320 HydrophobicContact CD1-CD1 4.4Å; Y309-L320 HydrophobicContact CD1-CD2 3.76Å; Y309-L320 HydrophobicContact CD1-CG 4.27Å; Y309-L320 HydrophobicContact CD2-CB 4.33Å; Y309-L320 HydrophobicContact CD2-CD1 4.17Å; Y309-L320 HydrophobicContact CE1-CB 3.66Å; Y309-L320 HydrophobicContact CE1-CD2 4.18Å; Y309-L320 HydrophobicContact CE1-CG 4.41Å; Y309-L320 HydrophobicContact CE2-CB 4.06Å; Y309-L320 HydrophobicContact CG-CB 4.3Å; Y309-L320 HydrophobicContact CG-CD1 4.03Å; Y309-L320 HydrophobicContact CG-CD2 4.16Å; Y309-L320 HydrophobicContact CG-CG 4.39Å; Y309-D321 VanDerWaalsContact OH-CA 3.22Å; Y309-D321 WeakPolarHBondContact OH-CA 3.31Å; Y309-D321 PolarHBondContact OH-N 2.82Å; Y309-D321 PolarHBondContact OH-O 2.9Å; Y309-G322 PolarHBondContact OH-N 3.11Å; Y309-G323 WeakPolarHBondContact CE2-O 3.49Å; Y309-G323 WeakPolarHBondContact OH-CA 3.45Å; Y309-G323 PolarHBondContact OH-N 2.7Å; Y309-G323 PolarHBondContact OH-O 3.16Å; Y309-L324 CarbonylContact C-O 3.57Å; Y309-L324 VanDerWaalsContact CA-O 3.32Å; Y309-L324 WeakPolarHBondContact CA-O 3.34Å; Y309-L324 WeakPolarHBondContact CD2-O 3.41Å
310	D	91.2	Very high	77.8	Confident	45 Å²	45	49.5 Å²	49.5	24%	0.241	30%	0.303	C	S	.	.			trans	-96.2	3	-175	77.2	21.4	0	0	0	115.3	Y185 R187 R195 C308 G323 L324	Y185-D310 VanDerWaalsContact OH-CB 3.31Å; Y185-D310 WeakPolarHBondContact OH-CB 3.48Å; Y185-D310 PolarHBondContact OH-OD2 2.7Å; Y185-D310 VanDerWaalsContact OH-OD2 3.13Å; R187-D310 IonicContact CZ-OD1 3.99Å; R187-D310 IonicContact CZ-OD2 3.45Å; R187-D310 IonicContact NH1-OD1 2.84Å; R187-D310 IonicContact NH1-OD2 2.74Å; R187-D310 PolarHBondContact NH1-OD2 3.47Å; R187-D310 IonicContact NH2-OD1 3.74Å; R187-D310 PolarHBondContact NH2-OD1 2.86Å; R187-D310 IonicContact NH2-OD2 3.61Å; R187-D310 PolarHBondContact NH2-OD2 2.81Å; R195-D310 IonicContact CZ-OD1 2.65Å; R195-D310 PolarHBondContact NH1-O 3.22Å; R195-D310 IonicContact NH1-OD1 3.34Å; R195-D310 PolarHBondContact NH1-OD1 2.83Å; C308-D310 PolarHBondContact O-N 3.43Å; D310-G323 WeakPolarHBondContact OD1-CA 3.42Å; D310-L324 PolarHBondContact N-O 3.46Å; D310-L324 PolarHBondContact OD1-N 3.05Å
311	G	90.5	Very high	80.7	Confident	16 Å²	16	48.7 Å²	48.7	17%	0.165	29%	0.289	C	S	.	.	S	Bend	trans	-101.1	-162.3	178.5	0	0	0	0	0	113.6
312	H	88.6	Confident	82.8	Confident	132 Å²	132	46.5 Å²	46.5	61%	0.611	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	138.2	-179.3	-56.6	-62.8	0	0	0	111.1	I314 D321	H312-I314 HydrophobicContact CB-CG1 4.38Å; H312-D321 PolarHBondContact N-O 3.04Å; H312-D321 PolarHBondContact O-N 2.69Å
313	R	87.9	Confident	84.3	Confident	69 Å²	69	42.7 Å²	42.7	26%	0.26	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	105.1	168.9	-48.9	-160.7	-174.1	-129.8	-4	107.7	E265 D306 L320	E265-R313 IonicContact OE1-NH1 3.76Å; E265-R313 IonicContact OE2-CZ 2.97Å; E265-R313 IonicContact OE2-NE 3.88Å; E265-R313 IonicContact OE2-NH1 3.65Å; E265-R313 PolarHBondContact OE2-NH1 3.47Å; D306-R313 PolarHBondContact O-NH1 2.96Å; D306-R313 VanDerWaalsContact O-NH1 3.1Å; D306-R313 PolarHBondContact O-NH2 2.95Å; R313-L320 HydrophobicContact CB-CD2 4.23Å; R313-L320 HydrophobicContact CG-CD2 3.63Å
314	I	84.5	Confident	85.7	Confident	69 Å²	69	42.6 Å²	42.6	35%	0.354	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	126.8	-172.4	-58.1	-179.5	0	0	0	110.1	H312 S318 L319 D321	H312-I314 HydrophobicContact CB-CG1 4.38Å; I314-S318 WeakPolarHBondContact O-CA 3.35Å; I314-S318 PolarHBondContact O-N 3.15Å; I314-L319 HydrophobicContact CB-CB 4.39Å; I314-L319 PolarHBondContact N-O 2.96Å; I314-L319 PolarHBondContact O-N 2.79Å; I314-D321 HydrophobicContact CD1-CB 3.61Å; I314-D321 HydrophobicContact CG1-CB 4.3Å
315	E	76.7	Confident	86	Confident	164 Å²	164	42.8 Å²	42.8	77%	0.766	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.5	148.5	169.4	-63.6	-169.9	169.4	0	0	110.6
316	P	65.6	Low	86.2	Confident	130 Å²	130	42.8 Å²	42.8	84%	0.844	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	cis	-77.7	158.6	-5	33.7	-36	0	0	0	112.7
317	G	61.3	Low	86.5	Confident	62 Å²	62	42.8 Å²	42.8	64%	0.639	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	110.2	-15.9	177.2	0	0	0	0	0	114.6
318	S	80.5	Confident	86.9	Confident	50 Å²	50	42.5 Å²	42.5	35%	0.35	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	64.2	179.8	-50	0	0	0	0	110.8	E265 I314	E265-S318 WeakPolarHBondContact CB-O 3.42Å; E265-S318 PolarHBondContact N-O 3.04Å; I314-S318 WeakPolarHBondContact O-CA 3.35Å; I314-S318 PolarHBondContact O-N 3.15Å
319	L	87.8	Confident	86.9	Confident	57 Å²	57	42.5 Å²	42.5	30%	0.298	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	128	178	-175.2	74.8	0	0	0	109.2	R262 I314	R262-L319 HydrophobicContact CG-CD1 4Å; R262-L319 HydrophobicContact CG-CD2 4.01Å; R262-L319 HydrophobicContact CG-CG 4.11Å; I314-L319 HydrophobicContact CB-CB 4.39Å; I314-L319 PolarHBondContact N-O 2.96Å; I314-L319 PolarHBondContact O-N 2.79Å
320	L	92.3	Very high	86.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	126.8	168.1	-59.7	-177.9	0	0	0	107.8	R262 I263 E265 D306 Y309 R313	R262-L320 CarbonylContact C-O 3.6Å; R262-L320 VanDerWaalsContact CA-O 3.22Å; R262-L320 WeakPolarHBondContact CA-O 3.28Å; I263-L320 HydrophobicContact CD1-CD1 4.18Å; I263-L320 HydrophobicContact CG1-CB 4Å; I263-L320 HydrophobicContact CG1-CD1 3.97Å; I263-L320 HydrophobicContact CG1-CG 4.4Å; I263-L320 PolarHBondContact N-O 3.26Å; I263-L320 WeakPolarHBondContact O-CB 3.18Å; I263-L320 PolarHBondContact O-N 3.23Å; E265-L320 HydrophobicContact CB-CG 4.39Å; E265-L320 WeakPolarHBondContact OE2-CD2 3.31Å; D306-L320 HydrophobicContact CB-CD1 3.61Å; Y309-L320 HydrophobicContact CD1-CB 4Å; Y309-L320 HydrophobicContact CD1-CD1 4.4Å; Y309-L320 HydrophobicContact CD1-CD2 3.76Å; Y309-L320 HydrophobicContact CD1-CG 4.27Å; Y309-L320 HydrophobicContact CD2-CB 4.33Å; Y309-L320 HydrophobicContact CD2-CD1 4.17Å; Y309-L320 HydrophobicContact CE1-CB 3.66Å; Y309-L320 HydrophobicContact CE1-CD2 4.18Å; Y309-L320 HydrophobicContact CE1-CG 4.41Å; Y309-L320 HydrophobicContact CE2-CB 4.06Å; Y309-L320 HydrophobicContact CG-CB 4.3Å; Y309-L320 HydrophobicContact CG-CD1 4.03Å; Y309-L320 HydrophobicContact CG-CD2 4.16Å; Y309-L320 HydrophobicContact CG-CG 4.39Å; R313-L320 HydrophobicContact CB-CD2 4.23Å; R313-L320 HydrophobicContact CG-CD2 3.63Å
321	D	91.7	Very high	86.1	Confident	24 Å²	24	42.6 Å²	42.6	13%	0.128	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	149	-177.2	-164.9	29.5	0	0	0	113.9	R262 Y309 H312 I314 G323	R262-D321 WeakPolarHBondContact CB-OD1 3.12Å; R262-D321 HydrophobicContact CG-CB 4.5Å; R262-D321 IonicContact CZ-OD1 2.77Å; R262-D321 IonicContact CZ-OD2 3.9Å; R262-D321 IonicContact NE-OD1 2.75Å; R262-D321 PolarHBondContact NE-OD1 2.74Å; R262-D321 IonicContact NE-OD2 3.85Å; R262-D321 PolarHBondContact NE-OD2 2.71Å; R262-D321 VanDerWaalsContact NH2-CG 3.3Å; R262-D321 IonicContact NH2-OD1 3.59Å; R262-D321 PolarHBondContact NH2-OD1 2.92Å; R262-D321 IonicContact NH2-OD2 3.2Å; R262-D321 PolarHBondContact NH2-OD2 3.06Å; Y309-D321 VanDerWaalsContact OH-CA 3.22Å; Y309-D321 WeakPolarHBondContact OH-CA 3.31Å; Y309-D321 PolarHBondContact OH-N 2.82Å; Y309-D321 PolarHBondContact OH-O 2.9Å; H312-D321 PolarHBondContact N-O 3.04Å; H312-D321 PolarHBondContact O-N 2.69Å; I314-D321 HydrophobicContact CD1-CB 3.61Å; I314-D321 HydrophobicContact CG1-CB 4.3Å; D321-G323 PolarHBondContact O-N 3.44Å
322	G	90.3	Very high	85.8	Confident	12 Å²	12	43.2 Å²	43.2	12%	0.124	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	64.7	29.7	174.8	0	0	0	0	0	115.4	R195 Y309	R195-G322 VanDerWaalsContact CZ-O 3.22Å; R195-G322 PolarHBondContact NH1-O 3.4Å; R195-G322 PolarHBondContact NH2-O 2.75Å; Y309-G322 PolarHBondContact OH-N 3.11Å
323	G	93.1	Very high	85.6	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	-178.8	-179.1	0	0	0	0	0	115.7	E260 Y261 Y309 D310 D321	E260-G323 CarbonylContact C-O 3.51Å; E260-G323 VanDerWaalsContact CA-O 3.31Å; E260-G323 WeakPolarHBondContact CA-O 3.37Å; Y261-G323 PolarHBondContact N-O 2.96Å; Y309-G323 WeakPolarHBondContact CE2-O 3.49Å; Y309-G323 WeakPolarHBondContact OH-CA 3.45Å; Y309-G323 PolarHBondContact OH-N 2.7Å; Y309-G323 PolarHBondContact OH-O 3.16Å; D310-G323 WeakPolarHBondContact OD1-CA 3.42Å; D321-G323 PolarHBondContact O-N 3.44Å
324	L	94.8	Very high	85.4	Confident	4 Å²	4	38 Å²	38	2%	0.021	23%	0.23	C	C	.	.			trans	-123.4	161.5	178.9	-63.4	-176.2	0	0	0	109.8	I227 L258 E260 Y261 Y309 D310 I328	I227-L324 HydrophobicContact CB-CD1 4.06Å; I227-L324 HydrophobicContact CD1-CD1 3.94Å; I227-L324 HydrophobicContact CG2-CD1 3.89Å; L258-L324 HydrophobicContact CD2-CD2 4.11Å; L258-L324 HydrophobicContact CG-CD2 4.02Å; E260-L324 VanDerWaalsContact CA-CD2 3.44Å; Y261-L324 HydrophobicContact CD1-CD2 4.18Å; Y309-L324 CarbonylContact C-O 3.57Å; Y309-L324 VanDerWaalsContact CA-O 3.32Å; Y309-L324 WeakPolarHBondContact CA-O 3.34Å; Y309-L324 WeakPolarHBondContact CD2-O 3.41Å; D310-L324 PolarHBondContact N-O 3.46Å; D310-L324 PolarHBondContact OD1-N 3.05Å; L324-I328 HydrophobicContact CB-CD1 3.71Å; L324-I328 HydrophobicContact CD1-CD1 4.13Å; L324-I328 HydrophobicContact CD2-CD1 3.38Å; L324-I328 HydrophobicContact CG-CD1 3.9Å
325	G	92.6	Very high	85.4	Confident	7 Å²	7	40 Å²	40	7%	0.072	23%	0.233	C	C	.	.			trans	-173.9	-151.3	-173.8	0	0	0	0	0	114.1	Y261 C308 L327 I328	Y261-G325 WeakPolarHBondContact OH-CA 3.43Å; Y261-G325 PolarHBondContact OH-N 2.8Å; Y261-G325 VanDerWaalsContact OH-N 3.16Å; C308-G325 VanDerWaalsContact SG-C 3.57Å; G325-L327 PolarHBondContact O-N 3.2Å; G325-I328 WeakPolarHBondContact O-CG1 3.08Å; G325-I328 PolarHBondContact O-N 2.71Å
326	C	91.3	Very high	85.8	Confident	9 Å²	9	38.2 Å²	38.2	6%	0.061	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	16.3	-161.7	-59.2	0	0	0	0	115.1	Y261 D306 C308 V360	Y261-C326 PolarHBondContact OH-N 3.09Å; D306-C326 WeakPolarHBondContact OD1-CB 3.5Å; D306-C326 PolarHBondContact OD1-N 3.24Å; C308-C326 WeakPolarHBondContact CB-SG 3.43Å; C308-C326 PolarHBondContact N-SG 3.09Å; C308-C326 WeakPolarHBondContact SG-CA 3.44Å; C308-C326 WeakPolarHBondContact SG-CB 3.13Å; C308-C326 PolarHBondContact SG-N 2.86Å; C308-C326 CovalentContact SG-SG 2.04Å; C308-C326 PolarHBondContact SG-SG 3.17Å; C326-V360 HydrophobicContact CB-CG2 4.25Å
327	L	93.8	Very high	86.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-1.3	169.4	-69.4	174.5	0	0	0	112.9	Y261 I263 G325 V360 W362 F469 E471 I472	Y261-L327 HydrophobicContact CE1-CB 4.26Å; I263-L327 HydrophobicContact CD1-CD1 3.66Å; G325-L327 PolarHBondContact O-N 3.2Å; L327-V360 HydrophobicContact CD2-CB 3.97Å; L327-V360 HydrophobicContact CD2-CG2 4.02Å; L327-V360 HydrophobicContact CG-CB 4.2Å; L327-V360 HydrophobicContact CG-CG2 3.94Å; L327-W362 HydrophobicContact CD1-CH2 4.32Å; L327-F469 HydrophobicContact CD2-CB 3.67Å; L327-E471 CarbonylContact O-C 3.55Å; L327-E471 VanDerWaalsContact O-CA 3.28Å; L327-E471 WeakPolarHBondContact O-CA 3.28Å; L327-I472 HydrophobicContact CB-CG1 4.48Å; L327-I472 HydrophobicContact CD1-CD1 4.1Å; L327-I472 PolarHBondContact O-N 2.94Å
328	I	92	Very high	87.8	Confident	10 Å²	10	33.3 Å²	33.3	5%	0.051	18%	0.18	C	C	.	.	S	Bend	trans	-151.9	20	-170.4	52.8	-179	0	0	0	112.4	I227 L258 Y261 L324 G325 L330 I472	I227-I328 HydrophobicContact CD1-CD1 4.43Å; L258-I328 HydrophobicContact CD2-CD1 3.73Å; L258-I328 HydrophobicContact CD2-CG2 4.02Å; Y261-I328 HydrophobicContact CD1-CD1 3.87Å; Y261-I328 HydrophobicContact CE1-CD1 3.56Å; Y261-I328 HydrophobicContact CE1-CG1 3.94Å; L324-I328 HydrophobicContact CB-CD1 3.71Å; L324-I328 HydrophobicContact CD1-CD1 4.13Å; L324-I328 HydrophobicContact CD2-CD1 3.38Å; L324-I328 HydrophobicContact CG-CD1 3.9Å; G325-I328 WeakPolarHBondContact O-CG1 3.08Å; G325-I328 PolarHBondContact O-N 2.71Å; I328-L330 PolarHBondContact O-N 3.41Å; I328-I472 WeakPolarHBondContact CG2-O 3.29Å
329	D	86.6	Confident	88	Confident	18 Å²	18	30.9 Å²	30.9	10%	0.096	16%	0.164	C	C	.	.	S	Bend	trans	-84.7	11.5	-177.6	71.3	-19.5	0	0	0	113.4	P224 P225 N331	P224-D329 HydrophobicContact CB-CB 4.36Å; P225-D329 WeakPolarHBondContact CD-O 3.48Å; P225-D329 WeakPolarHBondContact CG-O 3.3Å; D329-N331 VanDerWaalsContact CG-CB 3.44Å; D329-N331 PolarHBondContact O-N 3.48Å; D329-N331 WeakPolarHBondContact OD1-CA 3.45Å; D329-N331 WeakPolarHBondContact OD1-CB 3.16Å; D329-N331 PolarHBondContact OD1-N 3.29Å; D329-N331 VanDerWaalsContact OD2-CB 3.31Å; D329-N331 WeakPolarHBondContact OD2-CB 3.45Å
330	L	83.9	Confident	87.6	Confident	12 Å²	12	30.3 Å²	30.3	6%	0.063	16%	0.164	C	C	.	.	S	Bend	trans	60.3	21.6	-169.9	-47	178.7	0	0	0	114	K88 C91 I159 I328 E471	K88-L330 PolarHBondContact NZ-O 2.95Å; C91-L330 HydrophobicContact CB-CD1 4.25Å; I159-L330 HydrophobicContact CD1-CD1 3.78Å; I159-L330 HydrophobicContact CD1-CD2 3.75Å; I159-L330 HydrophobicContact CD1-CG 3.96Å; I159-L330 HydrophobicContact CG2-CD1 4.06Å; I328-L330 PolarHBondContact O-N 3.41Å; L330-E471 WeakPolarHBondContact CA-OE2 3.49Å; L330-E471 PolarHBondContact N-OE2 2.94Å
331	N	82.4	Confident	86.8	Confident	50 Å²	50	31.2 Å²	31.2	27%	0.267	17%	0.169	S	C	.	.			trans	-113.2	31	-175.2	-156.7	54.1	0	0	0	114.6	K88 D329 A333 E471	K88-N331 PolarHBondContact NZ-OD1 2.78Å; D329-N331 VanDerWaalsContact CG-CB 3.44Å; D329-N331 PolarHBondContact O-N 3.48Å; D329-N331 WeakPolarHBondContact OD1-CA 3.45Å; D329-N331 WeakPolarHBondContact OD1-CB 3.16Å; D329-N331 PolarHBondContact OD1-N 3.29Å; D329-N331 VanDerWaalsContact OD2-CB 3.31Å; D329-N331 WeakPolarHBondContact OD2-CB 3.45Å; N331-A333 PolarHBondContact O-N 3.01Å; N331-A333 VanDerWaalsContact O-N 3.09Å; N331-E471 PolarHBondContact N-OE2 3.05Å
332	S	83.3	Confident	85.5	Confident	29 Å²	29	38.8 Å²	38.8	20%	0.203	20%	0.196	C	C	.	.			trans	-37.9	115.2	167.9	68.9	0	0	0	0	113.2	E471	S332-E471 PolarHBondContact N-OE2 2.85Å
333	A	84.6	Confident	83.7	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.008	21%	0.208	C	C	.	.			trans	-52.1	142	177	0	0	0	0	0	112.4	Y84 N331 T337 Q358 F359 V441 S470	Y84-A333 PolarHBondContact OH-O 3.1Å; N331-A333 PolarHBondContact O-N 3.01Å; N331-A333 VanDerWaalsContact O-N 3.09Å; A333-T337 HydrophobicContact CB-CG2 4.14Å; A333-Q358 HydrophobicContact CB-CB 4.08Å; A333-F359 HydrophobicContact CB-CE1 3.88Å; A333-F359 HydrophobicContact CB-CE2 4.12Å; A333-F359 HydrophobicContact CB-CZ 3.52Å; A333-V441 HydrophobicContact CB-CG2 3.98Å; A333-S470 PolarHBondContact N-OG 3.22Å
334	N	84.5	Confident	80.9	Confident	89 Å²	89	46.3 Å²	46.3	48%	0.476	23%	0.234	S	C	.	.			trans	-61	152.7	177.7	-170.4	10.8	0	0	0	111	D336 T337 V441	N334-D336 PolarHBondContact O-N 3.49Å; N334-D336 VanDerWaalsContact O-N 3.15Å; N334-T337 PolarHBondContact N-OG1 3.36Å; N334-T337 WeakPolarHBondContact O-CB 3.48Å; N334-T337 PolarHBondContact O-N 3.34Å; N334-T337 PolarHBondContact O-OG1 3.44Å; N334-V441 VanDerWaalsContact O-CG2 3.3Å; N334-V441 WeakPolarHBondContact O-CG2 3.38Å
335	R	84.1	Confident	78.2	Confident	111 Å²	111	53.4 Å²	53.4	42%	0.419	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-38.5	-179	-171	179.1	-172.6	174.9	2.6	112.7	Y84 T337 G440 V441	Y84-R335 HydrophobicContact CE2-CB 4.33Å; Y84-R335 PolarHBondContact OH-N 2.79Å; R335-T337 VanDerWaalsContact C-N 3.32Å; R335-G440 CarbonylContact O-C 3.53Å; R335-G440 VanDerWaalsContact O-CA 3.29Å; R335-G440 WeakPolarHBondContact O-CA 3.3Å; R335-V441 PolarHBondContact O-N 2.96Å
336	D	84.6	Confident	75.4	Confident	128 Å²	128	56.8 Å²	56.8	68%	0.684	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-0	-177.7	-53.3	-46	0	0	0	113.3	N334 I338	N334-D336 PolarHBondContact O-N 3.49Å; N334-D336 VanDerWaalsContact O-N 3.15Å; D336-I338 PolarHBondContact O-N 2.85Å
337	T	85.3	Confident	72.6	Confident	13 Å²	13	61.1 Å²	61.1	8%	0.08	34%	0.337	C	S	.	.			trans	-68.9	115.2	175.5	-59.8	0	0	0	0	110.2	A333 N334 R335 P339 M355 F359 V441	A333-T337 HydrophobicContact CB-CG2 4.14Å; N334-T337 PolarHBondContact N-OG1 3.36Å; N334-T337 WeakPolarHBondContact O-CB 3.48Å; N334-T337 PolarHBondContact O-N 3.34Å; N334-T337 PolarHBondContact O-OG1 3.44Å; R335-T337 VanDerWaalsContact C-N 3.32Å; T337-P339 WeakPolarHBondContact O-CD 3.2Å; T337-M355 HydrophobicContact CG2-CE 3.75Å; T337-F359 HydrophobicContact CG2-CE2 3.61Å; T337-F359 HydrophobicContact CG2-CZ 3.7Å; T337-V441 WeakPolarHBondContact O-CG2 3.25Å
338	I	85.3	Confident	69.6	Low	75 Å²	75	66.9 Å²	66.9	39%	0.385	38%	0.378	S	S	.	.			trans	-109.2	104.1	175.4	-60.4	175.8	0	0	0	108.5	D336 N400 L439	D336-I338 PolarHBondContact O-N 2.85Å; I338-N400 HydrophobicContact CG2-CB 4.11Å; I338-N400 WeakPolarHBondContact CG2-ND2 3.46Å; I338-L439 HydrophobicContact CD1-CB 4.05Å
339	P	84.6	Confident	66.7	Low	0 Å²	0	68.5 Å²	68.5	0%	0	39%	0.39	C	S	.	.			trans	-69.9	153	174.3	27.3	-32.2	0	0	0	111.8	F304 T337 F359 S398 N400 I405 L468	F304-P339 HydrophobicContact CE1-CB 4.04Å; F304-P339 HydrophobicContact CZ-CB 4.34Å; T337-P339 WeakPolarHBondContact O-CD 3.2Å; P339-F359 HydrophobicContact CB-CD2 3.84Å; P339-F359 HydrophobicContact CB-CE2 3.72Å; P339-F359 HydrophobicContact CB-CZ 4.34Å; P339-F359 HydrophobicContact CG-CD2 4.13Å; P339-F359 HydrophobicContact CG-CE1 4.32Å; P339-F359 HydrophobicContact CG-CE2 3.79Å; P339-F359 HydrophobicContact CG-CZ 3.89Å; P339-S398 VanDerWaalsContact CD-OG 3.22Å; P339-S398 WeakPolarHBondContact CD-OG 3.37Å; P339-S398 VanDerWaalsContact CG-OG 3.3Å; P339-S398 WeakPolarHBondContact CG-OG 3.37Å; P339-N400 PolarHBondContact O-ND2 3.18Å; P339-I405 HydrophobicContact CG-CD1 4.34Å; P339-L468 HydrophobicContact CB-CD1 3.9Å; P339-L468 HydrophobicContact CG-CD1 3.51Å
340	S	79	Confident	64.3	Low	45 Å²	45	76.9 Å²	76.9	32%	0.315	43%	0.426	S	S	.	.			trans	-125.3	123.9	-176.5	174.4	0	0	0	0	110.9	R342 N356 E403	S340-R342 VanDerWaalsContact C-N 3.3Å; S340-R342 PolarHBondContact OG-N 2.93Å; S340-N356 PolarHBondContact N-OD1 2.86Å; S340-N356 VanDerWaalsContact N-OD1 3.11Å; S340-N356 PolarHBondContact O-ND2 3.02Å; S340-N356 PolarHBondContact O-OD1 2.81Å; S340-E403 WeakPolarHBondContact CA-OE2 3.41Å
341	I	75.7	Confident	62	Low	19 Å²	19	79.2 Å²	79.2	10%	0.097	45%	0.447	C	S	.	.	S	Bend	trans	-74.7	-27.6	173.2	-70.6	149.6	0	0	0	110.4	A269 F304 Q343 E403 I405 W466	A269-I341 HydrophobicContact CB-CG2 4.34Å; A269-I341 WeakPolarHBondContact O-CG2 3.22Å; F304-I341 HydrophobicContact CE2-CG1 3.92Å; F304-I341 HydrophobicContact CZ-CG1 4.34Å; I341-Q343 VanDerWaalsContact C-N 3.3Å; I341-Q343 PolarHBondContact O-N 3.09Å; I341-E403 HydrophobicContact CD1-CB 4.03Å; I341-E403 VanDerWaalsContact CD1-O 3.23Å; I341-E403 WeakPolarHBondContact CD1-O 3.28Å; I341-E403 PolarHBondContact N-OE2 2.91Å; I341-I405 HydrophobicContact CD1-CD1 3.57Å; I341-I405 HydrophobicContact CD1-CG1 3.56Å; I341-I405 HydrophobicContact CG1-CD1 4.04Å; I341-I405 HydrophobicContact CG1-CG1 4.43Å; I341-W466 HydrophobicContact CD1-CB 4.25Å; I341-W466 HydrophobicContact CD1-CD2 3.97Å; I341-W466 HydrophobicContact CD1-CG 3.61Å; I341-W466 HydrophobicContact CG1-CD2 4.3Å; I341-W466 HydrophobicContact CG1-CG 4.43Å; I341-W466 HydrophobicContact CG2-CZ2 4.46Å
342	R	64.3	Low	60	Low	183 Å²	183	81.8 Å²	81.8	69%	0.691	46%	0.461	S	S	*	.			trans	-76.3	75.4	-179.7	-66.3	-178.6	-177.6	-134.5	-2.8	112.1	S340 T344 E403	S340-R342 VanDerWaalsContact C-N 3.3Å; S340-R342 PolarHBondContact OG-N 2.93Å; R342-T344 PolarHBondContact O-N 2.88Å; R342-E403 VanDerWaalsContact CD-OE1 3.23Å; R342-E403 WeakPolarHBondContact CD-OE1 3.35Å; R342-E403 WeakPolarHBondContact CG-OE1 3.43Å; R342-E403 IonicContact NE-OE1 3.44Å; R342-E403 PolarHBondContact NE-OE1 2.89Å
343	Q	53.1	Low	58.4	Low	81 Å²	81	83.2 Å²	83.2	38%	0.379	47%	0.471	S	S	.	.			trans	-58.9	101.8	157.1	-72.7	-174.4	-46.3	0	0	109	I341 V345	I341-Q343 VanDerWaalsContact C-N 3.3Å; I341-Q343 PolarHBondContact O-N 3.09Å; Q343-V345 PolarHBondContact O-N 2.87Å
344	T	34.4	Very low	57.1	Low	89 Å²	89	86 Å²	86	55%	0.546	49%	0.49	S	S	.	.			trans	-75.9	91.6	175.9	39.9	0	0	0	0	109.3	R342 G346 V347	R342-T344 PolarHBondContact O-N 2.88Å; T344-G346 PolarHBondContact O-N 2.79Å; T344-V347 PolarHBondContact O-N 2.88Å
345	V	36.5	Very low	56.1	Low	153 Å²	153	84.9 Å²	84.9	93%	0.927	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	103.7	169.6	-178.3	0	0	0	0	108.1	Q343	Q343-V345 PolarHBondContact O-N 2.87Å
346	G	33.9	Very low	55.7	Low	77 Å²	77	80 Å²	80	79%	0.794	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	124.3	-14	-173	0	0	0	0	0	115.9	T344	T344-G346 PolarHBondContact O-N 2.79Å
347	V	32.3	Very low	55.3	Low	100 Å²	100	77 Å²	77	61%	0.606	45%	0.446	S	S	*	.			trans	-130.9	70.3	175.5	-167.7	0	0	0	0	110.6	T344 S349	T344-V347 PolarHBondContact O-N 2.88Å; V347-S349 PolarHBondContact O-N 3.03Å
348	S	31.6	Very low	55.2	Low	122 Å²	122	79 Å²	79	85%	0.853	46%	0.455	S	S	*	.			trans	-76.8	65.6	175.6	59.3	0	0	0	0	112.2	K350	S348-K350 PolarHBondContact O-N 2.97Å
349	S	31	Very low	55.4	Low	43 Å²	43	75.5 Å²	75.5	30%	0.301	44%	0.437	S	S	.	.			trans	-57.2	121.4	155.7	149.9	0	0	0	0	108.1	V347 A351 D352	V347-S349 PolarHBondContact O-N 3.03Å; S349-A351 PolarHBondContact O-N 2.79Å; S349-A351 VanDerWaalsContact O-N 3.15Å; S349-A351 PolarHBondContact OG-N 3.47Å; S349-D352 WeakPolarHBondContact CB-OD2 3.49Å; S349-D352 PolarHBondContact O-N 2.83Å; S349-D352 PolarHBondContact OG-N 2.93Å; S349-D352 PolarHBondContact OG-OD2 3.35Å
350	K	36.7	Very low	55.8	Low	195 Å²	195	75.5 Å²	75.5	85%	0.848	44%	0.437	S	S	*	.	H	α-helix	trans	-63.4	-15	176.4	-84.9	-172.8	173.6	-178.1	0	112.8	S348	S348-K350 PolarHBondContact O-N 2.97Å
351	A	35.5	Very low	56.5	Low	61 Å²	61	73.3 Å²	73.3	50%	0.504	42%	0.422	S	S	.	.	H	α-helix	trans	-77.4	-50.3	176.8	0	0	0	0	0	111.7	S349 S353 S354	S349-A351 PolarHBondContact O-N 2.79Å; S349-A351 VanDerWaalsContact O-N 3.15Å; S349-A351 PolarHBondContact OG-N 3.47Å; A351-S353 PolarHBondContact O-N 3.44Å; A351-S354 WeakPolarHBondContact O-CB 3.32Å; A351-S354 PolarHBondContact O-N 2.87Å; A351-S354 PolarHBondContact O-OG 2.82Å
352	D	40.3	Very low	57.2	Low	104 Å²	104	72.4 Å²	72.4	56%	0.556	42%	0.417	S	S	*	.	H	α-helix	trans	-64	-39	-173.6	-65.6	-75.7	0	0	0	112.5	S349 S354	S349-D352 WeakPolarHBondContact CB-OD2 3.49Å; S349-D352 PolarHBondContact O-N 2.83Å; S349-D352 PolarHBondContact OG-N 2.93Å; S349-D352 PolarHBondContact OG-OD2 3.35Å; D352-S354 VanDerWaalsContact C-N 3.27Å; D352-S354 PolarHBondContact O-N 2.95Å
353	S	48.8	Very low	58.4	Low	59 Å²	59	64.5 Å²	64.5	41%	0.413	39%	0.388	S	S	.	.	H	α-helix	trans	-65.6	-29.2	175.5	59.5	0	0	0	0	112.8	A351 M355 H357	A351-S353 PolarHBondContact O-N 3.44Å; S353-M355 PolarHBondContact O-N 2.75Å; S353-H357 PolarHBondContact O-CE1 2.89Å; S353-H357 VanDerWaalsContact O-CE1 3.3Å; S353-H357 PolarHBondContact O-ND1 2.7Å
354	S	57.1	Low	60.1	Low	60 Å²	60	62.6 Å²	62.6	42%	0.42	38%	0.377	S	S	.	.	H	α-helix	trans	-68.5	-33.9	-177.2	77.7	0	0	0	0	113.3	A351 D352 H357	A351-S354 WeakPolarHBondContact O-CB 3.32Å; A351-S354 PolarHBondContact O-N 2.87Å; A351-S354 PolarHBondContact O-OG 2.82Å; D352-S354 VanDerWaalsContact C-N 3.27Å; D352-S354 PolarHBondContact O-N 2.95Å; S354-H357 PolarHBondContact O-N 2.88Å
355	M	65	Low	62.3	Low	64 Å²	64	61.6 Å²	61.6	32%	0.315	37%	0.369	S	S	.	.	H	α-helix	trans	-71.2	-35.7	-172.9	-63.9	179.4	69.6	0	0	112.6	T337 S353 H357 Q358	T337-M355 HydrophobicContact CG2-CE 3.75Å; S353-M355 PolarHBondContact O-N 2.75Å; M355-H357 PolarHBondContact O-N 3.41Å; M355-Q358 WeakPolarHBondContact O-CB 3.33Å; M355-Q358 PolarHBondContact O-N 2.89Å
356	N	74.7	Confident	64.2	Low	9 Å²	9	58 Å²	58	5%	0.048	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-68.9	-15.9	180	-74.3	-9.3	0	0	0	114.1	P303 F304 S340 Q358	P303-N356 HydrophobicContact CB-CB 4.26Å; F304-N356 HydrophobicContact CD1-CB 4.35Å; F304-N356 HydrophobicContact CE1-CB 3.82Å; F304-N356 HydrophobicContact CZ-CB 4.3Å; S340-N356 PolarHBondContact N-OD1 2.86Å; S340-N356 VanDerWaalsContact N-OD1 3.11Å; S340-N356 PolarHBondContact O-ND2 3.02Å; S340-N356 PolarHBondContact O-OD1 2.81Å; N356-Q358 PolarHBondContact O-N 3.26Å
357	H	76.2	Confident	66.2	Low	64 Å²	64	56.1 Å²	56.1	30%	0.296	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-77.8	-5.9	175.2	-66.7	84.4	0	0	0	112.9	S353 S354 M355 F359	S353-H357 PolarHBondContact O-CE1 2.89Å; S353-H357 VanDerWaalsContact O-CE1 3.3Å; S353-H357 PolarHBondContact O-ND1 2.7Å; S354-H357 PolarHBondContact O-N 2.88Å; M355-H357 PolarHBondContact O-N 3.41Å; H357-F359 VanDerWaalsContact C-N 3.29Å
358	Q	83.3	Confident	67.8	Low	55 Å²	55	56.6 Å²	56.6	26%	0.257	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-88.8	10.3	175.1	-55.4	178	8.6	0	0	113.1	A333 M355 N356 S470	A333-Q358 HydrophobicContact CB-CB 4.08Å; M355-Q358 WeakPolarHBondContact O-CB 3.33Å; M355-Q358 PolarHBondContact O-N 2.89Å; N356-Q358 PolarHBondContact O-N 3.26Å; Q358-S470 WeakPolarHBondContact O-CA 3.31Å; Q358-S470 WeakPolarHBondContact O-CB 3.45Å
359	F	90.6	Very high	69	Low	2 Å²	2	56 Å²	56	1%	0.009	30%	0.297	C	S	.	.			trans	-139.7	137.4	-175.8	-60.3	-85.9	0	0	0	111.1	F304 A333 T337 P339 H357 V441 L468 F469	F304-F359 WeakPolarHBondContact CA-O 3.29Å; F304-F359 HydrophobicContact CD1-CB 4.07Å; F304-F359 HydrophobicContact CE1-CB 4.45Å; A333-F359 HydrophobicContact CB-CE1 3.88Å; A333-F359 HydrophobicContact CB-CE2 4.12Å; A333-F359 HydrophobicContact CB-CZ 3.52Å; T337-F359 HydrophobicContact CG2-CE2 3.61Å; T337-F359 HydrophobicContact CG2-CZ 3.7Å; P339-F359 HydrophobicContact CB-CD2 3.84Å; P339-F359 HydrophobicContact CB-CE2 3.72Å; P339-F359 HydrophobicContact CB-CZ 4.34Å; P339-F359 HydrophobicContact CG-CD2 4.13Å; P339-F359 HydrophobicContact CG-CE1 4.32Å; P339-F359 HydrophobicContact CG-CE2 3.79Å; P339-F359 HydrophobicContact CG-CZ 3.89Å; H357-F359 VanDerWaalsContact C-N 3.29Å; F359-V441 HydrophobicContact CE1-CG2 3.83Å; F359-V441 HydrophobicContact CZ-CG2 3.75Å; F359-L468 HydrophobicContact CB-CB 4.42Å; F359-L468 HydrophobicContact CD1-CB 4.25Å; F359-F469 CarbonylContact C-O 3.54Å; F359-F469 WeakPolarHBondContact CA-O 3.29Å
360	V	92.6	Very high	70.3	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	135	160.6	-171.9	0	0	0	0	107.7	D306 C326 L327 W362 F469	D306-V360 HydrophobicContact CB-CG1 4.12Å; D306-V360 HydrophobicContact CB-CG2 3.87Å; C326-V360 HydrophobicContact CB-CG2 4.25Å; L327-V360 HydrophobicContact CD2-CB 3.97Å; L327-V360 HydrophobicContact CD2-CG2 4.02Å; L327-V360 HydrophobicContact CG-CB 4.2Å; L327-V360 HydrophobicContact CG-CG2 3.94Å; V360-W362 HydrophobicContact CB-CH2 4.3Å; V360-W362 HydrophobicContact CG1-CH2 3.92Å; V360-W362 HydrophobicContact CG1-CZ2 3.7Å; V360-F469 PolarHBondContact N-O 3.2Å; V360-F469 PolarHBondContact O-N 2.68Å
361	G	92.7	Very high	70.7	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	148.2	-163.7	0	0	0	0	0	115.7	G266 S267 F304 L467 L468	G266-G361 CarbonylContact C-O 3.57Å; G266-G361 WeakPolarHBondContact CA-O 3.22Å; S267-G361 PolarHBondContact N-O 2.9Å; F304-G361 PolarHBondContact O-N 2.91Å; G361-L467 WeakPolarHBondContact CA-O 3.36Å; G361-L468 VanDerWaalsContact CA-CD2 3.44Å
362	W	91.6	Very high	71.5	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	145	-175.3	-55.9	-83.5	0	0	0	111.8	I263 P264 E265 L327 V360 W367 V378 M380 F462 W466 L467 F469	I263-W362 HydrophobicContact CD1-CZ2 4.15Å; P264-W362 PolarHBondContact O-NE1 3.27Å; E265-W362 PolarHBondContact O-NE1 3Å; L327-W362 HydrophobicContact CD1-CH2 4.32Å; V360-W362 HydrophobicContact CB-CH2 4.3Å; V360-W362 HydrophobicContact CG1-CH2 3.92Å; V360-W362 HydrophobicContact CG1-CZ2 3.7Å; W362-W367 HydrophobicContact CB-CH2 3.83Å; W362-W367 HydrophobicContact CB-CZ3 3.95Å; W362-W367 AromaticContact CD1-CH2 3.9Å; W362-W367 AromaticContact CG-CH2 4Å; W362-W367 HydrophobicContact CG-CH2 4Å; W362-V378 HydrophobicContact CB-CG2 4.04Å; W362-V378 HydrophobicContact CD2-CG1 3.89Å; W362-V378 HydrophobicContact CD2-CG2 4.09Å; W362-V378 HydrophobicContact CE3-CG1 4.18Å; W362-V378 HydrophobicContact CE3-CG2 4.19Å; W362-V378 HydrophobicContact CG-CG1 4.32Å; W362-V378 HydrophobicContact CG-CG2 4.03Å; W362-V378 HydrophobicContact CZ2-CG1 4.31Å; W362-M380 HydrophobicContact CE3-CE 4.34Å; W362-M380 HydrophobicContact CH2-CE 3.41Å; W362-M380 VanDerWaalsContact CH2-CE 3.41Å; W362-M380 HydrophobicContact CZ2-CE 4.1Å; W362-M380 HydrophobicContact CZ3-CE 3.55Å; W362-F462 HydrophobicContact CB-CE1 4.33Å; W362-F462 HydrophobicContact CB-CZ 3.83Å; W362-F462 WeakPolarHBondContact O-CE1 3.5Å; W362-W466 VanDerWaalsContact O-CE3 3.22Å; W362-L467 PolarHBondContact N-O 3.01Å; W362-L467 PolarHBondContact O-N 3.07Å; W362-F469 HydrophobicContact CZ3-CB 4.47Å; W362-F469 AromaticContact CZ3-CD2 3.76Å; W362-F469 HydrophobicContact CZ3-CD2 3.76Å; W362-F469 HydrophobicContact CZ3-CE2 4.35Å; W362-F469 HydrophobicContact CZ3-CG 4.39Å
363	H	89.6	Confident	72	Confident	17 Å²	17	62.5 Å²	62.5	8%	0.079	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	132.5	174.1	-170	-125.3	0	0	0	110.2	S267 P271 D365 R366 W367 D465 W466	S267-H363 PolarHBondContact OG-N 3.21Å; P271-H363 WeakPolarHBondContact CG-ND1 3.13Å; H363-D365 IonicContact CE1-OD1 2.78Å; H363-D365 IonicContact CE1-OD2 2.72Å; H363-D365 PolarHBondContact CE1-OD2 3.07Å; H363-D365 WeakPolarHBondContact ND1-CB 3.46Å; H363-D365 IonicContact ND1-OD2 3.45Å; H363-D365 PolarHBondContact O-N 3.26Å; H363-D365 VanDerWaalsContact O-N 3.1Å; H363-R366 PolarHBondContact O-N 3.23Å; H363-R366 VanDerWaalsContact O-N 3.16Å; H363-W367 WeakPolarHBondContact O-CZ3 3.33Å; H363-D465 PolarHBondContact CD2-O 2.99Å; H363-W466 HydrophobicContact CB-CD2 4.1Å; H363-W466 HydrophobicContact CB-CE3 4.15Å; H363-W466 HydrophobicContact CB-CH2 3.81Å; H363-W466 HydrophobicContact CB-CZ2 3.75Å; H363-W466 HydrophobicContact CB-CZ3 4.02Å; H363-W466 AromaticContact CD2-CD1 3.5Å; H363-W466 VanDerWaalsContact CD2-CD1 3.5Å; H363-W466 AromaticContact CD2-CD2 3.81Å; H363-W466 AromaticContact CD2-CE2 3.38Å; H363-W466 AromaticContact CD2-CG 3.88Å; H363-W466 AromaticContact CD2-CZ2 3.93Å; H363-W466 AromaticContact CD2-NE1 3.17Å; H363-W466 PolarHBondContact CD2-NE1 2.88Å; H363-W466 AromaticContact CG-CE2 3.83Å; H363-W466 AromaticContact CG-CZ2 3.93Å; H363-W466 AromaticContact NE2-NE1 3.69Å
364	R	87.9	Confident	72.4	Confident	40 Å²	40	66 Å²	66	15%	0.151	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-53.5	-34	-175.9	-167.8	-168	-67.8	-108.8	2.6	113.3	R366 W367 K368 D376 F462 D464 D465	R364-R366 PolarHBondContact O-N 3.39Å; R364-W367 PolarHBondContact O-N 2.9Å; R364-K368 VanDerWaalsContact CD-CE 3.48Å; R364-D376 WeakPolarHBondContact CD-OD2 3.33Å; R364-D376 WeakPolarHBondContact CG-OD1 3.43Å; R364-D376 IonicContact CZ-OD2 2.65Å; R364-D376 IonicContact NE-OD2 3.69Å; R364-D376 IonicContact NH1-OD2 3.56Å; R364-D376 PolarHBondContact NH1-OD2 2.81Å; R364-F462 HydrophobicContact CB-CD1 4.17Å; R364-F462 HydrophobicContact CB-CE1 4.4Å; R364-F462 HydrophobicContact CB-CG 4.29Å; R364-F462 HydrophobicContact CG-CB 4.42Å; R364-F462 HydrophobicContact CG-CD2 4.42Å; R364-F462 HydrophobicContact CG-CG 4.29Å; R364-F462 VanDerWaalsContact NH2-CB 3.31Å; R364-F462 PolarHBondContact NH2-O 2.72Å; R364-D464 VanDerWaalsContact CZ-O 3.31Å; R364-D464 PolarHBondContact NE-O 2.78Å; R364-D464 VanDerWaalsContact NH2-N 3.19Å; R364-D464 PolarHBondContact NH2-O 3.33Å; R364-D465 PolarHBondContact N-O 2.95Å
365	D	81.3	Confident	72.7	Confident	69 Å²	69	65.8 Å²	65.8	37%	0.369	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-56.7	-24.9	-178.7	-70.9	0.8	0	0	0	114.4	H363 W367 K368	H363-D365 IonicContact CE1-OD1 2.78Å; H363-D365 IonicContact CE1-OD2 2.72Å; H363-D365 PolarHBondContact CE1-OD2 3.07Å; H363-D365 WeakPolarHBondContact ND1-CB 3.46Å; H363-D365 IonicContact ND1-OD2 3.45Å; H363-D365 PolarHBondContact O-N 3.26Å; H363-D365 VanDerWaalsContact O-N 3.1Å; D365-W367 PolarHBondContact O-N 3.29Å; D365-W367 VanDerWaalsContact O-N 3.17Å; D365-K368 PolarHBondContact O-N 2.83Å; D365-K368 VanDerWaalsContact OD1-CD 3.32Å; D365-K368 WeakPolarHBondContact OD1-CD 3.41Å; D365-K368 VanDerWaalsContact OD1-CE 3.23Å; D365-K368 WeakPolarHBondContact OD1-CE 3.4Å; D365-K368 IonicContact OD1-NZ 2.74Å; D365-K368 PolarHBondContact OD1-NZ 2.84Å
366	R	75.9	Confident	73.5	Confident	76 Å²	76	65.2 Å²	65.2	29%	0.287	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-55.9	-31.9	175.8	177.2	-175	-64.1	-132.6	5.5	112.1	E265 G266 S267 H363 R364 S369	E265-R366 PolarHBondContact O-NH1 3.31Å; E265-R366 VanDerWaalsContact O-NH1 3.09Å; E265-R366 PolarHBondContact O-NH2 3.03Å; G266-R366 PolarHBondContact O-NH2 3.49Å; S267-R366 PolarHBondContact OG-NE 3.17Å; S267-R366 PolarHBondContact OG-NH2 3.1Å; H363-R366 PolarHBondContact O-N 3.23Å; H363-R366 VanDerWaalsContact O-N 3.16Å; R364-R366 PolarHBondContact O-N 3.39Å; R366-S369 PolarHBondContact O-OG 3.09Å
367	W	75.9	Confident	74.2	Confident	38 Å²	38	65.3 Å²	65.3	14%	0.144	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-19.1	-178.3	-67.8	-93.5	0	0	0	114	P264 W362 H363 R364 D365 S369 S370 N375 V377 V378 F462	P264-W367 HydrophobicContact CB-CZ2 4.28Å; P264-W367 HydrophobicContact CG-CZ2 4.03Å; W362-W367 HydrophobicContact CB-CH2 3.83Å; W362-W367 HydrophobicContact CB-CZ3 3.95Å; W362-W367 AromaticContact CD1-CH2 3.9Å; W362-W367 AromaticContact CG-CH2 4Å; W362-W367 HydrophobicContact CG-CH2 4Å; H363-W367 WeakPolarHBondContact O-CZ3 3.33Å; R364-W367 PolarHBondContact O-N 2.9Å; D365-W367 PolarHBondContact O-N 3.29Å; D365-W367 VanDerWaalsContact O-N 3.17Å; W367-S369 PolarHBondContact O-N 3.27Å; W367-S369 VanDerWaalsContact O-N 3.09Å; W367-S370 WeakPolarHBondContact O-CB 3.19Å; W367-S370 PolarHBondContact O-N 3.15Å; W367-S370 PolarHBondContact O-OG 3.27Å; W367-N375 HydrophobicContact CB-CB 4.27Å; W367-N375 WeakPolarHBondContact CB-O 3.4Å; W367-V377 PolarHBondContact NE1-O 2.66Å; W367-V378 HydrophobicContact CH2-CG2 3.82Å; W367-V378 HydrophobicContact CZ2-CG2 4.25Å; W367-V378 HydrophobicContact CZ3-CG2 4.44Å; W367-F462 HydrophobicContact CD2-CE2 4.49Å; W367-F462 AromaticContact CE3-CE2 3.78Å; W367-F462 HydrophobicContact CE3-CE2 3.78Å; W367-F462 HydrophobicContact CE3-CZ 4.03Å; W367-F462 HydrophobicContact CH2-CE2 4.17Å; W367-F462 HydrophobicContact CH2-CZ 4.09Å; W367-F462 AromaticContact CZ3-CE2 3.62Å; W367-F462 HydrophobicContact CZ3-CE2 3.62Å; W367-F462 AromaticContact CZ3-CZ 3.48Å; W367-F462 HydrophobicContact CZ3-CZ 3.48Å; W367-F462 VanDerWaalsContact CZ3-CZ 3.48Å
368	K	65.9	Low	75	Confident	111 Å²	111	62.2 Å²	62.2	48%	0.483	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-14.2	-178.6	-65.4	-178.3	-169.5	162.9	0	114.4	R364 D365 D465	R364-K368 VanDerWaalsContact CD-CE 3.48Å; D365-K368 PolarHBondContact O-N 2.83Å; D365-K368 VanDerWaalsContact OD1-CD 3.32Å; D365-K368 WeakPolarHBondContact OD1-CD 3.41Å; D365-K368 VanDerWaalsContact OD1-CE 3.23Å; D365-K368 WeakPolarHBondContact OD1-CE 3.4Å; D365-K368 IonicContact OD1-NZ 2.74Å; D365-K368 PolarHBondContact OD1-NZ 2.84Å; K368-D465 IonicContact NZ-OD1 3.77Å
369	S	55.3	Low	75.4	Confident	108 Å²	108	62.2 Å²	62.2	76%	0.755	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-18.4	172.6	56.6	0	0	0	0	113.5	R366 W367	R366-S369 PolarHBondContact O-OG 3.09Å; W367-S369 PolarHBondContact O-N 3.27Å; W367-S369 VanDerWaalsContact O-N 3.09Å
370	S	58.9	Low	75.6	Confident	43 Å²	43	62.1 Å²	62.1	30%	0.301	31%	0.311	S	S	.	.	S	Bend	trans	-82.4	137.7	173.5	73.4	0	0	0	0	110	W367 D372 N375	W367-S370 WeakPolarHBondContact O-CB 3.19Å; W367-S370 PolarHBondContact O-N 3.15Å; W367-S370 PolarHBondContact O-OG 3.27Å; S370-D372 PolarHBondContact O-N 3.38Å; S370-N375 WeakPolarHBondContact CB-ND2 3.46Å; S370-N375 WeakPolarHBondContact OG-CB 3.34Å; S370-N375 PolarHBondContact OG-ND2 3.05Å
371	Q	46	Very low	75.8	Confident	205 Å²	205	64.4 Å²	64.4	96%	0.958	32%	0.323	S	S	*	.	S	Bend	trans	-77.5	-1	-171.5	-129.2	171.7	3.6	0	0	114
372	D	52.7	Low	75.9	Confident	95 Å²	95	64.4 Å²	64.4	51%	0.508	32%	0.323	S	S	.	.			trans	-96.7	125.2	-174.1	-144.3	-25.7	0	0	0	111	S370 D374 N375	S370-D372 PolarHBondContact O-N 3.38Å; D372-D374 VanDerWaalsContact C-N 3.28Å; D372-D374 PolarHBondContact O-N 2.94Å; D372-N375 WeakPolarHBondContact O-CB 3.5Å; D372-N375 PolarHBondContact O-N 2.77Å
373	K	50.5	Low	76.1	Confident	198 Å²	198	67.2 Å²	67.2	86%	0.861	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-74.7	-17.4	-170.7	-74	-178.5	178.7	173.8	0	113.9	N375	K373-N375 VanDerWaalsContact C-N 3.28Å
374	D	56.4	Low	76.4	Confident	131 Å²	131	66.4 Å²	66.4	70%	0.701	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-83.1	-3.9	178.5	-74.1	-20.2	0	0	0	113.2	D372 D376 V377	D372-D374 VanDerWaalsContact C-N 3.28Å; D372-D374 PolarHBondContact O-N 2.94Å; D374-D376 VanDerWaalsContact C-N 3.27Å; D374-D376 PolarHBondContact O-N 2.92Å; D374-V377 WeakPolarHBondContact O-CG1 3.19Å
375	N	63.6	Low	76.5	Confident	56 Å²	56	66.4 Å²	66.4	30%	0.299	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-77.9	3.4	-176.7	-77	-15.1	0	0	0	115.3	W367 S370 D372 K373 V377	W367-N375 HydrophobicContact CB-CB 4.27Å; W367-N375 WeakPolarHBondContact CB-O 3.4Å; S370-N375 WeakPolarHBondContact CB-ND2 3.46Å; S370-N375 WeakPolarHBondContact OG-CB 3.34Å; S370-N375 PolarHBondContact OG-ND2 3.05Å; D372-N375 WeakPolarHBondContact O-CB 3.5Å; D372-N375 PolarHBondContact O-N 2.77Å; K373-N375 VanDerWaalsContact C-N 3.28Å; N375-V377 PolarHBondContact O-N 3.42Å
376	D	82.1	Confident	76.9	Confident	53 Å²	53	64 Å²	64	28%	0.283	33%	0.327	S	S	.	.			trans	-73.4	49.1	171.2	-98.6	1.5	0	0	0	112.1	R364 D374 F462	R364-D376 WeakPolarHBondContact CD-OD2 3.33Å; R364-D376 WeakPolarHBondContact CG-OD1 3.43Å; R364-D376 IonicContact CZ-OD2 2.65Å; R364-D376 IonicContact NE-OD2 3.69Å; R364-D376 IonicContact NH1-OD2 3.56Å; R364-D376 PolarHBondContact NH1-OD2 2.81Å; D374-D376 VanDerWaalsContact C-N 3.27Å; D374-D376 PolarHBondContact O-N 2.92Å; D376-F462 PolarHBondContact O-N 3.45Å
377	V	90	Very high	77.7	Confident	10 Å²	10	61.9 Å²	61.9	6%	0.061	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	132.4	-171.9	66.1	0	0	0	0	111.6	W367 D374 N375 K459 A460 F461	W367-V377 PolarHBondContact NE1-O 2.66Å; D374-V377 WeakPolarHBondContact O-CG1 3.19Å; N375-V377 PolarHBondContact O-N 3.42Å; V377-K459 HydrophobicContact CG2-CB 3.75Å; V377-K459 HydrophobicContact CG2-CG 4.1Å; V377-A460 WeakPolarHBondContact CA-O 3.4Å; V377-F461 HydrophobicContact CB-CD1 3.72Å; V377-F461 HydrophobicContact CB-CE1 3.71Å; V377-F461 HydrophobicContact CB-CG 4.33Å; V377-F461 HydrophobicContact CB-CZ 4.32Å; V377-F461 HydrophobicContact CG1-CE1 4.36Å; V377-F461 HydrophobicContact CG2-CD1 3.77Å; V377-F461 HydrophobicContact CG2-CD2 4.09Å; V377-F461 HydrophobicContact CG2-CE1 3.63Å; V377-F461 HydrophobicContact CG2-CE2 3.97Å; V377-F461 HydrophobicContact CG2-CG 3.99Å; V377-F461 HydrophobicContact CG2-CZ 3.74Å
378	V	92.6	Very high	78.5	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	117.2	164.2	-169.3	0	0	0	0	107.6	P264 W362 W367 M380 K459 A460 F462 L467	P264-V378 HydrophobicContact CG-CG1 4.22Å; W362-V378 HydrophobicContact CB-CG2 4.04Å; W362-V378 HydrophobicContact CD2-CG1 3.89Å; W362-V378 HydrophobicContact CD2-CG2 4.09Å; W362-V378 HydrophobicContact CE3-CG1 4.18Å; W362-V378 HydrophobicContact CE3-CG2 4.19Å; W362-V378 HydrophobicContact CG-CG1 4.32Å; W362-V378 HydrophobicContact CG-CG2 4.03Å; W362-V378 HydrophobicContact CZ2-CG1 4.31Å; W367-V378 HydrophobicContact CH2-CG2 3.82Å; W367-V378 HydrophobicContact CZ2-CG2 4.25Å; W367-V378 HydrophobicContact CZ3-CG2 4.44Å; V378-M380 HydrophobicContact CB-CE 4.21Å; V378-M380 HydrophobicContact CG1-CE 3.56Å; V378-M380 HydrophobicContact CG1-CG 4.16Å; V378-K459 WeakPolarHBondContact O-CA 3.1Å; V378-A460 PolarHBondContact N-O 3.47Å; V378-A460 PolarHBondContact O-N 3.39Å; V378-F462 HydrophobicContact CG2-CD2 4.48Å; V378-F462 HydrophobicContact CG2-CE2 3.51Å; V378-F462 HydrophobicContact CG2-CZ 3.52Å; V378-L467 HydrophobicContact CG2-CD2 3.85Å
379	D	91.6	Very high	79.8	Confident	55 Å²	55	57.2 Å²	57.2	29%	0.294	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	124	178.6	-162.2	5.6	0	0	0	109.2	P264 Q457 K459	P264-D379 WeakPolarHBondContact CD-O 3.48Å; D379-Q457 VanDerWaalsContact CG-NE2 3.35Å; D379-Q457 VanDerWaalsContact OD1-CG 3.29Å; D379-Q457 WeakPolarHBondContact OD1-CG 3.22Å; D379-Q457 PolarHBondContact OD1-NE2 2.68Å; D379-Q457 PolarHBondContact OD2-NE2 2.82Å; D379-K459 HydrophobicContact CB-CG 4.41Å; D379-K459 WeakPolarHBondContact OD1-CG 3.35Å; D379-K459 IonicContact OD1-NZ 3.8Å; D379-K459 PolarHBondContact OD1-NZ 2.78Å; D379-K459 WeakPolarHBondContact OD2-CE 3.48Å; D379-K459 IonicContact OD2-NZ 3.92Å; D379-K459 PolarHBondContact OD2-NZ 3.2Å
380	M	95.3	Very high	81.7	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	134.5	-174.6	-55.1	178.5	-173.9	0	0	109.5	I263 W362 V378 F382 Q457 L458 F469 I472	I263-M380 HydrophobicContact CB-CG 4.46Å; I263-M380 HydrophobicContact CG2-CB 3.75Å; I263-M380 HydrophobicContact CG2-CG 3.73Å; I263-M380 HydrophobicContact CG2-SD 4.39Å; W362-M380 HydrophobicContact CE3-CE 4.34Å; W362-M380 HydrophobicContact CH2-CE 3.41Å; W362-M380 VanDerWaalsContact CH2-CE 3.41Å; W362-M380 HydrophobicContact CZ2-CE 4.1Å; W362-M380 HydrophobicContact CZ3-CE 3.55Å; V378-M380 HydrophobicContact CB-CE 4.21Å; V378-M380 HydrophobicContact CG1-CE 3.56Å; V378-M380 HydrophobicContact CG1-CG 4.16Å; M380-F382 HydrophobicContact CB-CD2 4.46Å; M380-F382 HydrophobicContact CB-CE2 3.6Å; M380-F382 HydrophobicContact CB-CZ 4.09Å; M380-F382 HydrophobicContact SD-CE2 4.44Å; M380-F382 HydrophobicContact SD-CZ 4.25Å; M380-Q457 CarbonylContact O-C 3.58Å; M380-Q457 WeakPolarHBondContact O-CA 3.23Å; M380-L458 HydrophobicContact CB-CB 4.33Å; M380-L458 PolarHBondContact N-O 3.43Å; M380-L458 PolarHBondContact O-N 3.22Å; M380-L458 HydrophobicContact SD-CD2 4.16Å; M380-F469 HydrophobicContact CE-CE2 4.21Å; M380-F469 HydrophobicContact CE-CZ 4.34Å; M380-I472 HydrophobicContact SD-CD1 4.03Å
381	L	95.1	Very high	83.4	Confident	47 Å²	47	51.3 Å²	51.3	25%	0.246	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	134.7	176.7	-73.5	162.5	0	0	0	109.9	Y261 R262 F422 V455 V456 Q457	Y261-L381 CarbonylContact C-O 3.51Å; Y261-L381 WeakPolarHBondContact CA-O 3.18Å; Y261-L381 WeakPolarHBondContact CB-O 3.07Å; R262-L381 HydrophobicContact CB-CB 4.27Å; R262-L381 PolarHBondContact N-O 3.31Å; R262-L381 PolarHBondContact O-N 2.04Å; L381-F422 HydrophobicContact CD2-CE1 4.45Å; L381-F422 HydrophobicContact CD2-CE2 4.27Å; L381-F422 HydrophobicContact CD2-CZ 3.73Å; L381-V455 HydrophobicContact CD2-CG1 4.25Å; L381-V456 WeakPolarHBondContact CA-O 3.16Å; L381-Q457 HydrophobicContact CD2-CB 3.68Å; L381-Q457 HydrophobicContact CD2-CG 3.87Å
382	F	96.4	Very high	85.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	123	-177.4	-63.6	-91	0	0	0	109.1	L258 Y261 M380 F384 V455 V456 L458 I472 F474	L258-F382 HydrophobicContact CD1-CB 3.78Å; L258-F382 HydrophobicContact CD1-CD1 4.06Å; L258-F382 HydrophobicContact CD1-CG 4.43Å; L258-F382 HydrophobicContact CD2-CD1 4.2Å; Y261-F382 HydrophobicContact CD1-CD1 4.46Å; Y261-F382 HydrophobicContact CD1-CE1 4.2Å; Y261-F382 HydrophobicContact CG-CD1 4.49Å; Y261-F382 HydrophobicContact CG-CE1 4.29Å; M380-F382 HydrophobicContact CB-CD2 4.46Å; M380-F382 HydrophobicContact CB-CE2 3.6Å; M380-F382 HydrophobicContact CB-CZ 4.09Å; M380-F382 HydrophobicContact SD-CE2 4.44Å; M380-F382 HydrophobicContact SD-CZ 4.25Å; F382-F384 HydrophobicContact CB-CE2 3.89Å; F382-F384 HydrophobicContact CB-CZ 4.32Å; F382-V455 CarbonylContact O-C 3.45Å; F382-V455 VanDerWaalsContact O-CA 3.26Å; F382-V455 WeakPolarHBondContact O-CA 3.26Å; F382-V455 WeakPolarHBondContact O-CG1 3.33Å; F382-V456 HydrophobicContact CB-CB 4.46Å; F382-V456 PolarHBondContact N-O 3.5Å; F382-V456 PolarHBondContact O-N 3.12Å; F382-L458 HydrophobicContact CE2-CB 4.01Å; F382-L458 HydrophobicContact CE2-CD2 4.3Å; F382-I472 HydrophobicContact CE1-CD1 4.46Å; F382-I472 HydrophobicContact CE1-CG2 4.15Å; F382-I472 HydrophobicContact CZ-CD1 3.83Å; F382-I472 HydrophobicContact CZ-CG2 4.03Å; F382-F474 HydrophobicContact CB-CE2 4.46Å; F382-F474 HydrophobicContact CB-CZ 4.16Å; F382-F474 AromaticContact CD1-CE2 3.75Å; F382-F474 HydrophobicContact CD1-CE2 3.75Å; F382-F474 AromaticContact CD1-CZ 3.87Å; F382-F474 HydrophobicContact CD1-CZ 3.87Å; F382-F474 HydrophobicContact CD2-CE2 4.48Å; F382-F474 AromaticContact CD2-CZ 3.77Å; F382-F474 HydrophobicContact CD2-CZ 3.77Å; F382-F474 HydrophobicContact CE1-CE2 4.08Å; F382-F474 HydrophobicContact CE1-CZ 4.2Å; F382-F474 HydrophobicContact CE2-CZ 4.1Å; F382-F474 AromaticContact CG-CE2 3.98Å; F382-F474 HydrophobicContact CG-CE2 3.98Å; F382-F474 AromaticContact CG-CZ 3.65Å; F382-F474 HydrophobicContact CG-CZ 3.65Å; F382-F474 HydrophobicContact CZ-CZ 4.32Å
383	R	95.4	Very high	87.7	Confident	59 Å²	59	42.2 Å²	42.2	22%	0.223	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	135.6	177.9	179.2	179	71.2	78.8	2.8	111	E188 L258 V259 E260 V455	E188-R383 IonicContact OE1-CZ 2.68Å; E188-R383 IonicContact OE1-NH1 2.68Å; E188-R383 PolarHBondContact OE1-NH1 2.56Å; E188-R383 IonicContact OE2-CZ 3.96Å; E188-R383 VanDerWaalsContact OE2-CZ 3.24Å; E188-R383 IonicContact OE2-NH1 3.71Å; E188-R383 PolarHBondContact OE2-NH1 3.16Å; E188-R383 IonicContact OE2-NH2 2.63Å; E188-R383 PolarHBondContact OE2-NH2 2.95Å; L258-R383 WeakPolarHBondContact CD1-O 3.24Å; V259-R383 HydrophobicContact CG2-CG 4.37Å; V259-R383 VanDerWaalsContact CG2-O 3.22Å; V259-R383 WeakPolarHBondContact CG2-O 3.5Å; V259-R383 PolarHBondContact N-O 2.92Å; E260-R383 HydrophobicContact CG-CB 3.8Å; E260-R383 PolarHBondContact N-O 3.04Å; E260-R383 PolarHBondContact O-N 3.36Å; E260-R383 IonicContact OE1-CZ 3.55Å; E260-R383 IonicContact OE1-NE 3.99Å; E260-R383 PolarHBondContact OE1-NE 2.83Å; E260-R383 IonicContact OE1-NH2 3.44Å; E260-R383 IonicContact OE2-CZ 2.68Å; E260-R383 IonicContact OE2-NE 2.71Å; E260-R383 PolarHBondContact OE2-NE 3.39Å; E260-R383 IonicContact OE2-NH2 2.78Å; E260-R383 PolarHBondContact OE2-NH2 3.44Å; R383-V455 HydrophobicContact CB-CG2 4.31Å; R383-V455 HydrophobicContact CG-CG2 4.19Å
384	F	94.7	Very high	89.7	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	149.8	-177.1	-62.7	-92.5	0	0	0	111.1	D256 D257 L258 F382 S386 R388 F390 Q454 V456 F474	D256-F384 WeakPolarHBondContact O-CD1 3.13Å; D257-F384 CarbonylContact O-C 3.58Å; D257-F384 VanDerWaalsContact O-CA 3.31Å; D257-F384 WeakPolarHBondContact O-CA 3.17Å; L258-F384 HydrophobicContact CB-CD1 4.01Å; L258-F384 HydrophobicContact CB-CE1 3.82Å; L258-F384 HydrophobicContact CD1-CD1 4.06Å; L258-F384 HydrophobicContact CD1-CD2 4.33Å; L258-F384 HydrophobicContact CD1-CE1 3.7Å; L258-F384 HydrophobicContact CD1-CE2 3.96Å; L258-F384 HydrophobicContact CD1-CG 4.39Å; L258-F384 HydrophobicContact CD1-CZ 3.64Å; L258-F384 HydrophobicContact CG-CE1 4.34Å; F382-F384 HydrophobicContact CB-CE2 3.89Å; F382-F384 HydrophobicContact CB-CZ 4.32Å; F384-S386 PolarHBondContact O-N 2.84Å; F384-S386 VanDerWaalsContact O-N 3.13Å; F384-R388 HydrophobicContact CB-CG 4.44Å; F384-F390 HydrophobicContact CD1-CE1 4.4Å; F384-F390 HydrophobicContact CD1-CZ 4.42Å; F384-F390 HydrophobicContact CD2-CE1 4.16Å; F384-F390 AromaticContact CD2-CZ 3.66Å; F384-F390 HydrophobicContact CD2-CZ 3.66Å; F384-F390 AromaticContact CE1-CE1 3.98Å; F384-F390 HydrophobicContact CE1-CE1 3.98Å; F384-F390 HydrophobicContact CE1-CZ 4.38Å; F384-F390 AromaticContact CE2-CE1 3.75Å; F384-F390 HydrophobicContact CE2-CE1 3.75Å; F384-F390 AromaticContact CE2-CZ 3.64Å; F384-F390 HydrophobicContact CE2-CZ 3.64Å; F384-F390 HydrophobicContact CG-CE1 4.47Å; F384-F390 HydrophobicContact CG-CZ 4.07Å; F384-F390 AromaticContact CZ-CE1 3.64Å; F384-F390 HydrophobicContact CZ-CE1 3.64Å; F384-F390 HydrophobicContact CZ-CZ 4.01Å; F384-Q454 WeakPolarHBondContact CD2-O 3.45Å; F384-Q454 PolarHBondContact N-O 3.39Å; F384-Q454 WeakPolarHBondContact O-CG 3.26Å; F384-Q454 PolarHBondContact O-NE2 2.63Å; F384-V456 HydrophobicContact CD2-CG2 4.37Å; F384-V456 HydrophobicContact CE2-CB 4.23Å; F384-V456 HydrophobicContact CE2-CG2 3.71Å; F384-F474 HydrophobicContact CE1-CB 4.18Å; F384-F474 HydrophobicContact CE1-CD2 4.22Å; F384-F474 HydrophobicContact CE1-CG 4.21Å; F384-F474 HydrophobicContact CZ-CB 4.08Å; F384-F474 AromaticContact CZ-CD1 3.97Å; F384-F474 HydrophobicContact CZ-CD1 3.97Å; F384-F474 AromaticContact CZ-CD2 3.73Å; F384-F474 HydrophobicContact CZ-CD2 3.73Å; F384-F474 HydrophobicContact CZ-CE1 4.31Å; F384-F474 HydrophobicContact CZ-CE2 4.07Å; F384-F474 AromaticContact CZ-CG 3.67Å; F384-F474 HydrophobicContact CZ-CG 3.67Å; F384-F474 HydrophobicContact CZ-CZ 4.35Å
385	A	91.5	Very high	91.6	Very high	41 Å²	41	28.9 Å²	28.9	34%	0.339	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	-15.3	-175.4	0	0	0	0	0	114.1	D257 V259	D257-A385 HydrophobicContact CB-CB 4.12Å; D257-A385 PolarHBondContact O-N 3.05Å; V259-A385 HydrophobicContact CG1-CB 3.76Å
386	S	89.8	Confident	93	Very high	18 Å²	18	26.8 Å²	26.8	13%	0.126	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	169.2	176	56.2	0	0	0	0	110.9	F384 R388 K478	F384-S386 PolarHBondContact O-N 2.84Å; F384-S386 VanDerWaalsContact O-N 3.13Å; S386-R388 WeakPolarHBondContact O-CG 3.26Å; S386-R388 PolarHBondContact O-N 3.43Å; S386-K478 WeakPolarHBondContact OG-CD 3.09Å; S386-K478 VanDerWaalsContact OG-CE 3.27Å; S386-K478 WeakPolarHBondContact OG-CE 3.38Å
387	V	91.9	Very high	93.6	Very high	31 Å²	31	24.3 Å²	24.3	19%	0.188	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	128.6	177.9	-165.3	0	0	0	0	110.2	V417 I452 G453 Q454 V479 I483	V387-V417 HydrophobicContact CG1-CG1 4.41Å; V387-V417 HydrophobicContact CG1-CG2 4.48Å; V387-V417 HydrophobicContact CG2-CG1 4.05Å; V387-I452 HydrophobicContact CG1-CG2 3.51Å; V387-G453 WeakPolarHBondContact CA-O 3.08Å; V387-Q454 HydrophobicContact CG2-CB 4.35Å; V387-V479 PolarHBondContact O-N 3.47Å; V387-I483 HydrophobicContact CB-CD1 4.14Å; V387-I483 HydrophobicContact CG1-CD1 3.63Å; V387-I483 HydrophobicContact CG2-CD1 4.5Å
388	R	93	Very high	93.7	Very high	9 Å²	9	23.8 Å²	23.8	3%	0.034	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	155	-176.7	-47.7	-170.3	71.4	87.7	-1.3	112.1	S255 D256 D257 F384 S386 F390 I452 G453 S476 E477	S255-R388 PolarHBondContact O-NH2 2.92Å; D256-R388 VanDerWaalsContact O-CD 3.26Å; D256-R388 WeakPolarHBondContact O-CD 3.47Å; D256-R388 PolarHBondContact O-NE 3.33Å; D256-R388 PolarHBondContact O-NH1 3.22Å; D256-R388 VanDerWaalsContact O-NH1 3.16Å; D257-R388 VanDerWaalsContact CB-NH1 3.33Å; D257-R388 IonicContact OD2-CZ 2.7Å; D257-R388 IonicContact OD2-NH1 2.75Å; D257-R388 PolarHBondContact OD2-NH1 2.83Å; F384-R388 HydrophobicContact CB-CG 4.44Å; S386-R388 WeakPolarHBondContact O-CG 3.26Å; S386-R388 PolarHBondContact O-N 3.43Å; R388-F390 HydrophobicContact CB-CD2 4.37Å; R388-F390 HydrophobicContact CB-CE1 4.32Å; R388-F390 HydrophobicContact CB-CE2 3.89Å; R388-F390 HydrophobicContact CB-CZ 3.85Å; R388-F390 HydrophobicContact CG-CZ 4.27Å; R388-I452 VanDerWaalsContact O-CA 3.28Å; R388-I452 WeakPolarHBondContact O-CA 3.36Å; R388-G453 PolarHBondContact N-O 3.15Å; R388-G453 PolarHBondContact O-N 2.65Å; R388-S476 PolarHBondContact NE-OG 3.22Å; R388-S476 PolarHBondContact NH2-O 3.19Å; R388-E477 CarbonylContact C-O 3.6Å; R388-E477 VanDerWaalsContact CA-O 3.24Å; R388-E477 WeakPolarHBondContact CA-O 3.35Å; R388-E477 WeakPolarHBondContact CB-O 3.38Å
389	N	93.3	Very high	93.7	Very high	42 Å²	42	24.3 Å²	24.3	23%	0.225	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	115.1	163.9	174	-18.2	0	0	0	107.7	H450 S476 E477 V479	N389-H450 VanDerWaalsContact OD1-C 3.31Å; N389-H450 WeakPolarHBondContact OD1-CA 3.25Å; N389-H450 VanDerWaalsContact OD1-CB 3.24Å; N389-H450 WeakPolarHBondContact OD1-CB 3.22Å; N389-H450 PolarHBondContact OD1-ND1 2.87Å; N389-H450 PolarHBondContact OD1-O 2.81Å; N389-S476 CarbonylContact O-C 3.51Å; N389-S476 WeakPolarHBondContact O-CA 3.11Å; N389-S476 VanDerWaalsContact O-CB 3.29Å; N389-S476 WeakPolarHBondContact O-CB 3.47Å; N389-E477 PolarHBondContact N-O 3.49Å; N389-E477 PolarHBondContact O-N 3.43Å; N389-V479 HydrophobicContact CB-CG2 4.3Å
390	F	94.6	Very high	93.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	118.8	-175.4	-66.8	-85.5	0	0	0	112	F384 R388 F415 L448 H450 R451 G453 V456 F474 S476	F384-F390 HydrophobicContact CD1-CE1 4.4Å; F384-F390 HydrophobicContact CD1-CZ 4.42Å; F384-F390 HydrophobicContact CD2-CE1 4.16Å; F384-F390 AromaticContact CD2-CZ 3.66Å; F384-F390 HydrophobicContact CD2-CZ 3.66Å; F384-F390 AromaticContact CE1-CE1 3.98Å; F384-F390 HydrophobicContact CE1-CE1 3.98Å; F384-F390 HydrophobicContact CE1-CZ 4.38Å; F384-F390 AromaticContact CE2-CE1 3.75Å; F384-F390 HydrophobicContact CE2-CE1 3.75Å; F384-F390 AromaticContact CE2-CZ 3.64Å; F384-F390 HydrophobicContact CE2-CZ 3.64Å; F384-F390 HydrophobicContact CG-CE1 4.47Å; F384-F390 HydrophobicContact CG-CZ 4.07Å; F384-F390 AromaticContact CZ-CE1 3.64Å; F384-F390 HydrophobicContact CZ-CE1 3.64Å; F384-F390 HydrophobicContact CZ-CZ 4.01Å; R388-F390 HydrophobicContact CB-CD2 4.37Å; R388-F390 HydrophobicContact CB-CE1 4.32Å; R388-F390 HydrophobicContact CB-CE2 3.89Å; R388-F390 HydrophobicContact CB-CZ 3.85Å; R388-F390 HydrophobicContact CG-CZ 4.27Å; F390-F415 HydrophobicContact CB-CE1 3.8Å; F390-F415 HydrophobicContact CB-CZ 4.42Å; F390-F415 AromaticContact CD2-CD1 3.69Å; F390-F415 HydrophobicContact CD2-CD1 3.69Å; F390-F415 AromaticContact CD2-CE1 3.56Å; F390-F415 HydrophobicContact CD2-CE1 3.56Å; F390-F415 HydrophobicContact CE2-CD1 4.13Å; F390-F415 HydrophobicContact CE2-CE1 4.29Å; F390-F415 HydrophobicContact CG-CD1 4.33Å; F390-F415 AromaticContact CG-CE1 3.73Å; F390-F415 HydrophobicContact CG-CE1 3.73Å; F390-L448 HydrophobicContact CB-CB 3.98Å; F390-L448 HydrophobicContact CB-CD1 3.74Å; F390-L448 HydrophobicContact CD1-CD1 4.45Å; F390-L448 HydrophobicContact CG-CD1 4.4Å; F390-L448 CarbonylContact O-C 3.49Å; F390-L448 WeakPolarHBondContact O-CB 3.27Å; F390-H450 WeakPolarHBondContact O-CA 2.97Å; F390-H450 PolarHBondContact O-N 2.88Å; F390-R451 WeakPolarHBondContact CD2-O 3.4Å; F390-R451 PolarHBondContact N-O 2.87Å; F390-R451 PolarHBondContact O-N 3.25Å; F390-G453 WeakPolarHBondContact CE2-O 3.47Å; F390-V456 HydrophobicContact CD1-CG2 4.39Å; F390-V456 HydrophobicContact CD2-CG2 4.27Å; F390-V456 HydrophobicContact CE1-CG2 3.91Å; F390-V456 HydrophobicContact CE2-CG2 3.75Å; F390-V456 HydrophobicContact CZ-CG2 3.56Å; F390-F474 HydrophobicContact CD1-CB 4.34Å; F390-F474 HydrophobicContact CD1-CD1 4.33Å; F390-F474 HydrophobicContact CE1-CB 4.29Å; F390-F474 HydrophobicContact CE1-CD1 4.33Å; F390-S476 VanDerWaalsContact CD1-CB 3.49Å
391	T	94	Very high	93.2	Very high	28 Å²	28	25.4 Å²	25.4	17%	0.172	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-49.4	-177.4	-53.9	0	0	0	0	111.5	L448 H450 E475	T391-L448 PolarHBondContact O-N 3.29Å; T391-H450 VanDerWaalsContact CG2-CE1 3.47Å; T391-H450 WeakPolarHBondContact CG2-CE1 3.48Å; T391-H450 PolarHBondContact OG1-CE1 2.98Å; T391-H450 VanDerWaalsContact OG1-CE1 3.26Å; T391-H450 PolarHBondContact OG1-ND1 3.28Å; T391-E475 WeakPolarHBondContact CA-O 3Å; T391-E475 WeakPolarHBondContact CB-O 3.45Å; T391-E475 PolarHBondContact N-O 2.7Å
392	R	94.5	Very high	92.8	Very high	109 Å²	109	29.1 Å²	29.1	41%	0.411	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	158.7	177.6	-50.4	-170.4	-174.8	107	-2.7	113.4	I445 L446 F474 E475	R392-I445 HydrophobicContact CB-CG2 4.26Å; R392-L446 CarbonylContact C-O 3.52Å; R392-L446 VanDerWaalsContact CA-O 3.23Å; R392-L446 WeakPolarHBondContact CA-O 3.39Å; R392-L446 WeakPolarHBondContact CB-O 3.21Å; R392-F474 CarbonylContact O-C 3.58Å; R392-E475 HydrophobicContact CB-CB 4Å; R392-E475 HydrophobicContact CB-CG 4.26Å; R392-E475 VanDerWaalsContact CD-OE2 3.27Å; R392-E475 WeakPolarHBondContact CD-OE2 3.17Å; R392-E475 WeakPolarHBondContact CG-OE2 3.27Å; R392-E475 IonicContact CZ-OE2 2.7Å; R392-E475 PolarHBondContact N-O 3.26Å; R392-E475 VanDerWaalsContact N-O 3.07Å; R392-E475 IonicContact NE-OE2 3.43Å; R392-E475 IonicContact NH1-OE1 3.64Å; R392-E475 IonicContact NH1-OE2 3.73Å; R392-E475 PolarHBondContact NH1-OE2 2.05Å; R392-E475 PolarHBondContact O-N 3.42Å
393	L	95	Very high	92.3	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	122.6	169.4	168.4	56.1	0	0	0	109.3	L395 V413 I445 L446 L448 L458 I472 R473 F474	L393-L395 HydrophobicContact CD1-CD2 3.55Å; L393-L395 HydrophobicContact CD1-CG 4.3Å; L393-L395 HydrophobicContact CD2-CD2 4.16Å; L393-L395 HydrophobicContact CG-CD2 3.78Å; L393-L395 HydrophobicContact CG-CG 4.08Å; L393-V413 HydrophobicContact CD2-CG2 4.21Å; L393-I445 WeakPolarHBondContact O-CA 3.45Å; L393-L446 HydrophobicContact CB-CB 4.35Å; L393-L446 HydrophobicContact CD2-CD1 4.32Å; L393-L446 PolarHBondContact N-O 2.87Å; L393-L446 PolarHBondContact O-N 2.84Å; L393-L448 HydrophobicContact CB-CD1 3.74Å; L393-L448 HydrophobicContact CB-CD2 4.06Å; L393-L448 HydrophobicContact CB-CG 3.99Å; L393-L458 HydrophobicContact CD2-CD1 4.05Å; L393-L458 HydrophobicContact CD2-CD2 4.39Å; L393-I472 HydrophobicContact CD1-CG2 3.83Å; L393-R473 CarbonylContact C-O 3.58Å; L393-R473 WeakPolarHBondContact CA-O 3.37Å; L393-R473 VanDerWaalsContact CD1-O 3.24Å; L393-R473 WeakPolarHBondContact CD1-O 3.23Å; L393-F474 HydrophobicContact CD1-CD1 3.85Å; L393-F474 HydrophobicContact CD1-CD2 4.5Å; L393-F474 HydrophobicContact CD1-CE1 3.62Å; L393-F474 HydrophobicContact CD1-CE2 4.31Å; L393-F474 HydrophobicContact CD1-CG 4.28Å; L393-F474 HydrophobicContact CD1-CZ 3.88Å; L393-F474 HydrophobicContact CD2-CE1 4.12Å; L393-F474 HydrophobicContact CG-CE1 4.38Å
394	R	93.9	Very high	92	Very high	48 Å²	48	33.1 Å²	33.1	18%	0.181	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	131.3	173.6	-54.7	-168.2	-173.8	-166.1	4.2	109.7	D83 Y396 I444 I445 I472 R473 E475	D83-R394 IonicContact OD2-CZ 3.6Å; D83-R394 IonicContact OD2-NH1 3.46Å; D83-R394 PolarHBondContact OD2-NH1 2.83Å; D83-R394 IonicContact OD2-NH2 3.88Å; D83-R394 PolarHBondContact OD2-NH2 2.99Å; R394-Y396 HydrophobicContact CB-CE2 4.48Å; R394-I444 CarbonylContact C-O 3.52Å; R394-I444 WeakPolarHBondContact CA-O 3.12Å; R394-I445 HydrophobicContact CG-CG1 4.22Å; R394-I472 CarbonylContact O-C 3.5Å; R394-I472 WeakPolarHBondContact O-CA 3.41Å; R394-R473 HydrophobicContact CB-CB 4.48Å; R394-R473 PolarHBondContact N-O 3.03Å; R394-R473 PolarHBondContact O-N 3.13Å; R394-E475 IonicContact CZ-OE1 3.7Å; R394-E475 IonicContact NE-OE1 2.85Å; R394-E475 PolarHBondContact NE-OE1 2.74Å; R394-E475 IonicContact NH2-OE1 3.28Å; R394-E475 PolarHBondContact NH2-OE1 2.87Å
395	L	94.6	Very high	91.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.8	179.8	-52.8	173.6	0	0	0	109.4	L393 I397 L411 S443 I444 L458 F469 I472	L393-L395 HydrophobicContact CD1-CD2 3.55Å; L393-L395 HydrophobicContact CD1-CG 4.3Å; L393-L395 HydrophobicContact CD2-CD2 4.16Å; L393-L395 HydrophobicContact CG-CD2 3.78Å; L393-L395 HydrophobicContact CG-CG 4.08Å; L395-I397 HydrophobicContact CB-CD1 4.06Å; L395-I397 HydrophobicContact CB-CG1 4.02Å; L395-I397 HydrophobicContact CD1-CD1 4.36Å; L395-L411 HydrophobicContact CD1-CD1 3.48Å; L395-L411 VanDerWaalsContact CD1-CD1 3.48Å; L395-L411 HydrophobicContact CD1-CD2 4.26Å; L395-S443 CarbonylContact O-C 3.52Å; L395-S443 WeakPolarHBondContact O-CA 3.2Å; L395-I444 HydrophobicContact CB-CB 4.43Å; L395-I444 PolarHBondContact N-O 2.86Å; L395-I444 PolarHBondContact O-N 3.45Å; L395-L458 HydrophobicContact CD1-CD2 4.43Å; L395-L458 HydrophobicContact CD2-CD2 3.96Å; L395-F469 HydrophobicContact CB-CE1 4.21Å; L395-F469 HydrophobicContact CD1-CE1 4.2Å; L395-F469 HydrophobicContact CD2-CE1 4.13Å; L395-F469 HydrophobicContact CG-CE1 4.42Å; L395-I472 HydrophobicContact CD2-CB 4.2Å; L395-I472 HydrophobicContact CD2-CD1 4.36Å; L395-I472 HydrophobicContact CD2-CG1 3.89Å; L395-I472 HydrophobicContact CD2-CG2 3.77Å
396	Y	94.4	Very high	91.8	Very high	13 Å²	13	32.9 Å²	32.9	5%	0.051	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	108.8	175.1	-62.6	-99.1	0	0	0	108.6	Y84 R394 F442 F469 S470 E471	Y84-Y396 HydrophobicContact CE2-CE1 4.45Å; R394-Y396 HydrophobicContact CB-CE2 4.48Å; Y396-F442 WeakPolarHBondContact CA-O 3.49Å; Y396-F469 CarbonylContact O-C 3.58Å; Y396-F469 WeakPolarHBondContact O-CA 3.25Å; Y396-S470 WeakPolarHBondContact CB-OG 3.47Å; Y396-S470 PolarHBondContact O-N 2.78Å; Y396-E471 HydrophobicContact CD2-CB 3.59Å; Y396-E471 HydrophobicContact CD2-CG 3.9Å; Y396-E471 HydrophobicContact CE2-CB 4.28Å; Y396-E471 HydrophobicContact CE2-CG 4.11Å; Y396-E471 HydrophobicContact CG-CB 4.12Å; Y396-E471 PolarHBondContact N-O 2.97Å
397	I	94.1	Very high	91.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	136.1	-169	-49.5	-173.1	0	0	0	110	L395 L407 P408 F442 I444 L467 L468 F469	L395-I397 HydrophobicContact CB-CD1 4.06Å; L395-I397 HydrophobicContact CB-CG1 4.02Å; L395-I397 HydrophobicContact CD1-CD1 4.36Å; I397-L407 HydrophobicContact CB-CD2 3.86Å; I397-L407 HydrophobicContact CG2-CD2 3.81Å; I397-P408 HydrophobicContact CD1-CG 3.98Å; I397-F442 PolarHBondContact N-O 3.31Å; I397-F442 PolarHBondContact O-N 3.3Å; I397-I444 HydrophobicContact CD1-CD1 4.01Å; I397-L467 HydrophobicContact CG2-CD1 4.21Å; I397-L468 WeakPolarHBondContact CA-O 3.35Å; I397-L468 VanDerWaalsContact CG2-O 3.27Å; I397-L468 WeakPolarHBondContact CG2-O 3.24Å; I397-F469 HydrophobicContact CD1-CD1 4.11Å; I397-F469 HydrophobicContact CD1-CE1 3.53Å; I397-F469 HydrophobicContact CD1-CE2 4.03Å; I397-F469 HydrophobicContact CD1-CZ 3.49Å; I397-F469 VanDerWaalsContact CD1-CZ 3.49Å; I397-F469 HydrophobicContact CG1-CD1 3.82Å; I397-F469 HydrophobicContact CG1-CD2 4.43Å; I397-F469 HydrophobicContact CG1-CE1 3.78Å; I397-F469 HydrophobicContact CG1-CE2 4.4Å; I397-F469 HydrophobicContact CG1-CG 4.17Å; I397-F469 HydrophobicContact CG1-CZ 4.09Å
398	S	92.4	Very high	92	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	148.3	176.4	-165.8	0	0	0	0	112.8	P339 L468	P339-S398 VanDerWaalsContact CD-OG 3.22Å; P339-S398 WeakPolarHBondContact CD-OG 3.37Å; P339-S398 VanDerWaalsContact CG-OG 3.3Å; P339-S398 WeakPolarHBondContact CG-OG 3.37Å; S398-L468 PolarHBondContact N-O 2.8Å
399	N	91.6	Very high	91.9	Very high	10 Å²	10	38.3 Å²	38.3	5%	0.053	17%	0.168	C	C	.	.			trans	-132.6	62.2	175.4	-169.5	63.4	0	0	0	111.4	Y401 I405 R406 L407 S438 G440 F442	N399-Y401 VanDerWaalsContact C-N 3.33Å; N399-Y401 PolarHBondContact O-N 2.95Å; N399-I405 CarbonylContact C-O 3.59Å; N399-R406 WeakPolarHBondContact OD1-CA 3.31Å; N399-L407 HydrophobicContact CB-CD2 3.94Å; N399-L407 HydrophobicContact CB-CG 3.92Å; N399-L407 PolarHBondContact OD1-N 2.87Å; N399-S438 PolarHBondContact ND2-O 2.86Å; N399-G440 PolarHBondContact N-O 2.85Å; N399-F442 HydrophobicContact CB-CD2 3.79Å; N399-F442 HydrophobicContact CB-CE2 3.52Å; N399-F442 HydrophobicContact CB-CZ 4.31Å
400	N	90	Very high	91.9	Very high	10 Å²	10	40 Å²	40	5%	0.053	17%	0.172	C	C	.	.			trans	-84.6	74.1	169.6	-176.1	7.1	0	0	0	111.3	I338 P339 L402 E403 K404 I405	I338-N400 HydrophobicContact CG2-CB 4.11Å; I338-N400 WeakPolarHBondContact CG2-ND2 3.46Å; P339-N400 PolarHBondContact O-ND2 3.18Å; N400-L402 PolarHBondContact O-N 3.04Å; N400-L402 VanDerWaalsContact O-N 3.07Å; N400-E403 CarbonylContact O-C 3.52Å; N400-E403 PolarHBondContact O-N 3.13Å; N400-K404 PolarHBondContact O-N 3.06Å; N400-I405 CarbonylContact C-O 3.57Å; N400-I405 HydrophobicContact CB-CB 4.01Å; N400-I405 HydrophobicContact CB-CD1 3.88Å; N400-I405 PolarHBondContact N-O 2.84Å; N400-I405 VanDerWaalsContact N-O 3.16Å; N400-I405 PolarHBondContact O-N 3.33Å
401	Y	87.1	Confident	92	Very high	68 Å²	68	40 Å²	40	27%	0.267	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-65.3	-12.1	-175.9	68.5	-98.7	0	0	0	114.1	N399 E403 I405 L439	N399-Y401 VanDerWaalsContact C-N 3.33Å; N399-Y401 PolarHBondContact O-N 2.95Å; Y401-E403 VanDerWaalsContact C-N 3.31Å; Y401-I405 WeakPolarHBondContact CA-O 3.41Å; Y401-I405 PolarHBondContact N-O 2.71Å; Y401-I405 VanDerWaalsContact N-O 3.14Å; Y401-L439 HydrophobicContact CD1-CD2 3.5Å; Y401-L439 HydrophobicContact CD1-CG 4.37Å; Y401-L439 HydrophobicContact CE1-CD2 3.4Å; Y401-L439 VanDerWaalsContact CE1-CD2 3.4Å; Y401-L439 HydrophobicContact CE1-CG 3.84Å; Y401-L439 HydrophobicContact CG-CD2 4.21Å
402	L	86.2	Confident	92	Very high	125 Å²	125	40 Å²	40	65%	0.654	17%	0.17	S	C	*	.	G	3₁₀ helix	trans	-71.1	-29.7	172.9	-61.5	175.6	0	0	0	111.6	N400 L439	N400-L402 PolarHBondContact O-N 3.04Å; N400-L402 VanDerWaalsContact O-N 3.07Å; L402-L439 HydrophobicContact CD1-CD1 3.91Å; L402-L439 HydrophobicContact CD1-CD2 4.44Å; L402-L439 HydrophobicContact CG-CD2 4.24Å
403	E	85.8	Confident	92	Very high	41 Å²	41	34.8 Å²	34.8	19%	0.192	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-108.7	22.7	175.7	-55.9	-149.2	137.4	0	0	112.6	S340 I341 R342 N400 Y401 I405	S340-E403 WeakPolarHBondContact CA-OE2 3.41Å; I341-E403 HydrophobicContact CD1-CB 4.03Å; I341-E403 VanDerWaalsContact CD1-O 3.23Å; I341-E403 WeakPolarHBondContact CD1-O 3.28Å; I341-E403 PolarHBondContact N-OE2 2.91Å; R342-E403 VanDerWaalsContact CD-OE1 3.23Å; R342-E403 WeakPolarHBondContact CD-OE1 3.35Å; R342-E403 WeakPolarHBondContact CG-OE1 3.43Å; R342-E403 IonicContact NE-OE1 3.44Å; R342-E403 PolarHBondContact NE-OE1 2.89Å; N400-E403 CarbonylContact O-C 3.52Å; N400-E403 PolarHBondContact O-N 3.13Å; Y401-E403 VanDerWaalsContact C-N 3.31Å; E403-I405 HydrophobicContact CB-CD1 4.46Å; E403-I405 PolarHBondContact O-N 3.13Å
404	K	89.1	Confident	92	Very high	103 Å²	103	37.7 Å²	37.7	45%	0.448	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	18.9	-178.9	-52.4	-176.9	-176.6	173.1	0	115.5	N400 D464 D465 W466	N400-K404 PolarHBondContact O-N 3.06Å; K404-D464 WeakPolarHBondContact CB-OD1 3.38Å; K404-D464 WeakPolarHBondContact O-CB 3.29Å; K404-D465 HydrophobicContact CB-CB 4.12Å; K404-D465 HydrophobicContact CD-CB 3.8Å; K404-D465 WeakPolarHBondContact CD-OD2 3.29Å; K404-D465 WeakPolarHBondContact CE-OD2 3.5Å; K404-D465 IonicContact NZ-OD2 2.63Å; K404-D465 PolarHBondContact NZ-OD2 3.1Å; K404-W466 PolarHBondContact O-N 2.76Å
405	I	90.8	Very high	91.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-83	122.3	168.8	-63.6	154.9	0	0	0	107.6	P339 I341 N399 N400 Y401 E403 W466 L468	P339-I405 HydrophobicContact CG-CD1 4.34Å; I341-I405 HydrophobicContact CD1-CD1 3.57Å; I341-I405 HydrophobicContact CD1-CG1 3.56Å; I341-I405 HydrophobicContact CG1-CD1 4.04Å; I341-I405 HydrophobicContact CG1-CG1 4.43Å; N399-I405 CarbonylContact C-O 3.59Å; N400-I405 CarbonylContact C-O 3.57Å; N400-I405 HydrophobicContact CB-CB 4.01Å; N400-I405 HydrophobicContact CB-CD1 3.88Å; N400-I405 PolarHBondContact N-O 2.84Å; N400-I405 VanDerWaalsContact N-O 3.16Å; N400-I405 PolarHBondContact O-N 3.33Å; Y401-I405 WeakPolarHBondContact CA-O 3.41Å; Y401-I405 PolarHBondContact N-O 2.71Å; Y401-I405 VanDerWaalsContact N-O 3.14Å; E403-I405 HydrophobicContact CB-CD1 4.46Å; E403-I405 PolarHBondContact O-N 3.13Å; I405-W466 HydrophobicContact CB-CB 4.33Å; I405-W466 HydrophobicContact CG1-CB 3.69Å; I405-W466 HydrophobicContact CG1-CG 4.35Å; I405-L468 HydrophobicContact CD1-CD1 3.56Å; I405-L468 HydrophobicContact CD1-CG 4.42Å; I405-L468 HydrophobicContact CG1-CD1 3.89Å; I405-L468 HydrophobicContact CG1-CG 4.21Å; I405-L468 HydrophobicContact CG2-CB 4.28Å; I405-L468 HydrophobicContact CG2-CD1 3.88Å; I405-L468 HydrophobicContact CG2-CG 3.86Å
406	R	91.2	Very high	91.8	Very high	35 Å²	35	36.4 Å²	36.4	13%	0.132	16%	0.16	C	C	.	.			trans	-136.2	155.3	178.3	-71	-160.7	-165.3	-112.7	-4.5	114	N399 N436 A463 D464 W466 L467	N399-R406 WeakPolarHBondContact OD1-CA 3.31Å; R406-N436 PolarHBondContact NH1-OD1 3.48Å; R406-A463 HydrophobicContact CB-CB 4Å; R406-D464 HydrophobicContact CB-CB 4.01Å; R406-D464 HydrophobicContact CG-CB 3.67Å; R406-D464 IonicContact CZ-OD2 3.93Å; R406-D464 IonicContact NE-OD2 2.76Å; R406-D464 PolarHBondContact NE-OD2 2.92Å; R406-D464 IonicContact NH2-OD2 3.53Å; R406-W466 PolarHBondContact N-O 3.06Å; R406-W466 VanDerWaalsContact N-O 3.09Å; R406-L467 WeakPolarHBondContact O-CD1 3.13Å
407	L	92.4	Very high	91.4	Very high	32 Å²	32	38.3 Å²	38.3	17%	0.168	17%	0.173	C	C	.	.			trans	-53.6	143.8	160.7	-53	-176.1	0	0	0	110.4	I397 N399 F442 I444 A463	I397-L407 HydrophobicContact CB-CD2 3.86Å; I397-L407 HydrophobicContact CG2-CD2 3.81Å; N399-L407 HydrophobicContact CB-CD2 3.94Å; N399-L407 HydrophobicContact CB-CG 3.92Å; N399-L407 PolarHBondContact OD1-N 2.87Å; L407-F442 HydrophobicContact CD1-CB 4.46Å; L407-F442 HydrophobicContact CD1-CD1 4.19Å; L407-F442 HydrophobicContact CD1-CG 4.18Å; L407-F442 HydrophobicContact CD2-CB 3.97Å; L407-F442 HydrophobicContact CD2-CD2 4.19Å; L407-F442 HydrophobicContact CD2-CG 4.13Å; L407-I444 HydrophobicContact CD1-CD1 4.45Å; L407-I444 HydrophobicContact CD2-CD1 4.39Å; L407-A463 WeakPolarHBondContact O-CB 3.2Å
408	P	93.3	Very high	90.4	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	20%	0.199	C	C	.	.			trans	-63.4	143.7	-178.7	26.5	-33.9	0	0	0	111.1	I397 R410 L411 F432 A460 F461 L467	I397-P408 HydrophobicContact CD1-CG 3.98Å; P408-R410 VanDerWaalsContact C-N 3.31Å; P408-R410 PolarHBondContact O-N 2.82Å; P408-L411 HydrophobicContact CB-CD2 4.15Å; P408-L411 HydrophobicContact CB-CG 4.44Å; P408-L411 HydrophobicContact CG-CD1 4.21Å; P408-L411 HydrophobicContact CG-CD2 3.63Å; P408-L411 HydrophobicContact CG-CG 3.78Å; P408-F432 WeakPolarHBondContact O-CB 3.21Å; P408-F432 VanDerWaalsContact O-CD2 3.24Å; P408-F432 WeakPolarHBondContact O-CD2 3.49Å; P408-A460 HydrophobicContact CB-CB 4.26Å; P408-F461 CarbonylContact C-O 3.04Å; P408-F461 WeakPolarHBondContact CA-O 3.27Å; P408-F461 WeakPolarHBondContact CB-O 3.33Å; P408-L467 HydrophobicContact CB-CD1 4.09Å; P408-L467 HydrophobicContact CG-CD1 4.33Å
409	R	92.6	Very high	89.3	Confident	139 Å²	139	42.4 Å²	42.4	53%	0.525	22%	0.215	S	C	.	.	S	Bend	trans	-66.9	-37.6	179.2	172.2	-179.2	161.4	158.1	-0.2	111	E431 F432 F461 A463	R409-E431 IonicContact NH2-OE1 3.58Å; R409-E431 CarbonylContact O-C 3.57Å; R409-E431 WeakPolarHBondContact O-CA 3.42Å; R409-F432 PolarHBondContact O-N 3.27Å; R409-F461 PolarHBondContact N-O 2.99Å; R409-A463 HydrophobicContact CB-CB 4.04Å
410	R	93.4	Very high	88.1	Confident	77 Å²	77	44 Å²	44	29%	0.291	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	142.8	178.2	179.9	176.2	63.4	166.3	-13.7	108.7	P408 E412 R430 E431 F461	P408-R410 VanDerWaalsContact C-N 3.31Å; P408-R410 PolarHBondContact O-N 2.82Å; R410-E412 WeakPolarHBondContact CD-OE1 3.32Å; R410-E412 HydrophobicContact CG-CG 3.98Å; R410-E412 IonicContact CZ-OE1 2.79Å; R410-E412 VanDerWaalsContact CZ-OE1 3.28Å; R410-E412 IonicContact CZ-OE2 3.66Å; R410-E412 IonicContact NE-OE1 3.75Å; R410-E412 PolarHBondContact NE-OE1 3.21Å; R410-E412 IonicContact NH1-OE1 2.85Å; R410-E412 PolarHBondContact NH1-OE1 3.07Å; R410-E412 IonicContact NH1-OE2 3.17Å; R410-R430 CarbonylContact C-O 3.44Å; R410-R430 WeakPolarHBondContact CA-O 3.28Å; R410-E431 HydrophobicContact CB-CG 4.4Å; R410-E431 HydrophobicContact CG-CG 4.33Å; R410-F461 HydrophobicContact CB-CB 4.13Å; R410-F461 HydrophobicContact CB-CD2 3.81Å; R410-F461 HydrophobicContact CB-CG 4.22Å; R410-F461 HydrophobicContact CG-CD2 3.96Å; R410-F461 HydrophobicContact CG-CE2 4.36Å; R410-F461 VanDerWaalsContact NE-CE2 3.31Å; R410-F461 WeakPolarHBondContact O-CD2 3.49Å; R410-F461 PolarHBondContact O-N 2.81Å
411	L	95.4	Very high	87.1	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.5	164.6	-70.8	173	0	0	0	108.5	L395 P408 S429 R430 F432 I444 L446 L458 K459 A460	L395-L411 HydrophobicContact CD1-CD1 3.48Å; L395-L411 VanDerWaalsContact CD1-CD1 3.48Å; L395-L411 HydrophobicContact CD1-CD2 4.26Å; P408-L411 HydrophobicContact CB-CD2 4.15Å; P408-L411 HydrophobicContact CB-CG 4.44Å; P408-L411 HydrophobicContact CG-CD1 4.21Å; P408-L411 HydrophobicContact CG-CD2 3.63Å; P408-L411 HydrophobicContact CG-CG 3.78Å; L411-S429 CarbonylContact O-C 3.58Å; L411-S429 WeakPolarHBondContact O-CA 3.49Å; L411-R430 PolarHBondContact N-O 2.95Å; L411-R430 PolarHBondContact O-N 2.88Å; L411-F432 HydrophobicContact CB-CE2 4.21Å; L411-F432 HydrophobicContact CD1-CE2 3.68Å; L411-F432 HydrophobicContact CD1-CZ 3.85Å; L411-F432 HydrophobicContact CG-CE2 3.82Å; L411-F432 HydrophobicContact CG-CZ 4.49Å; L411-I444 HydrophobicContact CD1-CG2 4.34Å; L411-L446 HydrophobicContact CB-CD1 4.26Å; L411-L446 HydrophobicContact CD1-CD1 4.05Å; L411-L446 HydrophobicContact CD1-CD2 4.42Å; L411-L458 HydrophobicContact CD2-CD1 4.24Å; L411-K459 CarbonylContact C-O 3.58Å; L411-K459 WeakPolarHBondContact CA-O 3.39Å; L411-A460 HydrophobicContact CD2-CB 3.7Å
412	E	94.5	Very high	86.7	Confident	27 Å²	27	44.9 Å²	44.9	13%	0.126	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	135.5	171.5	-62.6	-169.4	150.5	0	0	111.1	R410 I428 S429 L458 K459 F461	R410-E412 WeakPolarHBondContact CD-OE1 3.32Å; R410-E412 HydrophobicContact CG-CG 3.98Å; R410-E412 IonicContact CZ-OE1 2.79Å; R410-E412 VanDerWaalsContact CZ-OE1 3.28Å; R410-E412 IonicContact CZ-OE2 3.66Å; R410-E412 IonicContact NE-OE1 3.75Å; R410-E412 PolarHBondContact NE-OE1 3.21Å; R410-E412 IonicContact NH1-OE1 2.85Å; R410-E412 PolarHBondContact NH1-OE1 3.07Å; R410-E412 IonicContact NH1-OE2 3.17Å; E412-I428 CarbonylContact C-O 3.59Å; E412-I428 VanDerWaalsContact CA-O 3.31Å; E412-I428 WeakPolarHBondContact CA-O 3.28Å; E412-S429 WeakPolarHBondContact CG-OG 3.49Å; E412-S429 PolarHBondContact OE1-OG 2.73Å; E412-S429 VanDerWaalsContact OE1-OG 3.11Å; E412-L458 WeakPolarHBondContact O-CA 3.48Å; E412-K459 HydrophobicContact CB-CB 4.27Å; E412-K459 PolarHBondContact N-O 2.68Å; E412-K459 PolarHBondContact O-N 3.16Å; E412-F461 HydrophobicContact CB-CE2 4.37Å; E412-F461 HydrophobicContact CG-CE2 3.92Å
413	V	95.3	Very high	85.5	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	129.4	-179.5	-165.1	0	0	0	0	110.1	L393 F415 P427 I428 L446 L448 V456 Q457 L458	L393-V413 HydrophobicContact CD2-CG2 4.21Å; V413-F415 HydrophobicContact CB-CE2 4.41Å; V413-F415 HydrophobicContact CG1-CE1 4.44Å; V413-F415 HydrophobicContact CG1-CE2 3.8Å; V413-F415 HydrophobicContact CG1-CZ 3.67Å; V413-P427 WeakPolarHBondContact O-CA 3.31Å; V413-I428 HydrophobicContact CB-CB 4.37Å; V413-I428 PolarHBondContact N-O 3.32Å; V413-I428 PolarHBondContact O-N 2.86Å; V413-L446 HydrophobicContact CG2-CD1 3.89Å; V413-L448 HydrophobicContact CB-CD2 4.33Å; V413-L448 HydrophobicContact CG1-CD2 4.11Å; V413-L448 HydrophobicContact CG2-CD2 4.18Å; V413-V456 HydrophobicContact CG1-CG1 3.53Å; V413-Q457 CarbonylContact C-O 3.59Å; V413-Q457 VanDerWaalsContact CA-O 3.28Å; V413-Q457 WeakPolarHBondContact CA-O 3.17Å; V413-L458 HydrophobicContact CG2-CD1 3.92Å
414	K	93.3	Very high	84.5	Confident	62 Å²	62	45.2 Å²	45.2	27%	0.27	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	158.2	172.9	-59.9	-178.7	-173	177.3	0	110.9	F422 P427 V456 Q457	K414-F422 HydrophobicContact CB-CB 4.29Å; K414-F422 HydrophobicContact CB-CD1 3.85Å; K414-F422 HydrophobicContact CB-CG 4.48Å; K414-F422 HydrophobicContact CD-CB 4.16Å; K414-P427 HydrophobicContact CG-CB 3.86Å; K414-V456 WeakPolarHBondContact O-CA 3.27Å; K414-Q457 HydrophobicContact CB-CB 4.28Å; K414-Q457 PolarHBondContact N-O 3.26Å; K414-Q457 PolarHBondContact O-N 2.9Å
415	F	93.2	Very high	83.7	Confident	9 Å²	9	44.2 Å²	44.2	4%	0.039	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	144.7	-175.7	-59.2	-93.9	0	0	0	110.1	F390 V413 I428 L448 R451 V455 V456	F390-F415 HydrophobicContact CB-CE1 3.8Å; F390-F415 HydrophobicContact CB-CZ 4.42Å; F390-F415 AromaticContact CD2-CD1 3.69Å; F390-F415 HydrophobicContact CD2-CD1 3.69Å; F390-F415 AromaticContact CD2-CE1 3.56Å; F390-F415 HydrophobicContact CD2-CE1 3.56Å; F390-F415 HydrophobicContact CE2-CD1 4.13Å; F390-F415 HydrophobicContact CE2-CE1 4.29Å; F390-F415 HydrophobicContact CG-CD1 4.33Å; F390-F415 AromaticContact CG-CE1 3.73Å; F390-F415 HydrophobicContact CG-CE1 3.73Å; V413-F415 HydrophobicContact CB-CE2 4.41Å; V413-F415 HydrophobicContact CG1-CE1 4.44Å; V413-F415 HydrophobicContact CG1-CE2 3.8Å; V413-F415 HydrophobicContact CG1-CZ 3.67Å; F415-I428 HydrophobicContact CE2-CD1 4.25Å; F415-L448 HydrophobicContact CE1-CD1 4.21Å; F415-L448 HydrophobicContact CZ-CB 4.11Å; F415-L448 HydrophobicContact CZ-CD1 3.91Å; F415-L448 HydrophobicContact CZ-CD2 4.08Å; F415-L448 HydrophobicContact CZ-CG 4.24Å; F415-R451 HydrophobicContact CD1-CB 4.29Å; F415-R451 HydrophobicContact CD2-CB 3.9Å; F415-R451 HydrophobicContact CD2-CG 4.41Å; F415-R451 HydrophobicContact CE1-CB 4.34Å; F415-R451 HydrophobicContact CE2-CB 3.96Å; F415-R451 VanDerWaalsContact CE2-CD 3.48Å; F415-R451 HydrophobicContact CE2-CG 4.38Å; F415-R451 HydrophobicContact CG-CB 4.09Å; F415-R451 HydrophobicContact CZ-CB 4.18Å; F415-V455 WeakPolarHBondContact CA-O 3.32Å; F415-V456 HydrophobicContact CD1-CG1 4.45Å; F415-V456 HydrophobicContact CD1-CG2 3.8Å; F415-V456 HydrophobicContact CE1-CG1 4.11Å; F415-V456 HydrophobicContact CE1-CG2 3.81Å
416	S	91.4	Very high	83.3	Confident	11 Å²	11	51.1 Å²	51.1	8%	0.077	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	143.8	170.1	-171.4	0	0	0	0	109.9	G418 G419 V420 H421 G453 Q454 V455	S416-G418 PolarHBondContact OG-N 3.28Å; S416-G419 PolarHBondContact OG-N 2.81Å; S416-G419 VanDerWaalsContact OG-N 3.15Å; S416-V420 PolarHBondContact OG-N 3.05Å; S416-H421 WeakPolarHBondContact CB-O 3.44Å; S416-H421 PolarHBondContact OG-O 2.66Å; S416-G453 WeakPolarHBondContact O-CA 3.43Å; S416-Q454 PolarHBondContact O-N 2.85Å; S416-V455 PolarHBondContact N-O 2.88Å; S416-V455 PolarHBondContact O-N 2.96Å
417	V	86.3	Confident	83.1	Confident	53 Å²	53	51.2 Å²	51.2	32%	0.321	30%	0.299	S	S	.	.	S	Bend	trans	-81.4	-19.9	174.1	178.2	0	0	0	0	111.8	V387 Q454 I485	V387-V417 HydrophobicContact CG1-CG1 4.41Å; V387-V417 HydrophobicContact CG1-CG2 4.48Å; V387-V417 HydrophobicContact CG2-CG1 4.05Å; V417-Q454 WeakPolarHBondContact O-CB 3.46Å; V417-Q454 PolarHBondContact O-OE1 2.84Å; V417-I485 HydrophobicContact CG1-CD1 4.23Å
418	G	72.4	Confident	83	Confident	53 Å²	53	51 Å²	51	55%	0.546	30%	0.298	S	S	.	.	S	Bend	trans	-132.6	15.7	-178.7	0	0	0	0	0	115.2	S416 V420	S416-G418 PolarHBondContact OG-N 3.28Å; G418-V420 WeakPolarHBondContact O-CB 3.21Å; G418-V420 WeakPolarHBondContact O-CG2 3.35Å; G418-V420 PolarHBondContact O-N 3.22Å
419	G	70.4	Confident	82.9	Confident	33 Å²	33	53.8 Å²	53.8	34%	0.34	32%	0.318	S	S	.	.	S	Bend	trans	66.2	-0.5	-177.3	0	0	0	0	0	115.9	S416 F422	S416-G419 PolarHBondContact OG-N 2.81Å; S416-G419 VanDerWaalsContact OG-N 3.15Å; G419-F422 WeakPolarHBondContact O-CE2 3.13Å
420	V	66.3	Low	82.9	Confident	45 Å²	45	49.9 Å²	49.9	27%	0.273	30%	0.303	S	S	.	.	S	Bend	trans	-105.9	-48.6	-160.2	139.8	0	0	0	0	112.2	S416 G418 W1306	S416-V420 PolarHBondContact OG-N 3.05Å; G418-V420 WeakPolarHBondContact O-CB 3.21Å; G418-V420 WeakPolarHBondContact O-CG2 3.35Å; G418-V420 PolarHBondContact O-N 3.22Å; V420-W1306 HydrophobicContact CB-CD2 4.17Å; V420-W1306 HydrophobicContact CB-CE3 4.4Å; V420-W1306 HydrophobicContact CB-CG 4.42Å; V420-W1306 HydrophobicContact CG1-CD2 3.57Å; V420-W1306 VanDerWaalsContact CG1-CE2 3.45Å; V420-W1306 HydrophobicContact CG1-CE3 3.68Å; V420-W1306 HydrophobicContact CG1-CG 4.26Å; V420-W1306 HydrophobicContact CG1-CH2 3.76Å; V420-W1306 HydrophobicContact CG1-CZ2 3.58Å; V420-W1306 HydrophobicContact CG1-CZ3 3.78Å; V420-W1306 HydrophobicContact CG2-CB 4.26Å; V420-W1306 HydrophobicContact CG2-CD2 3.93Å; V420-W1306 HydrophobicContact CG2-CG 3.69Å
421	H	69.9	Low	82.8	Confident	62 Å²	62	52.2 Å²	52.2	29%	0.287	32%	0.317	S	S	.	.			trans	-111.9	126.3	169.7	-66	-93.3	0	0	0	110	S416 W1306	S416-H421 WeakPolarHBondContact CB-O 3.44Å; S416-H421 PolarHBondContact OG-O 2.66Å; H421-W1306 AromaticContact CD2-CH2 3.94Å; H421-W1306 AromaticContact CE1-CH2 3.51Å; H421-W1306 AromaticContact CE1-CZ3 3.7Å; H421-W1306 AromaticContact ND1-CZ3 3.98Å; H421-W1306 AromaticContact NE2-CH2 3.28Å; H421-W1306 VanDerWaalsContact NE2-CH2 3.28Å; H421-W1306 WeakPolarHBondContact NE2-CH2 3.07Å; H421-W1306 AromaticContact NE2-CZ3 3.79Å
422	F	78.2	Confident	82.3	Confident	34 Å²	34	53.4 Å²	53.4	15%	0.149	32%	0.322	C	S	.	.			trans	-108.3	4.5	167.6	-67.9	-91.8	0	0	0	112.4	L381 K414 G419 V455 Q457	L381-F422 HydrophobicContact CD2-CE1 4.45Å; L381-F422 HydrophobicContact CD2-CE2 4.27Å; L381-F422 HydrophobicContact CD2-CZ 3.73Å; K414-F422 HydrophobicContact CB-CB 4.29Å; K414-F422 HydrophobicContact CB-CD1 3.85Å; K414-F422 HydrophobicContact CB-CG 4.48Å; K414-F422 HydrophobicContact CD-CB 4.16Å; G419-F422 WeakPolarHBondContact O-CE2 3.13Å; F422-V455 HydrophobicContact CE1-CG1 4.38Å; F422-V455 HydrophobicContact CZ-CB 4.25Å; F422-V455 HydrophobicContact CZ-CG1 3.82Å; F422-Q457 HydrophobicContact CD1-CB 4.24Å; F422-Q457 HydrophobicContact CE1-CB 3.9Å; F422-Q457 HydrophobicContact CZ-CB 4.36Å
423	S	60.6	Low	81.6	Confident	91 Å²	91	60.9 Å²	60.9	64%	0.636	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-17.7	-167.5	-50.1	0	0	0	0	114.9	Q425	S423-Q425 PolarHBondContact O-N 3Å
424	G	64.9	Low	80.6	Confident	81 Å²	81	65.5 Å²	65.5	84%	0.835	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-1.6	-175.2	0	0	0	0	0	115.6
425	Q	71.2	Confident	79.3	Confident	82 Å²	82	67.6 Å²	67.6	38%	0.383	39%	0.389	S	S	.	.	S	Bend	trans	-141.9	138.1	-178.9	-71.5	-169.4	22.8	0	0	112.2	S423	S423-Q425 PolarHBondContact O-N 3Å
426	L	82.7	Confident	78.1	Confident	145 Å²	145	71.8 Å²	71.8	76%	0.759	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-62.5	130.7	173.2	-166.3	76.9	0	0	0	110.2	R451	L426-R451 VanDerWaalsContact O-CZ 3.25Å; L426-R451 PolarHBondContact O-NH1 3.23Å; L426-R451 PolarHBondContact O-NH2 2.82Å
427	P	87.7	Confident	76.8	Confident	38 Å²	38	78.2 Å²	78.2	25%	0.247	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-59.9	145.1	179.1	23.5	-33.9	0	0	0	112.1	V413 K414 S429	V413-P427 WeakPolarHBondContact O-CA 3.31Å; K414-P427 HydrophobicContact CG-CB 3.86Å; P427-S429 PolarHBondContact O-N 2.84Å
428	I	90.3	Very high	76.3	Confident	27 Å²	27	78.1 Å²	78.1	14%	0.138	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	119.1	163.3	-61.7	-178.5	0	0	0	106.7	E412 V413 F415 L448	E412-I428 CarbonylContact C-O 3.59Å; E412-I428 VanDerWaalsContact CA-O 3.31Å; E412-I428 WeakPolarHBondContact CA-O 3.28Å; V413-I428 HydrophobicContact CB-CB 4.37Å; V413-I428 PolarHBondContact N-O 3.32Å; V413-I428 PolarHBondContact O-N 2.86Å; F415-I428 HydrophobicContact CE2-CD1 4.25Å; I428-L448 HydrophobicContact CD1-CB 4.44Å; I428-L448 HydrophobicContact CD1-CD2 4.22Å; I428-L448 WeakPolarHBondContact CD1-O 2.9Å
429	S	91.4	Very high	77	Confident	60 Å²	60	78.7 Å²	78.7	42%	0.42	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	136.2	-177.6	-166.8	0	0	0	0	110.5	L411 E412 P427	L411-S429 CarbonylContact O-C 3.58Å; L411-S429 WeakPolarHBondContact O-CA 3.49Å; E412-S429 WeakPolarHBondContact CG-OG 3.49Å; E412-S429 PolarHBondContact OE1-OG 2.73Å; E412-S429 VanDerWaalsContact OE1-OG 3.11Å; P427-S429 PolarHBondContact O-N 2.84Å
430	R	91.7	Very high	77.8	Confident	57 Å²	57	77.1 Å²	77.1	22%	0.215	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	121.6	173.5	-171.5	173.7	-172.4	172	8	110.2	R410 L411 F432 I445 L446	R410-R430 CarbonylContact C-O 3.44Å; R410-R430 WeakPolarHBondContact CA-O 3.28Å; L411-R430 PolarHBondContact N-O 2.95Å; L411-R430 PolarHBondContact O-N 2.88Å; R430-F432 HydrophobicContact CB-CE2 4.19Å; R430-F432 HydrophobicContact CB-CZ 4.31Å; R430-F432 HydrophobicContact CG-CE1 4.36Å; R430-F432 HydrophobicContact CG-CE2 3.99Å; R430-F432 HydrophobicContact CG-CZ 3.81Å; R430-F432 WeakPolarHBondContact O-CE2 3.45Å; R430-I445 PolarHBondContact NH1-O 3.43Å; R430-L446 HydrophobicContact CB-CD2 3.99Å; R430-L446 HydrophobicContact CG-CD2 4.31Å
431	E	91	Very high	78.9	Confident	125 Å²	125	75.1 Å²	75.1	58%	0.584	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	149.2	170.6	-65.6	-155.7	130.5	0	0	111.8	R409 R410	R409-E431 IonicContact NH2-OE1 3.58Å; R409-E431 CarbonylContact O-C 3.57Å; R409-E431 WeakPolarHBondContact O-CA 3.42Å; R410-E431 HydrophobicContact CB-CG 4.4Å; R410-E431 HydrophobicContact CG-CG 4.33Å
432	F	86.1	Confident	79.9	Confident	26 Å²	26	73 Å²	73	11%	0.114	39%	0.388	C	S	.	.			trans	-121.8	128.2	179.2	-60.7	-92.4	0	0	0	110.1	P408 R409 L411 R430 I444	P408-F432 WeakPolarHBondContact O-CB 3.21Å; P408-F432 VanDerWaalsContact O-CD2 3.24Å; P408-F432 WeakPolarHBondContact O-CD2 3.49Å; R409-F432 PolarHBondContact O-N 3.27Å; L411-F432 HydrophobicContact CB-CE2 4.21Å; L411-F432 HydrophobicContact CD1-CE2 3.68Å; L411-F432 HydrophobicContact CD1-CZ 3.85Å; L411-F432 HydrophobicContact CG-CE2 3.82Å; L411-F432 HydrophobicContact CG-CZ 4.49Å; R430-F432 HydrophobicContact CB-CE2 4.19Å; R430-F432 HydrophobicContact CB-CZ 4.31Å; R430-F432 HydrophobicContact CG-CE1 4.36Å; R430-F432 HydrophobicContact CG-CE2 3.99Å; R430-F432 HydrophobicContact CG-CZ 3.81Å; R430-F432 WeakPolarHBondContact O-CE2 3.45Å; F432-I444 HydrophobicContact CD1-CD1 4.45Å; F432-I444 HydrophobicContact CE1-CD1 3.85Å; F432-I444 HydrophobicContact CE1-CG1 4.48Å; F432-I444 HydrophobicContact CE1-CG2 3.86Å; F432-I444 HydrophobicContact CZ-CD1 4.06Å; F432-I444 HydrophobicContact CZ-CG2 3.67Å
433	K	79.7	Confident	80.5	Confident	185 Å²	185	73.6 Å²	73.6	80%	0.804	40%	0.396	S	S	*	.			trans	-77.9	132.7	174.3	-67.2	174.4	-177.6	169.2	0	109.1	E435	K433-E435 PolarHBondContact O-N 2.81Å
434	L	73.4	Confident	82	Confident	97 Å²	97	69.8 Å²	69.8	51%	0.508	37%	0.369	S	S	.	.			trans	-72.6	89.6	-179.7	-66.8	91.4	0	0	0	110.9	A463	L434-A463 HydrophobicContact CD2-CB 4.21Å
435	E	66	Low	83.3	Confident	106 Å²	106	67.6 Å²	67.6	50%	0.495	34%	0.338	S	S	.	.			trans	-99.9	114.6	174.1	-65.3	-154.8	-178.2	0	0	112.3	K433 R437	K433-E435 PolarHBondContact O-N 2.81Å; E435-R437 HydrophobicContact CB-CG 4.47Å; E435-R437 PolarHBondContact O-N 2.85Å; E435-R437 IonicContact OE1-NH1 3.6Å; E435-R437 WeakPolarHBondContact OE2-CD 3.45Å; E435-R437 IonicContact OE2-CZ 3.54Å; E435-R437 IonicContact OE2-NE 3.8Å; E435-R437 IonicContact OE2-NH1 2.65Å; E435-R437 PolarHBondContact OE2-NH1 3Å
436	N	68.3	Low	84.4	Confident	96 Å²	96	64 Å²	64	51%	0.513	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	53.5	179	-57.3	-18.5	0	0	0	112.1	R406	R406-N436 PolarHBondContact NH1-OD1 3.48Å
437	R	63.6	Low	85	Confident	147 Å²	147	61.9 Å²	61.9	56%	0.555	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.3	-15.9	-167.2	-73.8	-172.6	173	143.5	-2.4	116.8	E435	E435-R437 HydrophobicContact CB-CG 4.47Å; E435-R437 PolarHBondContact O-N 2.85Å; E435-R437 IonicContact OE1-NH1 3.6Å; E435-R437 WeakPolarHBondContact OE2-CD 3.45Å; E435-R437 IonicContact OE2-CZ 3.54Å; E435-R437 IonicContact OE2-NE 3.8Å; E435-R437 IonicContact OE2-NH1 2.65Å; E435-R437 PolarHBondContact OE2-NH1 3Å
438	S	76.7	Confident	85.3	Confident	51 Å²	51	60.1 Å²	60.1	36%	0.357	30%	0.299	S	S	.	.			trans	-154.4	145.2	178.1	25.9	0	0	0	0	111.9	N399 F442	N399-S438 PolarHBondContact ND2-O 2.86Å; S438-F442 VanDerWaalsContact OG-CZ 3.32Å; S438-F442 WeakPolarHBondContact OG-CZ 3.43Å
439	L	86.3	Confident	85.4	Confident	64 Å²	64	62.3 Å²	62.3	34%	0.335	32%	0.317	S	S	.	.			trans	-101.8	169.3	173.1	-63.9	167.9	0	0	0	109.3	I338 Y401 L402	I338-L439 HydrophobicContact CD1-CB 4.05Å; Y401-L439 HydrophobicContact CD1-CD2 3.5Å; Y401-L439 HydrophobicContact CD1-CG 4.37Å; Y401-L439 HydrophobicContact CE1-CD2 3.4Å; Y401-L439 VanDerWaalsContact CE1-CD2 3.4Å; Y401-L439 HydrophobicContact CE1-CG 3.84Å; Y401-L439 HydrophobicContact CG-CD2 4.21Å; L402-L439 HydrophobicContact CD1-CD1 3.91Å; L402-L439 HydrophobicContact CD1-CD2 4.44Å; L402-L439 HydrophobicContact CG-CD2 4.24Å
440	G	88.3	Confident	85.4	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.01	32%	0.321	C	S	.	.	S	Bend	trans	102	-159.9	178.3	0	0	0	0	0	113.8	R335 N399 F442	R335-G440 CarbonylContact O-C 3.53Å; R335-G440 VanDerWaalsContact O-CA 3.29Å; R335-G440 WeakPolarHBondContact O-CA 3.3Å; N399-G440 PolarHBondContact N-O 2.85Å; G440-F442 WeakPolarHBondContact O-CD2 3.37Å
441	V	90.2	Very high	85.4	Confident	3 Å²	3	64.4 Å²	64.4	2%	0.018	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	138.7	-178.1	-172.3	0	0	0	0	110.9	A333 N334 R335 T337 F359	A333-V441 HydrophobicContact CB-CG2 3.98Å; N334-V441 VanDerWaalsContact O-CG2 3.3Å; N334-V441 WeakPolarHBondContact O-CG2 3.38Å; R335-V441 PolarHBondContact O-N 2.96Å; T337-V441 WeakPolarHBondContact O-CG2 3.25Å; F359-V441 HydrophobicContact CE1-CG2 3.83Å; F359-V441 HydrophobicContact CZ-CG2 3.75Å
442	F	90.6	Very high	85.4	Confident	17 Å²	17	61.6 Å²	61.6	8%	0.075	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127.8	-174.9	-71.6	-108.1	0	0	0	110.4	F79 Y396 I397 N399 L407 S438 G440	F79-F442 HydrophobicContact CD1-CD1 4.25Å; F79-F442 HydrophobicContact CD1-CE1 4.47Å; F79-F442 AromaticContact CE1-CD1 3.73Å; F79-F442 HydrophobicContact CE1-CD1 3.73Å; F79-F442 AromaticContact CE1-CE1 3.77Å; F79-F442 HydrophobicContact CE1-CE1 3.77Å; F79-F442 HydrophobicContact CZ-CE1 4.47Å; Y396-F442 WeakPolarHBondContact CA-O 3.49Å; I397-F442 PolarHBondContact N-O 3.31Å; I397-F442 PolarHBondContact O-N 3.3Å; N399-F442 HydrophobicContact CB-CD2 3.79Å; N399-F442 HydrophobicContact CB-CE2 3.52Å; N399-F442 HydrophobicContact CB-CZ 4.31Å; L407-F442 HydrophobicContact CD1-CB 4.46Å; L407-F442 HydrophobicContact CD1-CD1 4.19Å; L407-F442 HydrophobicContact CD1-CG 4.18Å; L407-F442 HydrophobicContact CD2-CB 3.97Å; L407-F442 HydrophobicContact CD2-CD2 4.19Å; L407-F442 HydrophobicContact CD2-CG 4.13Å; S438-F442 VanDerWaalsContact OG-CZ 3.32Å; S438-F442 WeakPolarHBondContact OG-CZ 3.43Å; G440-F442 WeakPolarHBondContact O-CD2 3.37Å
443	S	90.2	Very high	85.6	Confident	46 Å²	46	60.3 Å²	60.3	32%	0.322	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	116.2	165.5	-167	0	0	0	0	109.4	L395	L395-S443 CarbonylContact O-C 3.52Å; L395-S443 WeakPolarHBondContact O-CA 3.2Å
444	I	91.3	Very high	86.3	Confident	12 Å²	12	54 Å²	54	6%	0.062	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	120.5	172.8	-61.1	-177.2	0	0	0	107.7	R394 L395 I397 L407 L411 F432 L446	R394-I444 CarbonylContact C-O 3.52Å; R394-I444 WeakPolarHBondContact CA-O 3.12Å; L395-I444 HydrophobicContact CB-CB 4.43Å; L395-I444 PolarHBondContact N-O 2.86Å; L395-I444 PolarHBondContact O-N 3.45Å; I397-I444 HydrophobicContact CD1-CD1 4.01Å; L407-I444 HydrophobicContact CD1-CD1 4.45Å; L407-I444 HydrophobicContact CD2-CD1 4.39Å; L411-I444 HydrophobicContact CD1-CG2 4.34Å; F432-I444 HydrophobicContact CD1-CD1 4.45Å; F432-I444 HydrophobicContact CE1-CD1 3.85Å; F432-I444 HydrophobicContact CE1-CG1 4.48Å; F432-I444 HydrophobicContact CE1-CG2 3.86Å; F432-I444 HydrophobicContact CZ-CD1 4.06Å; F432-I444 HydrophobicContact CZ-CG2 3.67Å; I444-L446 HydrophobicContact CG2-CD2 4.17Å
445	I	93.4	Very high	87.3	Confident	35 Å²	35	50.1 Å²	50.1	18%	0.179	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	123.8	175.1	-50.9	-176.7	0	0	0	108.9	I80 R392 L393 R394 R430	I80-I445 HydrophobicContact CD1-CD1 4.1Å; R392-I445 HydrophobicContact CB-CG2 4.26Å; L393-I445 WeakPolarHBondContact O-CA 3.45Å; R394-I445 HydrophobicContact CG-CG1 4.22Å; R430-I445 PolarHBondContact NH1-O 3.43Å
446	L	94.1	Very high	88.7	Confident	6 Å²	6	45 Å²	45	3%	0.031	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.9	169.2	-56.7	-176.3	0	0	0	109.3	R392 L393 L411 V413 R430 I444 L448	R392-L446 CarbonylContact C-O 3.52Å; R392-L446 VanDerWaalsContact CA-O 3.23Å; R392-L446 WeakPolarHBondContact CA-O 3.39Å; R392-L446 WeakPolarHBondContact CB-O 3.21Å; L393-L446 HydrophobicContact CB-CB 4.35Å; L393-L446 HydrophobicContact CD2-CD1 4.32Å; L393-L446 PolarHBondContact N-O 2.87Å; L393-L446 PolarHBondContact O-N 2.84Å; L411-L446 HydrophobicContact CB-CD1 4.26Å; L411-L446 HydrophobicContact CD1-CD1 4.05Å; L411-L446 HydrophobicContact CD1-CD2 4.42Å; V413-L446 HydrophobicContact CG2-CD1 3.89Å; R430-L446 HydrophobicContact CB-CD2 3.99Å; R430-L446 HydrophobicContact CG-CD2 4.31Å; I444-L446 HydrophobicContact CG2-CD2 4.17Å; L446-L448 HydrophobicContact CB-CD2 4.32Å
447	D	94.8	Very high	89.9	Confident	101 Å²	101	41.5 Å²	41.5	54%	0.54	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	129	164.3	-170.8	-59.4	0	0	0	108.3	S449	D447-S449 VanDerWaalsContact OD1-CA 3.23Å; D447-S449 WeakPolarHBondContact OD1-CA 3.4Å; D447-S449 PolarHBondContact OD1-N 2.79Å; D447-S449 PolarHBondContact OD1-OG 2.88Å; D447-S449 VanDerWaalsContact OD1-OG 3.06Å
448	L	94.3	Very high	91.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	4.5	179.4	-64	-169.4	0	0	0	113.4	F390 T391 L393 V413 F415 I428 L446 H450 R451	F390-L448 HydrophobicContact CB-CB 3.98Å; F390-L448 HydrophobicContact CB-CD1 3.74Å; F390-L448 HydrophobicContact CD1-CD1 4.45Å; F390-L448 HydrophobicContact CG-CD1 4.4Å; F390-L448 CarbonylContact O-C 3.49Å; F390-L448 WeakPolarHBondContact O-CB 3.27Å; T391-L448 PolarHBondContact O-N 3.29Å; L393-L448 HydrophobicContact CB-CD1 3.74Å; L393-L448 HydrophobicContact CB-CD2 4.06Å; L393-L448 HydrophobicContact CB-CG 3.99Å; V413-L448 HydrophobicContact CB-CD2 4.33Å; V413-L448 HydrophobicContact CG1-CD2 4.11Å; V413-L448 HydrophobicContact CG2-CD2 4.18Å; F415-L448 HydrophobicContact CE1-CD1 4.21Å; F415-L448 HydrophobicContact CZ-CB 4.11Å; F415-L448 HydrophobicContact CZ-CD1 3.91Å; F415-L448 HydrophobicContact CZ-CD2 4.08Å; F415-L448 HydrophobicContact CZ-CG 4.24Å; I428-L448 HydrophobicContact CD1-CB 4.44Å; I428-L448 HydrophobicContact CD1-CD2 4.22Å; I428-L448 WeakPolarHBondContact CD1-O 2.9Å; L446-L448 HydrophobicContact CB-CD2 4.32Å; L448-H450 VanDerWaalsContact C-N 3.26Å; L448-H450 PolarHBondContact O-N 2.93Å; L448-R451 WeakPolarHBondContact O-CB 3.19Å; L448-R451 WeakPolarHBondContact O-CG 3.47Å; L448-R451 PolarHBondContact O-N 2.99Å
449	S	91.9	Very high	92.3	Very high	73 Å²	73	34 Å²	34	51%	0.51	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	55.4	36.5	168.6	-48.6	0	0	0	0	114.3	D447 R451	D447-S449 VanDerWaalsContact OD1-CA 3.23Å; D447-S449 WeakPolarHBondContact OD1-CA 3.4Å; D447-S449 PolarHBondContact OD1-N 2.79Å; D447-S449 PolarHBondContact OD1-OG 2.88Å; D447-S449 VanDerWaalsContact OD1-OG 3.06Å; S449-R451 PolarHBondContact O-N 2.89Å
450	H	92	Very high	92.8	Very high	111 Å²	111	30.9 Å²	30.9	51%	0.514	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	55.3	32.9	178.9	-65.4	-67.4	0	0	0	114.7	N389 F390 T391 L448	N389-H450 VanDerWaalsContact OD1-C 3.31Å; N389-H450 WeakPolarHBondContact OD1-CA 3.25Å; N389-H450 VanDerWaalsContact OD1-CB 3.24Å; N389-H450 WeakPolarHBondContact OD1-CB 3.22Å; N389-H450 PolarHBondContact OD1-ND1 2.87Å; N389-H450 PolarHBondContact OD1-O 2.81Å; F390-H450 WeakPolarHBondContact O-CA 2.97Å; F390-H450 PolarHBondContact O-N 2.88Å; T391-H450 VanDerWaalsContact CG2-CE1 3.47Å; T391-H450 WeakPolarHBondContact CG2-CE1 3.48Å; T391-H450 PolarHBondContact OG1-CE1 2.98Å; T391-H450 VanDerWaalsContact OG1-CE1 3.26Å; T391-H450 PolarHBondContact OG1-ND1 3.28Å; L448-H450 VanDerWaalsContact C-N 3.26Å; L448-H450 PolarHBondContact O-N 2.93Å
451	R	91.2	Very high	93	Very high	51 Å²	51	32.4 Å²	32.4	19%	0.192	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	142.7	-178	-73.4	176.1	-176.6	-125.4	20.4	111.8	F390 F415 L426 L448 S449	F390-R451 WeakPolarHBondContact CD2-O 3.4Å; F390-R451 PolarHBondContact N-O 2.87Å; F390-R451 PolarHBondContact O-N 3.25Å; F415-R451 HydrophobicContact CD1-CB 4.29Å; F415-R451 HydrophobicContact CD2-CB 3.9Å; F415-R451 HydrophobicContact CD2-CG 4.41Å; F415-R451 HydrophobicContact CE1-CB 4.34Å; F415-R451 HydrophobicContact CE2-CB 3.96Å; F415-R451 VanDerWaalsContact CE2-CD 3.48Å; F415-R451 HydrophobicContact CE2-CG 4.38Å; F415-R451 HydrophobicContact CG-CB 4.09Å; F415-R451 HydrophobicContact CZ-CB 4.18Å; L426-R451 VanDerWaalsContact O-CZ 3.25Å; L426-R451 PolarHBondContact O-NH1 3.23Å; L426-R451 PolarHBondContact O-NH2 2.82Å; L448-R451 WeakPolarHBondContact O-CB 3.19Å; L448-R451 WeakPolarHBondContact O-CG 3.47Å; L448-R451 PolarHBondContact O-N 2.99Å; S449-R451 PolarHBondContact O-N 2.89Å
452	I	90.9	Very high	93.1	Very high	65 Å²	65	32.7 Å²	32.7	33%	0.333	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	134.4	-177.8	-61.3	178.1	0	0	0	110.5	V387 R388 V479 I483	V387-I452 HydrophobicContact CG1-CG2 3.51Å; R388-I452 VanDerWaalsContact O-CA 3.28Å; R388-I452 WeakPolarHBondContact O-CA 3.36Å; I452-V479 HydrophobicContact CG2-CG2 4.23Å; I452-I483 HydrophobicContact CG2-CD1 3.89Å
453	G	91.3	Very high	93.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.2	170	174.3	0	0	0	0	0	113.4	V387 R388 F390 S416	V387-G453 WeakPolarHBondContact CA-O 3.08Å; R388-G453 PolarHBondContact N-O 3.15Å; R388-G453 PolarHBondContact O-N 2.65Å; F390-G453 WeakPolarHBondContact CE2-O 3.47Å; S416-G453 WeakPolarHBondContact O-CA 3.43Å
454	Q	92.9	Very high	93.2	Very high	51 Å²	51	32.4 Å²	32.4	24%	0.238	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	-20.4	167.7	-171.8	174.3	7.2	0	0	111.8	F384 V387 S416 V417	F384-Q454 WeakPolarHBondContact CD2-O 3.45Å; F384-Q454 PolarHBondContact N-O 3.39Å; F384-Q454 WeakPolarHBondContact O-CG 3.26Å; F384-Q454 PolarHBondContact O-NE2 2.63Å; V387-Q454 HydrophobicContact CG2-CB 4.35Å; S416-Q454 PolarHBondContact O-N 2.85Å; V417-Q454 WeakPolarHBondContact O-CB 3.46Å; V417-Q454 PolarHBondContact O-OE1 2.84Å
455	V	94.5	Very high	93	Very high	16 Å²	16	33.3 Å²	33.3	10%	0.097	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	132.2	175.8	-172.6	0	0	0	0	109.3	L381 F382 R383 F415 S416 F422	L381-V455 HydrophobicContact CD2-CG1 4.25Å; F382-V455 CarbonylContact O-C 3.45Å; F382-V455 VanDerWaalsContact O-CA 3.26Å; F382-V455 WeakPolarHBondContact O-CA 3.26Å; F382-V455 WeakPolarHBondContact O-CG1 3.33Å; R383-V455 HydrophobicContact CB-CG2 4.31Å; R383-V455 HydrophobicContact CG-CG2 4.19Å; F415-V455 WeakPolarHBondContact CA-O 3.32Å; S416-V455 PolarHBondContact N-O 2.88Å; S416-V455 PolarHBondContact O-N 2.96Å; F422-V455 HydrophobicContact CE1-CG1 4.38Å; F422-V455 HydrophobicContact CZ-CB 4.25Å; F422-V455 HydrophobicContact CZ-CG1 3.82Å
456	V	95.1	Very high	92.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	129.6	177.9	-175.4	0	0	0	0	109.1	L381 F382 F384 F390 V413 K414 F415 F474	L381-V456 WeakPolarHBondContact CA-O 3.16Å; F382-V456 HydrophobicContact CB-CB 4.46Å; F382-V456 PolarHBondContact N-O 3.5Å; F382-V456 PolarHBondContact O-N 3.12Å; F384-V456 HydrophobicContact CD2-CG2 4.37Å; F384-V456 HydrophobicContact CE2-CB 4.23Å; F384-V456 HydrophobicContact CE2-CG2 3.71Å; F390-V456 HydrophobicContact CD1-CG2 4.39Å; F390-V456 HydrophobicContact CD2-CG2 4.27Å; F390-V456 HydrophobicContact CE1-CG2 3.91Å; F390-V456 HydrophobicContact CE2-CG2 3.75Å; F390-V456 HydrophobicContact CZ-CG2 3.56Å; V413-V456 HydrophobicContact CG1-CG1 3.53Å; K414-V456 WeakPolarHBondContact O-CA 3.27Å; F415-V456 HydrophobicContact CD1-CG1 4.45Å; F415-V456 HydrophobicContact CD1-CG2 3.8Å; F415-V456 HydrophobicContact CE1-CG1 4.11Å; F415-V456 HydrophobicContact CE1-CG2 3.81Å; V456-F474 HydrophobicContact CB-CE1 4.35Å; V456-F474 HydrophobicContact CG1-CE1 4.08Å
457	Q	95.1	Very high	92.9	Very high	22 Å²	22	32 Å²	32	10%	0.103	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	126	171.3	-174.7	176.6	40.9	0	0	109.2	D379 M380 L381 V413 K414 F422 K459	D379-Q457 VanDerWaalsContact CG-NE2 3.35Å; D379-Q457 VanDerWaalsContact OD1-CG 3.29Å; D379-Q457 WeakPolarHBondContact OD1-CG 3.22Å; D379-Q457 PolarHBondContact OD1-NE2 2.68Å; D379-Q457 PolarHBondContact OD2-NE2 2.82Å; M380-Q457 CarbonylContact O-C 3.58Å; M380-Q457 WeakPolarHBondContact O-CA 3.23Å; L381-Q457 HydrophobicContact CD2-CB 3.68Å; L381-Q457 HydrophobicContact CD2-CG 3.87Å; V413-Q457 CarbonylContact C-O 3.59Å; V413-Q457 VanDerWaalsContact CA-O 3.28Å; V413-Q457 WeakPolarHBondContact CA-O 3.17Å; K414-Q457 HydrophobicContact CB-CB 4.28Å; K414-Q457 PolarHBondContact N-O 3.26Å; K414-Q457 PolarHBondContact O-N 2.9Å; F422-Q457 HydrophobicContact CD1-CB 4.24Å; F422-Q457 HydrophobicContact CE1-CB 3.9Å; F422-Q457 HydrophobicContact CZ-CB 4.36Å; Q457-K459 HydrophobicContact CG-CG 4.48Å; Q457-K459 VanDerWaalsContact NE2-CE 3.32Å
458	L	96	Very high	92.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.7	174.1	177.1	66.3	0	0	0	109.4	M380 F382 L393 L395 L411 E412 V413 I472	M380-L458 HydrophobicContact CB-CB 4.33Å; M380-L458 PolarHBondContact N-O 3.43Å; M380-L458 PolarHBondContact O-N 3.22Å; M380-L458 HydrophobicContact SD-CD2 4.16Å; F382-L458 HydrophobicContact CE2-CB 4.01Å; F382-L458 HydrophobicContact CE2-CD2 4.3Å; L393-L458 HydrophobicContact CD2-CD1 4.05Å; L393-L458 HydrophobicContact CD2-CD2 4.39Å; L395-L458 HydrophobicContact CD1-CD2 4.43Å; L395-L458 HydrophobicContact CD2-CD2 3.96Å; L411-L458 HydrophobicContact CD2-CD1 4.24Å; E412-L458 WeakPolarHBondContact O-CA 3.48Å; V413-L458 HydrophobicContact CG2-CD1 3.92Å; L458-I472 HydrophobicContact CD2-CD1 4.45Å
459	K	94.8	Very high	92.9	Very high	39 Å²	39	27.1 Å²	27.1	17%	0.17	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	119.5	175.7	-78.9	176.2	178.8	-74	0	110.3	V377 V378 D379 L411 E412 Q457 F461	V377-K459 HydrophobicContact CG2-CB 3.75Å; V377-K459 HydrophobicContact CG2-CG 4.1Å; V378-K459 WeakPolarHBondContact O-CA 3.1Å; D379-K459 HydrophobicContact CB-CG 4.41Å; D379-K459 WeakPolarHBondContact OD1-CG 3.35Å; D379-K459 IonicContact OD1-NZ 3.8Å; D379-K459 PolarHBondContact OD1-NZ 2.78Å; D379-K459 WeakPolarHBondContact OD2-CE 3.48Å; D379-K459 IonicContact OD2-NZ 3.92Å; D379-K459 PolarHBondContact OD2-NZ 3.2Å; L411-K459 CarbonylContact C-O 3.58Å; L411-K459 WeakPolarHBondContact CA-O 3.39Å; E412-K459 HydrophobicContact CB-CB 4.27Å; E412-K459 PolarHBondContact N-O 2.68Å; E412-K459 PolarHBondContact O-N 3.16Å; Q457-K459 HydrophobicContact CG-CG 4.48Å; Q457-K459 VanDerWaalsContact NE2-CE 3.32Å; K459-F461 HydrophobicContact CB-CE2 3.88Å; K459-F461 HydrophobicContact CB-CZ 4.28Å
460	A	95.5	Very high	92.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	111.9	179.8	0	0	0	0	0	111.4	V377 V378 P408 L411 L467 F469	V377-A460 WeakPolarHBondContact CA-O 3.4Å; V378-A460 PolarHBondContact N-O 3.47Å; V378-A460 PolarHBondContact O-N 3.39Å; P408-A460 HydrophobicContact CB-CB 4.26Å; L411-A460 HydrophobicContact CD2-CB 3.7Å; A460-L467 HydrophobicContact CB-CD2 3.88Å; A460-F469 HydrophobicContact CB-CE2 4.44Å; A460-F469 HydrophobicContact CB-CZ 4.19Å
461	F	93.5	Very high	93	Very high	33 Å²	33	18.5 Å²	18.5	15%	0.145	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	127.9	-174.2	-65.1	-92.3	0	0	0	111.2	V377 P408 R409 R410 E412 K459 A463	V377-F461 HydrophobicContact CB-CD1 3.72Å; V377-F461 HydrophobicContact CB-CE1 3.71Å; V377-F461 HydrophobicContact CB-CG 4.33Å; V377-F461 HydrophobicContact CB-CZ 4.32Å; V377-F461 HydrophobicContact CG1-CE1 4.36Å; V377-F461 HydrophobicContact CG2-CD1 3.77Å; V377-F461 HydrophobicContact CG2-CD2 4.09Å; V377-F461 HydrophobicContact CG2-CE1 3.63Å; V377-F461 HydrophobicContact CG2-CE2 3.97Å; V377-F461 HydrophobicContact CG2-CG 3.99Å; V377-F461 HydrophobicContact CG2-CZ 3.74Å; P408-F461 CarbonylContact C-O 3.04Å; P408-F461 WeakPolarHBondContact CA-O 3.27Å; P408-F461 WeakPolarHBondContact CB-O 3.33Å; R409-F461 PolarHBondContact N-O 2.99Å; R410-F461 HydrophobicContact CB-CB 4.13Å; R410-F461 HydrophobicContact CB-CD2 3.81Å; R410-F461 HydrophobicContact CB-CG 4.22Å; R410-F461 HydrophobicContact CG-CD2 3.96Å; R410-F461 HydrophobicContact CG-CE2 4.36Å; R410-F461 VanDerWaalsContact NE-CE2 3.31Å; R410-F461 WeakPolarHBondContact O-CD2 3.49Å; R410-F461 PolarHBondContact O-N 2.81Å; E412-F461 HydrophobicContact CB-CE2 4.37Å; E412-F461 HydrophobicContact CG-CE2 3.92Å; K459-F461 HydrophobicContact CB-CE2 3.88Å; K459-F461 HydrophobicContact CB-CZ 4.28Å; F461-A463 PolarHBondContact O-N 2.97Å
462	F	92.6	Very high	93.2	Very high	9 Å²	9	16.1 Å²	16.1	4%	0.039	8%	0.082	C	C	.	.			trans	-64.7	127.4	-173	-76.4	-91.7	0	0	0	113	W362 R364 W367 D376 V378 L467	W362-F462 HydrophobicContact CB-CE1 4.33Å; W362-F462 HydrophobicContact CB-CZ 3.83Å; W362-F462 WeakPolarHBondContact O-CE1 3.5Å; R364-F462 HydrophobicContact CB-CD1 4.17Å; R364-F462 HydrophobicContact CB-CE1 4.4Å; R364-F462 HydrophobicContact CB-CG 4.29Å; R364-F462 HydrophobicContact CG-CB 4.42Å; R364-F462 HydrophobicContact CG-CD2 4.42Å; R364-F462 HydrophobicContact CG-CG 4.29Å; R364-F462 VanDerWaalsContact NH2-CB 3.31Å; R364-F462 PolarHBondContact NH2-O 2.72Å; W367-F462 HydrophobicContact CD2-CE2 4.49Å; W367-F462 AromaticContact CE3-CE2 3.78Å; W367-F462 HydrophobicContact CE3-CE2 3.78Å; W367-F462 HydrophobicContact CE3-CZ 4.03Å; W367-F462 HydrophobicContact CH2-CE2 4.17Å; W367-F462 HydrophobicContact CH2-CZ 4.09Å; W367-F462 AromaticContact CZ3-CE2 3.62Å; W367-F462 HydrophobicContact CZ3-CE2 3.62Å; W367-F462 AromaticContact CZ3-CZ 3.48Å; W367-F462 HydrophobicContact CZ3-CZ 3.48Å; W367-F462 VanDerWaalsContact CZ3-CZ 3.48Å; D376-F462 PolarHBondContact O-N 3.45Å; V378-F462 HydrophobicContact CG2-CD2 4.48Å; V378-F462 HydrophobicContact CG2-CE2 3.51Å; V378-F462 HydrophobicContact CG2-CZ 3.52Å; F462-L467 HydrophobicContact CD1-CB 3.8Å; F462-L467 HydrophobicContact CE1-CB 3.54Å; F462-L467 HydrophobicContact CE1-CD2 4.42Å; F462-L467 HydrophobicContact CZ-CB 4.34Å
463	A	91.3	Very high	93.3	Very high	22 Å²	22	15.4 Å²	15.4	18%	0.182	8%	0.075	C	C	.	.	S	Bend	trans	-87.3	-27.4	172.4	0	0	0	0	0	114	R406 L407 R409 L434 F461	R406-A463 HydrophobicContact CB-CB 4Å; L407-A463 WeakPolarHBondContact O-CB 3.2Å; R409-A463 HydrophobicContact CB-CB 4.04Å; L434-A463 HydrophobicContact CD2-CB 4.21Å; F461-A463 PolarHBondContact O-N 2.97Å
464	D	90	Very high	93.4	Very high	35 Å²	35	15.5 Å²	15.5	19%	0.187	8%	0.076	C	C	.	.	S	Bend	trans	-145.6	-160.1	-177.5	-149.5	-37.5	0	0	0	108.4	R364 K404 R406	R364-D464 VanDerWaalsContact CZ-O 3.31Å; R364-D464 PolarHBondContact NE-O 2.78Å; R364-D464 VanDerWaalsContact NH2-N 3.19Å; R364-D464 PolarHBondContact NH2-O 3.33Å; K404-D464 WeakPolarHBondContact CB-OD1 3.38Å; K404-D464 WeakPolarHBondContact O-CB 3.29Å; R406-D464 HydrophobicContact CB-CB 4.01Å; R406-D464 HydrophobicContact CG-CB 3.67Å; R406-D464 IonicContact CZ-OD2 3.93Å; R406-D464 IonicContact NE-OD2 2.76Å; R406-D464 PolarHBondContact NE-OD2 2.92Å; R406-D464 IonicContact NH2-OD2 3.53Å
465	D	89	Confident	93.4	Very high	31 Å²	31	15.4 Å²	15.4	17%	0.166	8%	0.075	C	C	.	.	S	Bend	trans	-72.7	-31.3	-179.4	-79.9	-29.2	0	0	0	114.4	H363 R364 K368 K404	H363-D465 PolarHBondContact CD2-O 2.99Å; R364-D465 PolarHBondContact N-O 2.95Å; K368-D465 IonicContact NZ-OD1 3.77Å; K404-D465 HydrophobicContact CB-CB 4.12Å; K404-D465 HydrophobicContact CD-CB 3.8Å; K404-D465 WeakPolarHBondContact CD-OD2 3.29Å; K404-D465 WeakPolarHBondContact CE-OD2 3.5Å; K404-D465 IonicContact NZ-OD2 2.63Å; K404-D465 PolarHBondContact NZ-OD2 3.1Å
466	W	90.9	Very high	93.4	Very high	11 Å²	11	15.6 Å²	15.6	4%	0.042	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	146.3	-176.9	-78.8	94.5	0	0	0	114.4	S267 L268 A269 F304 I341 W362 H363 K404 I405 R406 L468	S267-W466 WeakPolarHBondContact O-CH2 3.43Å; L268-W466 WeakPolarHBondContact O-CH2 3.1Å; A269-W466 WeakPolarHBondContact O-CZ2 3.48Å; F304-W466 HydrophobicContact CD2-CH2 4.2Å; F304-W466 AromaticContact CD2-CZ3 3.92Å; F304-W466 HydrophobicContact CD2-CZ3 3.92Å; I341-W466 HydrophobicContact CD1-CB 4.25Å; I341-W466 HydrophobicContact CD1-CD2 3.97Å; I341-W466 HydrophobicContact CD1-CG 3.61Å; I341-W466 HydrophobicContact CG1-CD2 4.3Å; I341-W466 HydrophobicContact CG1-CG 4.43Å; I341-W466 HydrophobicContact CG2-CZ2 4.46Å; W362-W466 VanDerWaalsContact O-CE3 3.22Å; H363-W466 HydrophobicContact CB-CD2 4.1Å; H363-W466 HydrophobicContact CB-CE3 4.15Å; H363-W466 HydrophobicContact CB-CH2 3.81Å; H363-W466 HydrophobicContact CB-CZ2 3.75Å; H363-W466 HydrophobicContact CB-CZ3 4.02Å; H363-W466 AromaticContact CD2-CD1 3.5Å; H363-W466 VanDerWaalsContact CD2-CD1 3.5Å; H363-W466 AromaticContact CD2-CD2 3.81Å; H363-W466 AromaticContact CD2-CE2 3.38Å; H363-W466 AromaticContact CD2-CG 3.88Å; H363-W466 AromaticContact CD2-CZ2 3.93Å; H363-W466 AromaticContact CD2-NE1 3.17Å; H363-W466 PolarHBondContact CD2-NE1 2.88Å; H363-W466 AromaticContact CG-CE2 3.83Å; H363-W466 AromaticContact CG-CZ2 3.93Å; H363-W466 AromaticContact NE2-NE1 3.69Å; K404-W466 PolarHBondContact O-N 2.76Å; I405-W466 HydrophobicContact CB-CB 4.33Å; I405-W466 HydrophobicContact CG1-CB 3.69Å; I405-W466 HydrophobicContact CG1-CG 4.35Å; R406-W466 PolarHBondContact N-O 3.06Å; R406-W466 VanDerWaalsContact N-O 3.09Å; W466-L468 HydrophobicContact CE3-CD2 3.92Å; W466-L468 HydrophobicContact CZ3-CD2 4.4Å
467	L	93.3	Very high	93.2	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	119.7	175.6	-179.5	64.1	0	0	0	109.1	G361 W362 V378 I397 R406 P408 A460 F462 F469	G361-L467 WeakPolarHBondContact CA-O 3.36Å; W362-L467 PolarHBondContact N-O 3.01Å; W362-L467 PolarHBondContact O-N 3.07Å; V378-L467 HydrophobicContact CG2-CD2 3.85Å; I397-L467 HydrophobicContact CG2-CD1 4.21Å; R406-L467 WeakPolarHBondContact O-CD1 3.13Å; P408-L467 HydrophobicContact CB-CD1 4.09Å; P408-L467 HydrophobicContact CG-CD1 4.33Å; A460-L467 HydrophobicContact CB-CD2 3.88Å; F462-L467 HydrophobicContact CD1-CB 3.8Å; F462-L467 HydrophobicContact CE1-CB 3.54Å; F462-L467 HydrophobicContact CE1-CD2 4.42Å; F462-L467 HydrophobicContact CZ-CB 4.34Å; L467-F469 HydrophobicContact CD1-CD2 4.47Å; L467-F469 HydrophobicContact CD1-CE2 3.88Å; L467-F469 HydrophobicContact CD2-CE2 3.98Å; L467-F469 HydrophobicContact CG-CD2 4.24Å; L467-F469 HydrophobicContact CG-CE2 3.78Å
468	L	94	Very high	93	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	128.1	-176	-54.3	-177.2	0	0	0	111	F304 P339 F359 G361 I397 S398 I405 W466	F304-L468 HydrophobicContact CB-CD2 4.44Å; F304-L468 HydrophobicContact CD1-CD1 4.28Å; F304-L468 HydrophobicContact CD1-CD2 3.92Å; F304-L468 HydrophobicContact CD2-CD2 4.2Å; F304-L468 HydrophobicContact CE1-CD1 3.8Å; F304-L468 HydrophobicContact CE1-CD2 4.2Å; F304-L468 HydrophobicContact CE2-CD2 4.46Å; F304-L468 HydrophobicContact CG-CD2 3.93Å; F304-L468 HydrophobicContact CZ-CD1 4.03Å; F304-L468 HydrophobicContact CZ-CD2 4.47Å; P339-L468 HydrophobicContact CB-CD1 3.9Å; P339-L468 HydrophobicContact CG-CD1 3.51Å; F359-L468 HydrophobicContact CB-CB 4.42Å; F359-L468 HydrophobicContact CD1-CB 4.25Å; G361-L468 VanDerWaalsContact CA-CD2 3.44Å; I397-L468 WeakPolarHBondContact CA-O 3.35Å; I397-L468 VanDerWaalsContact CG2-O 3.27Å; I397-L468 WeakPolarHBondContact CG2-O 3.24Å; S398-L468 PolarHBondContact N-O 2.8Å; I405-L468 HydrophobicContact CD1-CD1 3.56Å; I405-L468 HydrophobicContact CD1-CG 4.42Å; I405-L468 HydrophobicContact CG1-CD1 3.89Å; I405-L468 HydrophobicContact CG1-CG 4.21Å; I405-L468 HydrophobicContact CG2-CB 4.28Å; I405-L468 HydrophobicContact CG2-CD1 3.88Å; I405-L468 HydrophobicContact CG2-CG 3.86Å; W466-L468 HydrophobicContact CE3-CD2 3.92Å; W466-L468 HydrophobicContact CZ3-CD2 4.4Å
469	F	95.2	Very high	92.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	146.6	174.5	-76.1	-118.3	0	0	0	109.8	L327 F359 V360 W362 M380 L395 Y396 I397 A460 L467 I472	L327-F469 HydrophobicContact CD2-CB 3.67Å; F359-F469 CarbonylContact C-O 3.54Å; F359-F469 WeakPolarHBondContact CA-O 3.29Å; V360-F469 PolarHBondContact N-O 3.2Å; V360-F469 PolarHBondContact O-N 2.68Å; W362-F469 HydrophobicContact CZ3-CB 4.47Å; W362-F469 AromaticContact CZ3-CD2 3.76Å; W362-F469 HydrophobicContact CZ3-CD2 3.76Å; W362-F469 HydrophobicContact CZ3-CE2 4.35Å; W362-F469 HydrophobicContact CZ3-CG 4.39Å; M380-F469 HydrophobicContact CE-CE2 4.21Å; M380-F469 HydrophobicContact CE-CZ 4.34Å; L395-F469 HydrophobicContact CB-CE1 4.21Å; L395-F469 HydrophobicContact CD1-CE1 4.2Å; L395-F469 HydrophobicContact CD2-CE1 4.13Å; L395-F469 HydrophobicContact CG-CE1 4.42Å; Y396-F469 CarbonylContact O-C 3.58Å; Y396-F469 WeakPolarHBondContact O-CA 3.25Å; I397-F469 HydrophobicContact CD1-CD1 4.11Å; I397-F469 HydrophobicContact CD1-CE1 3.53Å; I397-F469 HydrophobicContact CD1-CE2 4.03Å; I397-F469 HydrophobicContact CD1-CZ 3.49Å; I397-F469 VanDerWaalsContact CD1-CZ 3.49Å; I397-F469 HydrophobicContact CG1-CD1 3.82Å; I397-F469 HydrophobicContact CG1-CD2 4.43Å; I397-F469 HydrophobicContact CG1-CE1 3.78Å; I397-F469 HydrophobicContact CG1-CE2 4.4Å; I397-F469 HydrophobicContact CG1-CG 4.17Å; I397-F469 HydrophobicContact CG1-CZ 4.09Å; A460-F469 HydrophobicContact CB-CE2 4.44Å; A460-F469 HydrophobicContact CB-CZ 4.19Å; L467-F469 HydrophobicContact CD1-CD2 4.47Å; L467-F469 HydrophobicContact CD1-CE2 3.88Å; L467-F469 HydrophobicContact CD2-CE2 3.98Å; L467-F469 HydrophobicContact CG-CD2 4.24Å; L467-F469 HydrophobicContact CG-CE2 3.78Å; F469-I472 HydrophobicContact CD1-CD1 3.84Å; F469-I472 HydrophobicContact CD1-CG1 3.89Å; F469-I472 HydrophobicContact CE1-CD1 4.16Å; F469-I472 HydrophobicContact CE1-CG1 4.42Å
470	S	93.1	Very high	92.1	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.007	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	-21.7	172.3	58.6	0	0	0	0	114.4	A333 Q358 Y396	A333-S470 PolarHBondContact N-OG 3.22Å; Q358-S470 WeakPolarHBondContact O-CA 3.31Å; Q358-S470 WeakPolarHBondContact O-CB 3.45Å; Y396-S470 WeakPolarHBondContact CB-OG 3.47Å; Y396-S470 PolarHBondContact O-N 2.78Å
471	E	93.5	Very high	91.2	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.009	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	149.3	178.7	-178.6	113.7	176.5	0	0	110.9	L327 L330 N331 S332 Y396 R473	L327-E471 CarbonylContact O-C 3.55Å; L327-E471 VanDerWaalsContact O-CA 3.28Å; L327-E471 WeakPolarHBondContact O-CA 3.28Å; L330-E471 WeakPolarHBondContact CA-OE2 3.49Å; L330-E471 PolarHBondContact N-OE2 2.94Å; N331-E471 PolarHBondContact N-OE2 3.05Å; S332-E471 PolarHBondContact N-OE2 2.85Å; Y396-E471 HydrophobicContact CD2-CB 3.59Å; Y396-E471 HydrophobicContact CD2-CG 3.9Å; Y396-E471 HydrophobicContact CE2-CB 4.28Å; Y396-E471 HydrophobicContact CE2-CG 4.11Å; Y396-E471 HydrophobicContact CG-CB 4.12Å; Y396-E471 PolarHBondContact N-O 2.97Å; E471-R473 HydrophobicContact CG-CG 4.07Å; E471-R473 IonicContact OE1-CZ 2.74Å; E471-R473 IonicContact OE1-NE 3.6Å; E471-R473 PolarHBondContact OE1-NE 2.8Å; E471-R473 IonicContact OE1-NH2 2.69Å; E471-R473 PolarHBondContact OE1-NH2 2.78Å
472	I	95	Very high	90	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	129.5	178.4	-61.7	-175.3	0	0	0	108.6	L327 I328 M380 F382 L393 R394 L395 L458 F469 F474	L327-I472 HydrophobicContact CB-CG1 4.48Å; L327-I472 HydrophobicContact CD1-CD1 4.1Å; L327-I472 PolarHBondContact O-N 2.94Å; I328-I472 WeakPolarHBondContact CG2-O 3.29Å; M380-I472 HydrophobicContact SD-CD1 4.03Å; F382-I472 HydrophobicContact CE1-CD1 4.46Å; F382-I472 HydrophobicContact CE1-CG2 4.15Å; F382-I472 HydrophobicContact CZ-CD1 3.83Å; F382-I472 HydrophobicContact CZ-CG2 4.03Å; L393-I472 HydrophobicContact CD1-CG2 3.83Å; R394-I472 CarbonylContact O-C 3.5Å; R394-I472 WeakPolarHBondContact O-CA 3.41Å; L395-I472 HydrophobicContact CD2-CB 4.2Å; L395-I472 HydrophobicContact CD2-CD1 4.36Å; L395-I472 HydrophobicContact CD2-CG1 3.89Å; L395-I472 HydrophobicContact CD2-CG2 3.77Å; L458-I472 HydrophobicContact CD2-CD1 4.45Å; F469-I472 HydrophobicContact CD1-CD1 3.84Å; F469-I472 HydrophobicContact CD1-CG1 3.89Å; F469-I472 HydrophobicContact CE1-CD1 4.16Å; F469-I472 HydrophobicContact CE1-CG1 4.42Å; I472-F474 HydrophobicContact CG2-CD2 4.46Å; I472-F474 HydrophobicContact CG2-CE2 3.61Å; I472-F474 HydrophobicContact CG2-CZ 3.85Å
473	R	92.9	Very high	88.8	Confident	51 Å²	51	44.7 Å²	44.7	19%	0.192	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	148.3	-179.2	-61.8	-170.6	-178.4	-157.5	-3.9	114.3	D87 L393 R394 E471	D87-R473 IonicContact OD2-CZ 3.91Å; D87-R473 IonicContact OD2-NH1 2.71Å; D87-R473 PolarHBondContact OD2-NH1 3.01Å; D87-R473 IonicContact OD2-NH2 2.82Å; L393-R473 CarbonylContact C-O 3.58Å; L393-R473 WeakPolarHBondContact CA-O 3.37Å; L393-R473 VanDerWaalsContact CD1-O 3.24Å; L393-R473 WeakPolarHBondContact CD1-O 3.23Å; R394-R473 HydrophobicContact CB-CB 4.48Å; R394-R473 PolarHBondContact N-O 3.03Å; R394-R473 PolarHBondContact O-N 3.13Å; E471-R473 HydrophobicContact CG-CG 4.07Å; E471-R473 IonicContact OE1-CZ 2.74Å; E471-R473 IonicContact OE1-NE 3.6Å; E471-R473 PolarHBondContact OE1-NE 2.8Å; E471-R473 IonicContact OE1-NH2 2.69Å; E471-R473 PolarHBondContact OE1-NH2 2.78Å
474	F	94.3	Very high	87.2	Confident	1 Å²	1	52.8 Å²	52.8	0%	0.004	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	90	-170.6	-63.4	-92.5	0	0	0	113.1	D256 F382 F384 F390 R392 L393 V456 I472 S476	D256-F474 PolarHBondContact OD2-N 3.41Å; F382-F474 HydrophobicContact CB-CE2 4.46Å; F382-F474 HydrophobicContact CB-CZ 4.16Å; F382-F474 AromaticContact CD1-CE2 3.75Å; F382-F474 HydrophobicContact CD1-CE2 3.75Å; F382-F474 AromaticContact CD1-CZ 3.87Å; F382-F474 HydrophobicContact CD1-CZ 3.87Å; F382-F474 HydrophobicContact CD2-CE2 4.48Å; F382-F474 AromaticContact CD2-CZ 3.77Å; F382-F474 HydrophobicContact CD2-CZ 3.77Å; F382-F474 HydrophobicContact CE1-CE2 4.08Å; F382-F474 HydrophobicContact CE1-CZ 4.2Å; F382-F474 HydrophobicContact CE2-CZ 4.1Å; F382-F474 AromaticContact CG-CE2 3.98Å; F382-F474 HydrophobicContact CG-CE2 3.98Å; F382-F474 AromaticContact CG-CZ 3.65Å; F382-F474 HydrophobicContact CG-CZ 3.65Å; F382-F474 HydrophobicContact CZ-CZ 4.32Å; F384-F474 HydrophobicContact CE1-CB 4.18Å; F384-F474 HydrophobicContact CE1-CD2 4.22Å; F384-F474 HydrophobicContact CE1-CG 4.21Å; F384-F474 HydrophobicContact CZ-CB 4.08Å; F384-F474 AromaticContact CZ-CD1 3.97Å; F384-F474 HydrophobicContact CZ-CD1 3.97Å; F384-F474 AromaticContact CZ-CD2 3.73Å; F384-F474 HydrophobicContact CZ-CD2 3.73Å; F384-F474 HydrophobicContact CZ-CE1 4.31Å; F384-F474 HydrophobicContact CZ-CE2 4.07Å; F384-F474 AromaticContact CZ-CG 3.67Å; F384-F474 HydrophobicContact CZ-CG 3.67Å; F384-F474 HydrophobicContact CZ-CZ 4.35Å; F390-F474 HydrophobicContact CD1-CB 4.34Å; F390-F474 HydrophobicContact CD1-CD1 4.33Å; F390-F474 HydrophobicContact CE1-CB 4.29Å; F390-F474 HydrophobicContact CE1-CD1 4.33Å; R392-F474 CarbonylContact O-C 3.58Å; L393-F474 HydrophobicContact CD1-CD1 3.85Å; L393-F474 HydrophobicContact CD1-CD2 4.5Å; L393-F474 HydrophobicContact CD1-CE1 3.62Å; L393-F474 HydrophobicContact CD1-CE2 4.31Å; L393-F474 HydrophobicContact CD1-CG 4.28Å; L393-F474 HydrophobicContact CD1-CZ 3.88Å; L393-F474 HydrophobicContact CD2-CE1 4.12Å; L393-F474 HydrophobicContact CG-CE1 4.38Å; V456-F474 HydrophobicContact CB-CE1 4.35Å; V456-F474 HydrophobicContact CG1-CE1 4.08Å; I472-F474 HydrophobicContact CG2-CD2 4.46Å; I472-F474 HydrophobicContact CG2-CE2 3.61Å; I472-F474 HydrophobicContact CG2-CZ 3.85Å; F474-S476 PolarHBondContact O-N 2.81Å; F474-S476 PolarHBondContact O-OG 2.68Å
475	E	92.6	Very high	85.8	Confident	49 Å²	49	56.6 Å²	56.6	23%	0.229	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	107.5	171	-66.8	177.9	-155.6	0	0	109.7	T391 R392 R394	T391-E475 WeakPolarHBondContact CA-O 3Å; T391-E475 WeakPolarHBondContact CB-O 3.45Å; T391-E475 PolarHBondContact N-O 2.7Å; R392-E475 HydrophobicContact CB-CB 4Å; R392-E475 HydrophobicContact CB-CG 4.26Å; R392-E475 VanDerWaalsContact CD-OE2 3.27Å; R392-E475 WeakPolarHBondContact CD-OE2 3.17Å; R392-E475 WeakPolarHBondContact CG-OE2 3.27Å; R392-E475 IonicContact CZ-OE2 2.7Å; R392-E475 PolarHBondContact N-O 3.26Å; R392-E475 VanDerWaalsContact N-O 3.07Å; R392-E475 IonicContact NE-OE2 3.43Å; R392-E475 IonicContact NH1-OE1 3.64Å; R392-E475 IonicContact NH1-OE2 3.73Å; R392-E475 PolarHBondContact NH1-OE2 2.05Å; R392-E475 PolarHBondContact O-N 3.42Å; R394-E475 IonicContact CZ-OE1 3.7Å; R394-E475 IonicContact NE-OE1 2.85Å; R394-E475 PolarHBondContact NE-OE1 2.74Å; R394-E475 IonicContact NH2-OE1 3.28Å; R394-E475 PolarHBondContact NH2-OE1 2.87Å
476	S	93.3	Very high	83.9	Confident	20 Å²	20	60.8 Å²	60.8	14%	0.14	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	149.9	-169.9	56.2	0	0	0	0	112.9	R388 N389 F390 F474	R388-S476 PolarHBondContact NE-OG 3.22Å; R388-S476 PolarHBondContact NH2-O 3.19Å; N389-S476 CarbonylContact O-C 3.51Å; N389-S476 WeakPolarHBondContact O-CA 3.11Å; N389-S476 VanDerWaalsContact O-CB 3.29Å; N389-S476 WeakPolarHBondContact O-CB 3.47Å; F390-S476 VanDerWaalsContact CD1-CB 3.49Å; F474-S476 PolarHBondContact O-N 2.81Å; F474-S476 PolarHBondContact O-OG 2.68Å
477	E	92.2	Very high	81.8	Confident	137 Å²	137	66.9 Å²	66.9	64%	0.64	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	142.7	-179.5	-65.5	-178.9	178.2	0	0	111.1	R388 N389	R388-E477 CarbonylContact C-O 3.6Å; R388-E477 VanDerWaalsContact CA-O 3.24Å; R388-E477 WeakPolarHBondContact CA-O 3.35Å; R388-E477 WeakPolarHBondContact CB-O 3.38Å; N389-E477 PolarHBondContact N-O 3.49Å; N389-E477 PolarHBondContact O-N 3.43Å
478	K	90.7	Very high	79.2	Confident	120 Å²	120	73 Å²	73	52%	0.522	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	130.6	176.3	179.5	170.1	-178	166.8	0	110.8	S386 T480	S386-K478 WeakPolarHBondContact OG-CD 3.09Å; S386-K478 VanDerWaalsContact OG-CE 3.27Å; S386-K478 WeakPolarHBondContact OG-CE 3.38Å; K478-T480 PolarHBondContact O-N 2.84Å
479	V	89.2	Confident	76.9	Confident	31 Å²	31	76.6 Å²	76.6	19%	0.188	41%	0.407	C	S	.	.			trans	-73.6	119.6	176.3	-175.2	0	0	0	0	109.4	V387 N389 I452 I483	V387-V479 PolarHBondContact O-N 3.47Å; N389-V479 HydrophobicContact CB-CG2 4.3Å; I452-V479 HydrophobicContact CG2-CG2 4.23Å; V479-I483 HydrophobicContact CB-CD1 4.41Å; V479-I483 HydrophobicContact CG1-CD1 4.03Å; V479-I483 HydrophobicContact CG1-CG1 3.93Å
480	T	82.8	Confident	74.3	Confident	133 Å²	133	82.1 Å²	82.1	82%	0.816	43%	0.434	S	S	*	.			trans	-99.2	-16	-179.5	52.3	0	0	0	0	113.5	K478	K478-T480 PolarHBondContact O-N 2.84Å
481	T	76.8	Confident	71.9	Confident	98 Å²	98	87.1 Å²	87.1	60%	0.601	46%	0.46	S	S	*	.	S	Bend	trans	-82.6	142.4	176.1	46.9	0	0	0	0	111	I483	T481-I483 PolarHBondContact O-N 2.76Å
482	P	68.1	Low	69.4	Low	128 Å²	128	91.2 Å²	91.2	83%	0.831	49%	0.489	S	S	*	.			trans	-65.5	111.2	173.1	26.8	-33	0	0	0	109.4	K484	P482-K484 PolarHBondContact O-N 3.45Å
483	I	67.1	Low	67.1	Low	67 Å²	67	97.3 Å²	97.3	34%	0.344	52%	0.517	S	S	.	.			trans	-70.3	113.5	177.4	-58.2	170.4	0	0	0	107.7	V387 I452 V479 T481 I485	V387-I483 HydrophobicContact CB-CD1 4.14Å; V387-I483 HydrophobicContact CG1-CD1 3.63Å; V387-I483 HydrophobicContact CG2-CD1 4.5Å; I452-I483 HydrophobicContact CG2-CD1 3.89Å; V479-I483 HydrophobicContact CB-CD1 4.41Å; V479-I483 HydrophobicContact CG1-CD1 4.03Å; V479-I483 HydrophobicContact CG1-CG1 3.93Å; T481-I483 PolarHBondContact O-N 2.76Å; I483-I485 VanDerWaalsContact C-N 3.28Å; I483-I485 HydrophobicContact CG2-CG1 3.97Å; I483-I485 PolarHBondContact O-N 2.72Å
484	K	58.2	Low	64.5	Low	193 Å²	193	103.9 Å²	103.9	84%	0.839	55%	0.547	S	S	*	.			trans	-67.4	94.1	159	-73	-171	175.8	-172.9	0	107.8	P482 D486	P482-K484 PolarHBondContact O-N 3.45Å; K484-D486 PolarHBondContact O-N 2.98Å
485	I	59.2	Low	61.9	Low	114 Å²	114	108.8 Å²	108.8	59%	0.585	58%	0.582	S	S	*	*			trans	-69.8	111.7	163.4	-58.5	176	0	0	0	105	V417 I483 E487	V417-I485 HydrophobicContact CG1-CD1 4.23Å; I483-I485 VanDerWaalsContact C-N 3.28Å; I483-I485 HydrophobicContact CG2-CG1 3.97Å; I483-I485 PolarHBondContact O-N 2.72Å; I485-E487 VanDerWaalsContact C-N 3.33Å; I485-E487 PolarHBondContact O-N 2.78Å
486	D	48.5	Very low	59.2	Low	119 Å²	119	110.4 Å²	110.4	64%	0.636	60%	0.599	S	S	*	*			trans	-66.5	96.1	173.7	-82.9	-35.2	0	0	0	108.7	K484 L488 A489	K484-D486 PolarHBondContact O-N 2.98Å; D486-L488 PolarHBondContact O-N 3.42Å; D486-A489 VanDerWaalsContact O-CB 3.3Å; D486-A489 WeakPolarHBondContact O-CB 3.25Å; D486-A489 PolarHBondContact O-N 3.42Å
487	E	47	Very low	56.4	Low	140 Å²	140	116.2 Å²	116.2	65%	0.654	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	-22.2	-177.2	-165.6	172.8	-163.4	0	0	112.5	I485 A489 M490 L491	I485-E487 VanDerWaalsContact C-N 3.33Å; I485-E487 PolarHBondContact O-N 2.78Å; E487-A489 PolarHBondContact O-N 2.81Å; E487-A489 VanDerWaalsContact O-N 3.16Å; E487-M490 PolarHBondContact O-N 2.9Å; E487-L491 PolarHBondContact O-N 2.82Å
488	L	40.4	Very low	53.6	Low	129 Å²	129	118 Å²	118	68%	0.675	64%	0.636	S	S	*	*	H	α-helix	trans	-52.2	-32.5	168.7	-78.6	73.7	0	0	0	112.7	D486 M490 L491 S492	D486-L488 PolarHBondContact O-N 3.42Å; L488-M490 VanDerWaalsContact C-N 3.26Å; L488-M490 PolarHBondContact O-N 2.81Å; L488-L491 PolarHBondContact O-N 3.32Å; L488-S492 WeakPolarHBondContact O-CB 3.11Å; L488-S492 PolarHBondContact O-N 2.88Å
489	A	44	Very low	50.8	Low	76 Å²	76	121.3 Å²	121.3	63%	0.628	65%	0.653	S	S	*	*	H	α-helix	trans	-66.5	-25	176.3	0	0	0	0	0	113.3	D486 E487	D486-A489 VanDerWaalsContact O-CB 3.3Å; D486-A489 WeakPolarHBondContact O-CB 3.25Å; D486-A489 PolarHBondContact O-N 3.42Å; E487-A489 PolarHBondContact O-N 2.81Å; E487-A489 VanDerWaalsContact O-N 3.16Å
490	M	41.9	Very low	48.1	Very low	116 Å²	116	125.5 Å²	125.5	57%	0.571	68%	0.684	S	S	*	*	H	α-helix	trans	-91.3	-19.5	172.8	-76.2	-170.7	153.7	0	0	113.3	E487 L488	E487-M490 PolarHBondContact O-N 2.9Å; L488-M490 VanDerWaalsContact C-N 3.26Å; L488-M490 PolarHBondContact O-N 2.81Å
491	L	42.7	Very low	45.6	Very low	105 Å²	105	126.5 Å²	126.5	55%	0.55	68%	0.683	S	S	.	*	H	α-helix	trans	-87.2	-30.8	177.7	-65.1	171.8	0	0	0	112.8	E487 L488 E493 K494	E487-L491 PolarHBondContact O-N 2.82Å; L488-L491 PolarHBondContact O-N 3.32Å; L491-E493 VanDerWaalsContact C-N 3.33Å; L491-E493 PolarHBondContact O-N 2.97Å; L491-K494 PolarHBondContact O-N 3.13Å; L491-K494 VanDerWaalsContact O-N 3.14Å
492	S	41.4	Very low	43.4	Very low	88 Å²	88	128.8 Å²	128.8	62%	0.615	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-20.9	-171.1	-168.6	0	0	0	0	115.9	L488	L488-S492 WeakPolarHBondContact O-CB 3.11Å; L488-S492 PolarHBondContact O-N 2.88Å
493	E	46.5	Very low	41.8	Very low	128 Å²	128	131.6 Å²	131.6	60%	0.598	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-7.5	176	-67.7	-169.4	144.5	0	0	113.1	L491 S496	L491-E493 VanDerWaalsContact C-N 3.33Å; L491-E493 PolarHBondContact O-N 2.97Å; E493-S496 PolarHBondContact O-OG 2.94Å
494	K	38.7	Very low	40.4	Very low	189 Å²	189	137.6 Å²	137.6	82%	0.822	72%	0.72	S	S	*	*	S	Bend	trans	-89.8	-8.7	-170.5	-147.6	172.4	-174.3	177	0	114.6	L491	L491-K494 PolarHBondContact O-N 3.13Å; L491-K494 VanDerWaalsContact O-N 3.14Å
495	S	38.1	Very low	39.2	Very low	104 Å²	104	138 Å²	138	73%	0.727	73%	0.725	S	S	*	*	S	Bend	trans	-113.5	-3.1	177.7	64.6	0	0	0	0	114.9
496	S	36.7	Very low	38.1	Very low	84 Å²	84	140.1 Å²	140.1	59%	0.587	74%	0.737	S	S	*	*	S	Bend	trans	-91	-3.2	-173.3	51	0	0	0	0	115.4	E493	E493-S496 PolarHBondContact O-OG 2.94Å
497	N	34.6	Very low	37.5	Very low	141 Å²	141	141.3 Å²	141.3	75%	0.754	74%	0.743	S	S	*	*	S	Bend	trans	-109.6	22.6	-174.6	-78.7	-51.7	0	0	0	114.4
498	H	32.9	Very low	36.9	Very low	175 Å²	175	142.2 Å²	142.2	81%	0.81	75%	0.749	S	S	*	*	S	Bend	trans	-149.2	52.5	-176.6	-110.4	-58.7	0	0	0	115.5
499	Q	31.3	Very low	36.4	Very low	189 Å²	189	144 Å²	144	88%	0.883	76%	0.76	S	S	*	*	S	Bend	trans	-165.2	170.8	157.8	-108.4	148.2	18.4	0	0	111.7
500	S	32.5	Very low	36.2	Very low	119 Å²	119	146.5 Å²	146.5	83%	0.832	77%	0.767	S	S	*	*			trans	55.8	76.3	-179	61.6	0	0	0	0	117.3
501	I	31.9	Very low	35.6	Very low	155 Å²	155	149.3 Å²	149.3	80%	0.795	78%	0.776	S	S	*	*			trans	-124.7	148.8	140.2	-59	178.5	0	0	0	105.5
502	N	30.2	Very low	35	Very low	145 Å²	145	150.7 Å²	150.7	78%	0.775	78%	0.779	S	S	*	*			trans	78.7	104.6	-170	-44.2	-30.4	0	0	0	114
503	E	35.1	Very low	34.6	Very low	188 Å²	188	153.6 Å²	153.6	88%	0.879	78%	0.783	S	S	*	*				175.6	159.2	117.3	-93.1	164.6	-164.3	0	0	110.2
504	E	36.2	Very low	33.9	Very low	193 Å²	193	152.1 Å²	152.1	90%	0.902	79%	0.787	S	S	*	*			trans	62.7	63.1	172	-57.4	-169.3	144.6	0	0	119.7
505	E	33.5	Very low	33.8	Very low	200 Å²	200	150.2 Å²	150.2	94%	0.935	79%	0.786	S	S	*	*			trans	-113.4	79.4	140.1	-98.4	-159.9	144.7	0	0	109.6
506	D	36.6	Very low	33.6	Very low	159 Å²	159	149.2 Å²	149.2	85%	0.85	78%	0.783	S	S	*	*			trans	-164.5	112.7	164.8	-124.8	-27.6	0	0	0	111.2
507	L	34.7	Very low	33.6	Very low	145 Å²	145	152.3 Å²	152.3	76%	0.759	79%	0.794	S	S	*	*				167.1	102.7	123.8	-163.7	71.5	0	0	0	113.5
508	M	35.4	Very low	33.6	Very low	159 Å²	159	153.9 Å²	153.9	78%	0.783	79%	0.794	S	S	*	*			trans	55.9	121.3	148	-61.3	-175.1	179.2	0	0	122.9
509	N	30.5	Very low	33.7	Very low	167 Å²	167	151.7 Å²	151.7	89%	0.893	79%	0.792	S	S	*	*			trans	-72.5	125.7	148.9	-79.4	-69.6	0	0	0	111.7
510	T	38	Very low	34.1	Very low	128 Å²	128	147.6 Å²	147.6	79%	0.785	78%	0.782	S	S	*	*			trans	-151.9	82	155.6	7	0	0	0	0	114.1
511	K	29.9	Very low	34	Very low	175 Å²	175	147 Å²	147	76%	0.761	78%	0.778	S	S	*	*			trans	8.6	145	133.8	-140.8	-175.1	175.3	-137	0	120
512	H	31.4	Very low	34.4	Very low	133 Å²	133	144.4 Å²	144.4	62%	0.616	77%	0.773	S	S	*	*			trans	74.6	151.7	167.8	-64.9	-85.2	0	0	0	116.9
513	E	31.3	Very low	34.7	Very low	150 Å²	150	144.2 Å²	144.2	70%	0.701	77%	0.772	S	S	*	*			cis	-171.2	160.8	-20.4	177	165.7	173.1	0	0	110.3
514	S	31.6	Very low	34.7	Very low	96 Å²	96	142 Å²	142	67%	0.671	77%	0.767	S	S	*	*			trans	68.8	155	158.6	56	0	0	0	0	122.2
515	D	36.7	Very low	34.7	Very low	150 Å²	150	139.3 Å²	139.3	80%	0.802	76%	0.763	S	S	*	*			trans	54.5	123.7	161.2	-58.4	-12.8	0	0	0	120.8
516	A	33.7	Very low	34.8	Very low	82 Å²	82	134.7 Å²	134.7	68%	0.678	75%	0.753	S	S	*	*			cis	96.4	148.6	31.9	0	0	0	0	0	114.7
517	N	38.3	Very low	34.7	Very low	150 Å²	150	133 Å²	133	80%	0.802	75%	0.748	S	S	*	*			trans	87.3	143.5	-173.9	-59.3	-75.8	0	0	0	116
518	K	32.9	Very low	34.9	Very low	174 Å²	174	135.1 Å²	135.1	76%	0.757	75%	0.752	S	S	*	*			cis	-173.3	116.2	-12.1	171.8	177.3	-178	177.6	0	112.6
519	V	36.1	Very low	34.9	Very low	128 Å²	128	135.4 Å²	135.4	78%	0.776	76%	0.757	S	S	*	*				46.8	148.3	120.1	177.8	0	0	0	0	119.8
520	P	39.8	Very low	35.7	Very low	103 Å²	103	131.9 Å²	131.9	67%	0.669	74%	0.738	S	S	*	*			cis	-139.7	-168	-1.9	34.9	-11.9	0	0	0	117.8
521	S	30.8	Very low	36.3	Very low	108 Å²	108	130.9 Å²	130.9	76%	0.755	73%	0.733	S	S	*	*			trans	77.8	147.6	138.8	61.2	0	0	0	0	120.8
522	S	38.7	Very low	37.4	Very low	99 Å²	99	127 Å²	127	69%	0.692	73%	0.725	S	S	*	*			cis	-159.6	174.6	-16.9	60.2	0	0	0	0	108.4
523	N	36.6	Very low	38.5	Very low	141 Å²	141	124.7 Å²	124.7	75%	0.754	72%	0.72	S	S	*	*			cis	-150.2	175.6	33.9	-86	-30.9	0	0	0	112.1
524	D	35.5	Very low	39.5	Very low	143 Å²	143	127.2 Å²	127.2	77%	0.765	72%	0.723	S	S	*	*			trans	-53.5	163.7	174	-51.3	-76.6	0	0	0	115.1
525	T	37.2	Very low	40.7	Very low	135 Å²	135	128.9 Å²	128.9	83%	0.828	72%	0.724	S	S	*	*				-159.9	158.6	56	-46.2	0	0	0	0	113.7
526	S	34.6	Very low	42.2	Very low	103 Å²	103	125 Å²	125	72%	0.72	71%	0.708	S	S	*	*			trans	-92.7	-159.5	-174.2	59.8	0	0	0	0	114.5
527	V	34.5	Very low	44.2	Very low	123 Å²	123	124.8 Å²	124.8	75%	0.745	70%	0.699	S	S	*	*			trans	91.7	123.4	174.8	179.8	0	0	0	0	114.7
528	F	39.3	Very low	46.3	Very low	191 Å²	191	121.9 Å²	121.9	84%	0.838	69%	0.686	S	S	*	*			cis	-153.2	150.1	-3.1	-134.7	-131.1	0	0	0	109.2
529	D	36.4	Very low	48.7	Very low	165 Å²	165	117.5 Å²	117.5	88%	0.882	67%	0.674	S	S	*	*			trans	-91.8	129	173	-85.8	-65.2	0	0	0	112
530	D	47.1	Very low	51	Low	93 Å²	93	115.8 Å²	115.8	50%	0.497	66%	0.659	S	S	.	*			trans	-109.5	116.4	172.3	-171.7	-39.4	0	0	0	111.2	T532 T533	D530-T532 PolarHBondContact O-N 2.85Å; D530-T532 VanDerWaalsContact OD1-CB 3.29Å; D530-T532 WeakPolarHBondContact OD1-CB 3.44Å; D530-T532 VanDerWaalsContact OD1-CG2 3.29Å; D530-T532 WeakPolarHBondContact OD1-CG2 3.49Å; D530-T532 PolarHBondContact OD1-N 3.26Å; D530-T532 PolarHBondContact OD1-OG1 2.83Å; D530-T533 PolarHBondContact O-OG1 2.79Å; D530-T533 VanDerWaalsContact O-OG1 3.12Å
531	P	50.1	Low	53.2	Low	106 Å²	106	116.2 Å²	116.2	69%	0.688	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-12.4	-174.9	28.9	-35.6	0	0	0	114.7	T533	P531-T533 VanDerWaalsContact C-N 3.28Å; P531-T533 PolarHBondContact O-N 2.85Å
532	T	52.2	Low	56	Low	95 Å²	95	115 Å²	115	58%	0.583	64%	0.643	S	S	*	*	H	α-helix	trans	-66.4	-27.6	-178	59.4	0	0	0	0	113.4	D530 R534	D530-T532 PolarHBondContact O-N 2.85Å; D530-T532 VanDerWaalsContact OD1-CB 3.29Å; D530-T532 WeakPolarHBondContact OD1-CB 3.44Å; D530-T532 VanDerWaalsContact OD1-CG2 3.29Å; D530-T532 WeakPolarHBondContact OD1-CG2 3.49Å; D530-T532 PolarHBondContact OD1-N 3.26Å; D530-T532 PolarHBondContact OD1-OG1 2.83Å; T532-R534 PolarHBondContact O-N 2.87Å
533	T	54.1	Low	58.4	Low	84 Å²	84	115 Å²	115	52%	0.515	64%	0.635	S	S	.	*	H	α-helix	trans	-70.6	-28.8	-174.9	58.1	0	0	0	0	114.1	D530 P531 S536 T537	D530-T533 PolarHBondContact O-OG1 2.79Å; D530-T533 VanDerWaalsContact O-OG1 3.12Å; P531-T533 VanDerWaalsContact C-N 3.28Å; P531-T533 PolarHBondContact O-N 2.85Å; T533-S536 PolarHBondContact O-N 3.45Å; T533-T537 PolarHBondContact O-N 2.93Å; T533-T537 PolarHBondContact O-OG1 3.37Å
534	R	54.2	Low	60.9	Low	202 Å²	202	112.3 Å²	112.3	76%	0.762	62%	0.623	S	S	*	*	H	α-helix	trans	-75.1	-26.7	-179.6	-74.7	-166.5	177.4	-125.8	1.7	114	T532 T537 V538	T532-R534 PolarHBondContact O-N 2.87Å; R534-T537 PolarHBondContact O-OG1 2.86Å; R534-V538 WeakPolarHBondContact O-CG2 3.26Å; R534-V538 PolarHBondContact O-N 3.16Å
535	L	56.5	Low	63.6	Low	131 Å²	131	111.4 Å²	111.4	69%	0.686	62%	0.618	S	S	*	*	H	α-helix	trans	-71.1	-43.9	170.2	-89.4	79.3	0	0	0	111	T537 V538 V539	L535-T537 PolarHBondContact O-N 3.47Å; L535-V538 PolarHBondContact O-N 2.88Å; L535-V539 WeakPolarHBondContact O-CB 3.35Å; L535-V539 WeakPolarHBondContact O-CG2 3.21Å; L535-V539 PolarHBondContact O-N 3.03Å
536	S	68.2	Low	66.2	Low	68 Å²	68	109.4 Å²	109.4	48%	0.476	60%	0.602	S	S	.	*	H	α-helix	trans	-57.9	-47.3	-178.8	-174.2	0	0	0	0	112.3	T533 V538 V539 I540	T533-S536 PolarHBondContact O-N 3.45Å; S536-V538 PolarHBondContact O-N 2.92Å; S536-V539 PolarHBondContact O-N 2.55Å; S536-I540 VanDerWaalsContact O-CG1 3.29Å; S536-I540 WeakPolarHBondContact O-CG1 3.29Å; S536-I540 PolarHBondContact O-N 3.47Å
537	T	76.1	Confident	68.9	Low	79 Å²	79	108.7 Å²	108.7	49%	0.485	60%	0.596	S	S	.	*	H	α-helix	trans	-64.4	-39	178.6	40.6	0	0	0	0	113.3	T533 R534 L535 L541	T533-T537 PolarHBondContact O-N 2.93Å; T533-T537 PolarHBondContact O-OG1 3.37Å; R534-T537 PolarHBondContact O-OG1 2.86Å; L535-T537 PolarHBondContact O-N 3.47Å; T537-L541 WeakPolarHBondContact O-CG 3.05Å; T537-L541 PolarHBondContact O-N 3.37Å; T537-L541 VanDerWaalsContact O-N 3.09Å
538	V	82.4	Confident	71.5	Confident	88 Å²	88	106.4 Å²	106.4	53%	0.533	58%	0.584	S	S	.	*	H	α-helix	trans	-67.3	-42.4	174.2	172.6	0	0	0	0	111.5	R534 L535 S536 I540 L541 V542	R534-V538 WeakPolarHBondContact O-CG2 3.26Å; R534-V538 PolarHBondContact O-N 3.16Å; L535-V538 PolarHBondContact O-N 2.88Å; S536-V538 PolarHBondContact O-N 2.92Å; V538-I540 VanDerWaalsContact C-N 3.34Å; V538-I540 PolarHBondContact O-N 3.21Å; V538-L541 PolarHBondContact O-N 3.15Å; V538-V542 HydrophobicContact CG1-CG2 4.44Å; V538-V542 WeakPolarHBondContact O-CG2 3.47Å; V538-V542 PolarHBondContact O-N 2.67Å
539	V	82.3	Confident	74	Confident	82 Å²	82	103.7 Å²	103.7	50%	0.497	57%	0.572	S	S	.	*	H	α-helix	trans	-61.8	-41.6	176.7	168.9	0	0	0	0	111.3	L535 S536 V542 L543	L535-V539 WeakPolarHBondContact O-CB 3.35Å; L535-V539 WeakPolarHBondContact O-CG2 3.21Å; L535-V539 PolarHBondContact O-N 3.03Å; S536-V539 PolarHBondContact O-N 2.55Å; V539-V542 PolarHBondContact O-N 3.34Å; V539-L543 HydrophobicContact CG1-CD1 3.94Å; V539-L543 HydrophobicContact CG1-CG 4.46Å; V539-L543 WeakPolarHBondContact O-CB 3.42Å; V539-L543 VanDerWaalsContact O-CG 3.31Å; V539-L543 WeakPolarHBondContact O-CG 3.19Å; V539-L543 PolarHBondContact O-N 3.28Å
540	I	84.2	Confident	76.7	Confident	92 Å²	92	100.6 Å²	100.6	47%	0.472	56%	0.555	S	S	.	*	H	α-helix	trans	-61.9	-46.2	175.3	-69.4	162.8	0	0	0	111.1	S536 V538 V542 L543 V544	S536-I540 VanDerWaalsContact O-CG1 3.29Å; S536-I540 WeakPolarHBondContact O-CG1 3.29Å; S536-I540 PolarHBondContact O-N 3.47Å; V538-I540 VanDerWaalsContact C-N 3.34Å; V538-I540 PolarHBondContact O-N 3.21Å; I540-V542 PolarHBondContact O-N 2.65Å; I540-L543 PolarHBondContact O-N 3.04Å; I540-V544 WeakPolarHBondContact O-CG2 3.24Å; I540-V544 PolarHBondContact O-N 2.98Å
541	L	86.5	Confident	78.7	Confident	113 Å²	113	98.4 Å²	98.4	59%	0.592	55%	0.554	S	S	*	*	H	α-helix	trans	-62.7	-40.4	177.6	-75.6	170.1	0	0	0	112.6	T537 V538 V544 L545	T537-L541 WeakPolarHBondContact O-CG 3.05Å; T537-L541 PolarHBondContact O-N 3.37Å; T537-L541 VanDerWaalsContact O-N 3.09Å; V538-L541 PolarHBondContact O-N 3.15Å; L541-V544 PolarHBondContact O-N 3.17Å; L541-L545 WeakPolarHBondContact O-CB 3.2Å; L541-L545 WeakPolarHBondContact O-CG 3.39Å; L541-L545 PolarHBondContact O-N 3.2Å
542	V	89.8	Confident	80.6	Confident	82 Å²	82	99.1 Å²	99.1	50%	0.497	55%	0.552	S	S	.	*	H	α-helix	trans	-63.4	-43.7	174.7	170.3	0	0	0	0	111.1	V538 V539 I540 L545 L546	V538-V542 HydrophobicContact CG1-CG2 4.44Å; V538-V542 WeakPolarHBondContact O-CG2 3.47Å; V538-V542 PolarHBondContact O-N 2.67Å; V539-V542 PolarHBondContact O-N 3.34Å; I540-V542 PolarHBondContact O-N 2.65Å; V542-L545 PolarHBondContact O-N 2.95Å; V542-L546 WeakPolarHBondContact O-CB 3.34Å; V542-L546 PolarHBondContact O-N 3.29Å
543	L	88.7	Confident	82.5	Confident	100 Å²	100	99 Å²	99	52%	0.524	55%	0.548	S	S	.	.	H	α-helix	trans	-63.7	-40.9	177	-73.7	169.1	0	0	0	112.4	V539 I540 L546 C547	V539-L543 HydrophobicContact CG1-CD1 3.94Å; V539-L543 HydrophobicContact CG1-CG 4.46Å; V539-L543 WeakPolarHBondContact O-CB 3.42Å; V539-L543 VanDerWaalsContact O-CG 3.31Å; V539-L543 WeakPolarHBondContact O-CG 3.19Å; V539-L543 PolarHBondContact O-N 3.28Å; I540-L543 PolarHBondContact O-N 3.04Å; L543-L546 PolarHBondContact O-N 2.81Å; L543-C547 WeakPolarHBondContact O-CB 3.24Å; L543-C547 PolarHBondContact O-N 3.1Å
544	V	89.8	Confident	84.3	Confident	83 Å²	83	98 Å²	98	50%	0.503	55%	0.548	S	S	.	.	H	α-helix	trans	-62.9	-47.4	175.4	171	0	0	0	0	110.9	I540 L541 L546 C547 C548	I540-V544 WeakPolarHBondContact O-CG2 3.24Å; I540-V544 PolarHBondContact O-N 2.98Å; L541-V544 PolarHBondContact O-N 3.17Å; V544-L546 VanDerWaalsContact C-N 3.31Å; V544-L546 PolarHBondContact O-N 2.86Å; V544-C547 PolarHBondContact O-N 3.06Å; V544-C548 PolarHBondContact O-N 2.84Å; V544-C548 PolarHBondContact O-SG 3.46Å; V544-C548 VanDerWaalsContact O-SG 3.34Å
545	L	90.7	Very high	85.9	Confident	125 Å²	125	90.4 Å²	90.4	65%	0.654	53%	0.532	S	S	*	.	H	α-helix	trans	-60.4	-40	176.7	-74.2	168.1	0	0	0	112.2	L541 V542 C548 F549	L541-L545 WeakPolarHBondContact O-CB 3.2Å; L541-L545 WeakPolarHBondContact O-CG 3.39Å; L541-L545 PolarHBondContact O-N 3.2Å; V542-L545 PolarHBondContact O-N 2.95Å; L545-C548 PolarHBondContact O-N 3.34Å; L545-F549 WeakPolarHBondContact O-CB 3.08Å; L545-F549 PolarHBondContact O-N 2.79Å
546	L	92.4	Very high	87.5	Confident	93 Å²	93	88.6 Å²	88.6	49%	0.487	53%	0.526	S	S	.	.	H	α-helix	trans	-68.1	-41.4	178.7	-153.5	161.8	0	0	0	111.2	V542 L543 V544 F549 L550	V542-L546 WeakPolarHBondContact O-CB 3.34Å; V542-L546 PolarHBondContact O-N 3.29Å; L543-L546 PolarHBondContact O-N 2.81Å; V544-L546 VanDerWaalsContact C-N 3.31Å; V544-L546 PolarHBondContact O-N 2.86Å; L546-F549 PolarHBondContact O-N 2.97Å; L546-L550 HydrophobicContact CD2-CD1 3.62Å; L546-L550 HydrophobicContact CD2-CG 4.04Å; L546-L550 WeakPolarHBondContact O-CG 3.44Å; L546-L550 PolarHBondContact O-N 2.9Å
547	C	91.1	Very high	88.5	Confident	88 Å²	88	87.9 Å²	87.9	60%	0.595	52%	0.524	S	S	*	.	H	α-helix	trans	-60.9	-44.8	170.8	-82.1	0	0	0	0	112.7	L543 V544 F549 L550 G551	L543-C547 WeakPolarHBondContact O-CB 3.24Å; L543-C547 PolarHBondContact O-N 3.1Å; V544-C547 PolarHBondContact O-N 3.06Å; C547-F549 VanDerWaalsContact C-N 3.32Å; C547-F549 PolarHBondContact O-N 3.41Å; C547-L550 PolarHBondContact O-N 2.89Å; C547-G551 PolarHBondContact O-N 2.97Å
548	C	89.1	Confident	89.1	Confident	74 Å²	74	87.9 Å²	87.9	50%	0.5	53%	0.527	S	S	.	.	H	α-helix	trans	-61.1	-40.5	175.6	-69.9	0	0	0	0	112	V544 L545 G551 L552	V544-C548 PolarHBondContact O-N 2.84Å; V544-C548 PolarHBondContact O-SG 3.46Å; V544-C548 VanDerWaalsContact O-SG 3.34Å; L545-C548 PolarHBondContact O-N 3.34Å; C548-G551 PolarHBondContact O-N 2.91Å; C548-L552 WeakPolarHBondContact O-CG 3.34Å; C548-L552 PolarHBondContact O-N 2.95Å
549	F	92.4	Very high	89.3	Confident	135 Å²	135	90.4 Å²	90.4	59%	0.592	53%	0.531	S	S	*	.	H	α-helix	trans	-65.4	-43.6	177	-168.2	-105.3	0	0	0	112.3	L545 L546 C547 L552 L553	L545-F549 WeakPolarHBondContact O-CB 3.08Å; L545-F549 PolarHBondContact O-N 2.79Å; L546-F549 PolarHBondContact O-N 2.97Å; C547-F549 VanDerWaalsContact C-N 3.32Å; C547-F549 PolarHBondContact O-N 3.41Å; F549-L552 PolarHBondContact O-N 2.81Å; F549-L553 HydrophobicContact CD1-CD1 3.85Å; F549-L553 HydrophobicContact CD1-CG 4.42Å; F549-L553 HydrophobicContact CE1-CD1 3.63Å; F549-L553 HydrophobicContact CE1-CG 4.26Å; F549-L553 HydrophobicContact CZ-CD1 4.38Å; F549-L553 WeakPolarHBondContact O-CG 3.38Å; F549-L553 PolarHBondContact O-N 2.98Å
550	L	92.1	Very high	89.5	Confident	99 Å²	99	89 Å²	89	52%	0.518	53%	0.525	S	S	.	.	H	α-helix	trans	-63.6	-40.1	174.1	-71.2	172.5	0	0	0	112.4	L546 C547 L553 A554	L546-L550 HydrophobicContact CD2-CD1 3.62Å; L546-L550 HydrophobicContact CD2-CG 4.04Å; L546-L550 WeakPolarHBondContact O-CG 3.44Å; L546-L550 PolarHBondContact O-N 2.9Å; C547-L550 PolarHBondContact O-N 2.89Å; L550-L553 PolarHBondContact O-N 2.96Å; L550-A554 WeakPolarHBondContact O-CB 3.39Å; L550-A554 PolarHBondContact O-N 2.77Å
551	G	89.9	Confident	89.6	Confident	47 Å²	47	89.1 Å²	89.1	49%	0.485	53%	0.529	S	S	.	.	H	α-helix	trans	-61.5	-43.4	174.7	0	0	0	0	0	112.7	C547 C548 A554 G555	C547-G551 PolarHBondContact O-N 2.97Å; C548-G551 PolarHBondContact O-N 2.91Å; G551-A554 PolarHBondContact O-N 2.93Å; G551-G555 PolarHBondContact O-N 3.05Å
552	L	90.6	Very high	89.5	Confident	122 Å²	122	87.5 Å²	87.5	64%	0.639	52%	0.524	S	S	*	.	H	α-helix	trans	-64.4	-43.1	174.6	-73.9	169.5	0	0	0	112.2	C548 F549 G555 V556	C548-L552 WeakPolarHBondContact O-CG 3.34Å; C548-L552 PolarHBondContact O-N 2.95Å; F549-L552 PolarHBondContact O-N 2.81Å; L552-G555 PolarHBondContact O-N 2.75Å; L552-V556 WeakPolarHBondContact O-CB 3.38Å; L552-V556 WeakPolarHBondContact O-CG2 3.18Å; L552-V556 PolarHBondContact O-N 2.82Å
553	L	91.8	Very high	89.2	Confident	93 Å²	93	90 Å²	90	49%	0.487	53%	0.525	S	S	.	.	H	α-helix	trans	-61.6	-43.3	175.4	-73.3	175.4	0	0	0	112.1	F549 L550 V556 A557	F549-L553 HydrophobicContact CD1-CD1 3.85Å; F549-L553 HydrophobicContact CD1-CG 4.42Å; F549-L553 HydrophobicContact CE1-CD1 3.63Å; F549-L553 HydrophobicContact CE1-CG 4.26Å; F549-L553 HydrophobicContact CZ-CD1 4.38Å; F549-L553 WeakPolarHBondContact O-CG 3.38Å; F549-L553 PolarHBondContact O-N 2.98Å; L550-L553 PolarHBondContact O-N 2.96Å; L553-V556 PolarHBondContact O-N 2.77Å; L553-A557 VanDerWaalsContact O-CB 3.31Å; L553-A557 WeakPolarHBondContact O-CB 3.39Å; L553-A557 PolarHBondContact O-N 2.8Å
554	A	90.8	Very high	88.8	Confident	63 Å²	63	91.4 Å²	91.4	52%	0.521	53%	0.53	S	S	.	.	H	α-helix	trans	-64.1	-41.9	175.8	0	0	0	0	0	112.1	L550 G551 A557 C558	L550-A554 WeakPolarHBondContact O-CB 3.39Å; L550-A554 PolarHBondContact O-N 2.77Å; G551-A554 PolarHBondContact O-N 2.93Å; A554-A557 PolarHBondContact O-N 3.48Å; A554-C558 WeakPolarHBondContact O-CB 3.22Å; A554-C558 PolarHBondContact O-N 2.97Å
555	G	89.1	Confident	88.3	Confident	42 Å²	42	92.9 Å²	92.9	43%	0.433	53%	0.531	S	S	.	.	H	α-helix	trans	-61.7	-47.1	175.1	0	0	0	0	0	112.8	G551 L552 C558 F559	G551-G555 PolarHBondContact O-N 3.05Å; L552-G555 PolarHBondContact O-N 2.75Å; G555-C558 PolarHBondContact O-N 3.42Å; G555-F559 WeakPolarHBondContact O-CB 3.35Å; G555-F559 PolarHBondContact O-N 3.16Å
556	V	90.7	Very high	87.8	Confident	92 Å²	92	94.4 Å²	94.4	56%	0.558	53%	0.528	S	S	*	.	H	α-helix	trans	-64.9	-38.7	176.6	171.5	0	0	0	0	111.6	L552 L553 S560	L552-V556 WeakPolarHBondContact O-CB 3.38Å; L552-V556 WeakPolarHBondContact O-CG2 3.18Å; L552-V556 PolarHBondContact O-N 2.82Å; L553-V556 PolarHBondContact O-N 2.77Å; V556-S560 VanDerWaalsContact O-CB 3.3Å; V556-S560 WeakPolarHBondContact O-CB 3.44Å; V556-S560 PolarHBondContact O-N 2.98Å; V556-S560 PolarHBondContact O-OG 2.97Å
557	A	88	Confident	87.1	Confident	53 Å²	53	95 Å²	95	44%	0.438	53%	0.527	S	S	.	.	H	α-helix	trans	-64.1	-46.2	174.6	0	0	0	0	0	111.8	L553 A554 S560 V561	L553-A557 VanDerWaalsContact O-CB 3.31Å; L553-A557 WeakPolarHBondContact O-CB 3.39Å; L553-A557 PolarHBondContact O-N 2.8Å; A554-A557 PolarHBondContact O-N 3.48Å; A557-S560 WeakPolarHBondContact O-CB 3.36Å; A557-S560 PolarHBondContact O-N 3.04Å; A557-V561 WeakPolarHBondContact O-CG2 3.22Å; A557-V561 PolarHBondContact O-N 3.14Å
558	C	88.9	Confident	86.5	Confident	79 Å²	79	99 Å²	99	53%	0.534	53%	0.53	S	S	.	.	H	α-helix	trans	-63.8	-42.7	178.1	-168.6	0	0	0	0	111.9	A554 G555 S560 V561 T562	A554-C558 WeakPolarHBondContact O-CB 3.22Å; A554-C558 PolarHBondContact O-N 2.97Å; G555-C558 PolarHBondContact O-N 3.42Å; C558-S560 VanDerWaalsContact C-N 3.34Å; C558-S560 PolarHBondContact O-N 3.19Å; C558-V561 PolarHBondContact O-N 3.37Å; C558-T562 WeakPolarHBondContact O-CG2 3.42Å; C558-T562 PolarHBondContact O-N 2.92Å; C558-T562 PolarHBondContact O-OG1 3.16Å
559	F	86.8	Confident	85.7	Confident	142 Å²	142	100.1 Å²	100.1	62%	0.623	53%	0.527	S	S	*	.	H	α-helix	trans	-61.3	-41.2	172.6	-174	-96.3	0	0	0	111.9	G555 T562 W563	G555-F559 WeakPolarHBondContact O-CB 3.35Å; G555-F559 PolarHBondContact O-N 3.16Å; F559-T562 WeakPolarHBondContact CA-OG1 3.44Å; F559-T562 PolarHBondContact O-OG1 3.04Å; F559-T562 VanDerWaalsContact O-OG1 3.09Å; F559-W563 WeakPolarHBondContact O-CB 3.29Å; F559-W563 PolarHBondContact O-N 3.28Å
560	S	86.5	Confident	84.9	Confident	53 Å²	53	97.2 Å²	97.2	37%	0.371	52%	0.518	S	S	.	.	H	α-helix	trans	-65.2	-43.2	178.2	-60.3	0	0	0	0	112.3	V556 A557 C558 M564	V556-S560 VanDerWaalsContact O-CB 3.3Å; V556-S560 WeakPolarHBondContact O-CB 3.44Å; V556-S560 PolarHBondContact O-N 2.98Å; V556-S560 PolarHBondContact O-OG 2.97Å; A557-S560 WeakPolarHBondContact O-CB 3.36Å; A557-S560 PolarHBondContact O-N 3.04Å; C558-S560 VanDerWaalsContact C-N 3.34Å; C558-S560 PolarHBondContact O-N 3.19Å; S560-M564 WeakPolarHBondContact O-CB 3.01Å; S560-M564 WeakPolarHBondContact O-CG 3.14Å; S560-M564 PolarHBondContact O-N 2.77Å
561	V	86.2	Confident	83.9	Confident	93 Å²	93	97.1 Å²	97.1	56%	0.564	52%	0.517	S	S	*	.	H	α-helix	trans	-65.3	-47.4	177.3	171.5	0	0	0	0	111	A557 C558 M564 H565	A557-V561 WeakPolarHBondContact O-CG2 3.22Å; A557-V561 PolarHBondContact O-N 3.14Å; C558-V561 PolarHBondContact O-N 3.37Å; V561-M564 PolarHBondContact O-N 2.96Å; V561-H565 PolarHBondContact O-N 3.27Å
562	T	84.5	Confident	83.1	Confident	79 Å²	79	100.1 Å²	100.1	49%	0.485	52%	0.519	S	S	.	.	H	α-helix	trans	-65.6	-39.3	178.8	50.1	0	0	0	0	112.4	C558 F559 H565 R566	C558-T562 WeakPolarHBondContact O-CG2 3.42Å; C558-T562 PolarHBondContact O-N 2.92Å; C558-T562 PolarHBondContact O-OG1 3.16Å; F559-T562 WeakPolarHBondContact CA-OG1 3.44Å; F559-T562 PolarHBondContact O-OG1 3.04Å; F559-T562 VanDerWaalsContact O-OG1 3.09Å; T562-H565 PolarHBondContact O-N 2.74Å; T562-R566 WeakPolarHBondContact O-CB 3.15Å; T562-R566 PolarHBondContact O-N 2.99Å
563	W	83.2	Confident	81.7	Confident	136 Å²	136	99.7 Å²	99.7	52%	0.515	51%	0.509	S	S	.	.	H	α-helix	trans	-63.1	-44	173.2	-175.8	86	0	0	0	112.3	F559 R566 K567	F559-W563 WeakPolarHBondContact O-CB 3.29Å; F559-W563 PolarHBondContact O-N 3.28Å; W563-R566 PolarHBondContact O-N 3.28Å; W563-K567 HydrophobicContact CH2-CD 3.78Å; W563-K567 HydrophobicContact CZ2-CD 3.93Å; W563-K567 HydrophobicContact CZ3-CD 4.07Å; W563-K567 VanDerWaalsContact O-CB 3.29Å; W563-K567 WeakPolarHBondContact O-CB 3.07Å; W563-K567 PolarHBondContact O-N 3.26Å
564	M	80.5	Confident	80.2	Confident	128 Å²	128	101.5 Å²	101.5	63%	0.631	52%	0.515	S	S	*	.	H	α-helix	trans	-64.4	-40	174.9	-74.9	-140.3	-64.3	0	0	112.5	S560 V561 K567 R568	S560-M564 WeakPolarHBondContact O-CB 3.01Å; S560-M564 WeakPolarHBondContact O-CG 3.14Å; S560-M564 PolarHBondContact O-N 2.77Å; V561-M564 PolarHBondContact O-N 2.96Å; M564-K567 PolarHBondContact O-N 3.26Å; M564-R568 WeakPolarHBondContact O-CB 3.29Å; M564-R568 PolarHBondContact O-N 2.93Å
565	H	78.8	Confident	78.6	Confident	115 Å²	115	105.6 Å²	105.6	53%	0.532	52%	0.521	S	S	.	.	H	α-helix	trans	-66.3	-41	178.4	-136.6	-72.6	0	0	0	111.9	V561 T562 R568 H569	V561-H565 PolarHBondContact O-N 3.27Å; T562-H565 PolarHBondContact O-N 2.74Å; H565-R568 PolarHBondContact O-N 2.87Å; H565-H569 AromaticContact CE1-NE2 3.98Å; H565-H569 AromaticContact ND1-CD2 3.87Å; H565-H569 AromaticContact ND1-NE2 3.69Å; H565-H569 PolarHBondContact O-CD2 3.17Å; H565-H569 VanDerWaalsContact O-CD2 3.31Å; H565-H569 PolarHBondContact O-N 3.47Å
566	R	80.4	Confident	77.1	Confident	157 Å²	157	110.8 Å²	110.8	59%	0.592	53%	0.533	S	S	*	.	H	α-helix	trans	-60.8	-53.3	173.6	-173.5	172.5	-176.1	159.4	3	111.2	T562 W563 R568 H569 D570	T562-R566 WeakPolarHBondContact O-CB 3.15Å; T562-R566 PolarHBondContact O-N 2.99Å; W563-R566 PolarHBondContact O-N 3.28Å; R566-R568 PolarHBondContact O-N 2.77Å; R566-H569 PolarHBondContact O-N 3.21Å; R566-D570 PolarHBondContact O-N 2.79Å; R566-D570 VanDerWaalsContact O-N 3.07Å
567	K	77	Confident	75.3	Confident	105 Å²	105	112.9 Å²	112.9	46%	0.457	54%	0.537	S	S	.	.	H	α-helix	trans	-61	-29.2	-179.4	-168.5	169.5	-173.4	174.1	0	113.4	W563 M564 L571	W563-K567 HydrophobicContact CH2-CD 3.78Å; W563-K567 HydrophobicContact CZ2-CD 3.93Å; W563-K567 HydrophobicContact CZ3-CD 4.07Å; W563-K567 VanDerWaalsContact O-CB 3.29Å; W563-K567 WeakPolarHBondContact O-CB 3.07Å; W563-K567 PolarHBondContact O-N 3.26Å; M564-K567 PolarHBondContact O-N 3.26Å; K567-L571 PolarHBondContact O-N 2.04Å
568	R	79	Confident	73.7	Confident	173 Å²	173	114.5 Å²	114.5	65%	0.653	54%	0.541	S	S	*	.	H	α-helix	trans	-68.9	-40.9	173.1	-171	175	-177	166.5	2.5	112.4	M564 H565 R566 E572	M564-R568 WeakPolarHBondContact O-CB 3.29Å; M564-R568 PolarHBondContact O-N 2.93Å; H565-R568 PolarHBondContact O-N 2.87Å; R566-R568 PolarHBondContact O-N 2.77Å; R568-E572 PolarHBondContact O-N 2.7Å
569	H	73.7	Confident	71.8	Confident	97 Å²	97	116.6 Å²	116.6	45%	0.449	54%	0.543	S	S	.	.	H	α-helix	trans	-68.3	-39.7	175.6	-80.1	-66.7	0	0	0	112.7	H565 R566 L571 E572 R573	H565-H569 AromaticContact CE1-NE2 3.98Å; H565-H569 AromaticContact ND1-CD2 3.87Å; H565-H569 AromaticContact ND1-NE2 3.69Å; H565-H569 PolarHBondContact O-CD2 3.17Å; H565-H569 VanDerWaalsContact O-CD2 3.31Å; H565-H569 PolarHBondContact O-N 3.47Å; R566-H569 PolarHBondContact O-N 3.21Å; H569-L571 VanDerWaalsContact C-N 3.3Å; H569-L571 PolarHBondContact O-N 2.83Å; H569-E572 PolarHBondContact O-N 2.73Å; H569-E572 VanDerWaalsContact O-N 3.16Å; H569-R573 WeakPolarHBondContact O-CG 3.31Å; H569-R573 PolarHBondContact O-N 2.81Å; H569-R573 VanDerWaalsContact O-N 3.09Å
570	D	75	Confident	70	Confident	73 Å²	73	117 Å²	117	39%	0.39	55%	0.545	S	S	.	.	H	α-helix	trans	-60.4	-41.1	179.2	-61.3	-36.6	0	0	0	111.2	R566 E572 R573 E574	R566-D570 PolarHBondContact O-N 2.79Å; R566-D570 VanDerWaalsContact O-N 3.07Å; D570-E572 VanDerWaalsContact C-N 3.31Å; D570-E572 PolarHBondContact O-N 2.91Å; D570-R573 PolarHBondContact O-N 2.75Å; D570-E574 PolarHBondContact O-N 2.8Å; D570-E574 VanDerWaalsContact O-N 3.16Å
571	L	70.8	Confident	68.1	Low	97 Å²	97	118.3 Å²	118.3	51%	0.508	55%	0.55	S	S	.	*	H	α-helix	trans	-67.1	-20.9	176.2	-94.7	162.4	0	0	0	115.4	K567 H569	K567-L571 PolarHBondContact O-N 2.04Å; H569-L571 VanDerWaalsContact C-N 3.3Å; H569-L571 PolarHBondContact O-N 2.83Å
572	E	73.1	Confident	66.2	Low	111 Å²	111	119.8 Å²	119.8	52%	0.519	56%	0.555	S	S	.	*	H	α-helix	trans	-87.4	-32.7	172.2	-71.7	-173.9	173.8	0	0	111.7	R568 H569 D570 K575 H576	R568-E572 PolarHBondContact O-N 2.7Å; H569-E572 PolarHBondContact O-N 2.73Å; H569-E572 VanDerWaalsContact O-N 3.16Å; D570-E572 VanDerWaalsContact C-N 3.31Å; D570-E572 PolarHBondContact O-N 2.91Å; E572-K575 PolarHBondContact O-N 2.8Å; E572-H576 PolarHBondContact O-N 3.11Å
573	R	60.1	Low	64.5	Low	112 Å²	112	120.9 Å²	120.9	42%	0.423	56%	0.557	S	S	.	*	H	α-helix	trans	-62.8	-43.7	173.6	-67.8	-177.7	-167.2	-164	7.2	112.1	H569 D570 K575 H576 Q577	H569-R573 WeakPolarHBondContact O-CG 3.31Å; H569-R573 PolarHBondContact O-N 2.81Å; H569-R573 VanDerWaalsContact O-N 3.09Å; D570-R573 PolarHBondContact O-N 2.75Å; R573-K575 VanDerWaalsContact C-N 3.26Å; R573-K575 PolarHBondContact O-N 2.85Å; R573-H576 PolarHBondContact O-N 3.22Å; R573-H576 VanDerWaalsContact O-N 3.1Å; R573-Q577 WeakPolarHBondContact O-CB 3.31Å; R573-Q577 PolarHBondContact O-N 2.65Å
574	E	60.2	Low	62.7	Low	131 Å²	131	119.9 Å²	119.9	61%	0.612	56%	0.56	S	S	*	*	H	α-helix	trans	-56.5	-40	177.7	-73.4	-167.2	140.9	0	0	112.3	D570 H576 Q577 V578	D570-E574 PolarHBondContact O-N 2.8Å; D570-E574 VanDerWaalsContact O-N 3.16Å; E574-H576 PolarHBondContact O-N 2.92Å; E574-Q577 PolarHBondContact O-N 2.78Å; E574-V578 WeakPolarHBondContact O-CB 3.28Å; E574-V578 WeakPolarHBondContact O-CG2 3.45Å; E574-V578 PolarHBondContact O-N 3.3Å
575	K	58.7	Low	60.7	Low	150 Å²	150	123.2 Å²	123.2	65%	0.652	57%	0.566	S	S	*	*	H	α-helix	trans	-63.8	-39.5	177.4	-67.6	177.9	-179.1	175.3	0	112.6	E572 R573 H579	E572-K575 PolarHBondContact O-N 2.8Å; R573-K575 VanDerWaalsContact C-N 3.26Å; R573-K575 PolarHBondContact O-N 2.85Å; K575-H579 WeakPolarHBondContact O-CB 3.14Å; K575-H579 PolarHBondContact O-N 3.11Å
576	H	57.6	Low	58.7	Low	151 Å²	151	119.1 Å²	119.1	70%	0.699	56%	0.555	S	S	*	*	H	α-helix	trans	-76	-35.4	176.3	-80.4	23.2	0	0	0	112.7	E572 R573 E574 H579 K580	E572-H576 PolarHBondContact O-N 3.11Å; R573-H576 PolarHBondContact O-N 3.22Å; R573-H576 VanDerWaalsContact O-N 3.1Å; E574-H576 PolarHBondContact O-N 2.92Å; H576-H579 PolarHBondContact O-N 2.89Å; H576-K580 PolarHBondContact O-N 3.38Å
577	Q	51.9	Low	56.9	Low	135 Å²	135	119 Å²	119	63%	0.631	56%	0.561	S	S	*	*	H	α-helix	trans	-62.8	-50.5	176.5	-161.3	95.5	4.9	0	0	110.5	R573 E574 H579 K580 T581	R573-Q577 WeakPolarHBondContact O-CB 3.31Å; R573-Q577 PolarHBondContact O-N 2.65Å; E574-Q577 PolarHBondContact O-N 2.78Å; Q577-H579 VanDerWaalsContact C-N 3.31Å; Q577-H579 PolarHBondContact O-N 2.89Å; Q577-K580 PolarHBondContact O-N 3.43Å; Q577-T581 PolarHBondContact O-N 3.03Å; Q577-T581 PolarHBondContact O-OG1 2.93Å
578	V	53.9	Low	55	Low	87 Å²	87	121 Å²	121	53%	0.527	58%	0.577	S	S	.	*	H	α-helix	trans	-59.4	-41.3	177.6	170.5	0	0	0	0	111.3	E574 T581 L582	E574-V578 WeakPolarHBondContact O-CB 3.28Å; E574-V578 WeakPolarHBondContact O-CG2 3.45Å; E574-V578 PolarHBondContact O-N 3.3Å; V578-T581 PolarHBondContact O-N 3.18Å; V578-L582 HydrophobicContact CG1-CD1 3.92Å; V578-L582 WeakPolarHBondContact O-CB 3.48Å; V578-L582 PolarHBondContact O-N 2.86Å
579	H	50	Low	53	Low	123 Å²	123	115.8 Å²	115.8	57%	0.569	57%	0.571	S	S	*	*	H	α-helix	trans	-70.3	-31.9	179.1	-152.4	-45.7	0	0	0	113.3	K575 H576 Q577 L583	K575-H579 WeakPolarHBondContact O-CB 3.14Å; K575-H579 PolarHBondContact O-N 3.11Å; H576-H579 PolarHBondContact O-N 2.89Å; Q577-H579 VanDerWaalsContact C-N 3.31Å; Q577-H579 PolarHBondContact O-N 2.89Å; H579-L583 WeakPolarHBondContact O-CD1 3.43Å; H579-L583 WeakPolarHBondContact O-CG 3.23Å; H579-L583 PolarHBondContact O-N 2.89Å
580	K	49	Very low	51.1	Low	151 Å²	151	117.6 Å²	117.6	66%	0.657	58%	0.583	S	S	*	*	H	α-helix	trans	-71.7	-43.4	171.2	-95.5	-169.7	171.8	-174	0	112.3	H576 Q577 L582 L583 I584	H576-K580 PolarHBondContact O-N 3.38Å; Q577-K580 PolarHBondContact O-N 3.43Å; K580-L582 VanDerWaalsContact C-N 3.32Å; K580-L582 PolarHBondContact O-N 2.89Å; K580-L583 PolarHBondContact O-N 3.37Å; K580-I584 WeakPolarHBondContact O-CG1 3.09Å; K580-I584 PolarHBondContact O-N 2.77Å
581	T	46.5	Very low	49.1	Very low	80 Å²	80	121.5 Å²	121.5	49%	0.491	60%	0.604	S	S	.	*	H	α-helix	trans	-67.7	-31.6	179.2	-55.2	0	0	0	0	112.1	Q577 V578 R585	Q577-T581 PolarHBondContact O-N 3.03Å; Q577-T581 PolarHBondContact O-OG1 2.93Å; V578-T581 PolarHBondContact O-N 3.18Å; T581-R585 WeakPolarHBondContact O-CB 3.45Å; T581-R585 PolarHBondContact O-N 3.3Å
582	L	46.6	Very low	47.3	Very low	125 Å²	125	123 Å²	123	65%	0.654	62%	0.617	S	S	*	*	H	α-helix	trans	-73.2	-27	171.7	-85.4	164.9	0	0	0	114.2	V578 K580 G586	V578-L582 HydrophobicContact CG1-CD1 3.92Å; V578-L582 WeakPolarHBondContact O-CB 3.48Å; V578-L582 PolarHBondContact O-N 2.86Å; K580-L582 VanDerWaalsContact C-N 3.32Å; K580-L582 PolarHBondContact O-N 2.89Å; L582-G586 WeakPolarHBondContact O-CA 3.35Å; L582-G586 PolarHBondContact O-N 3.49Å; L582-G586 VanDerWaalsContact O-N 3.1Å
583	L	47.7	Very low	45.1	Very low	101 Å²	101	123.2 Å²	123.2	53%	0.529	63%	0.629	S	S	.	*	H	α-helix	trans	-76.4	-51.2	173.9	-77	166.5	0	0	0	111.3	H579 K580 R585 G586 E587	H579-L583 WeakPolarHBondContact O-CD1 3.43Å; H579-L583 WeakPolarHBondContact O-CG 3.23Å; H579-L583 PolarHBondContact O-N 2.89Å; K580-L583 PolarHBondContact O-N 3.37Å; L583-R585 VanDerWaalsContact C-N 3.33Å; L583-R585 PolarHBondContact O-N 3.31Å; L583-G586 WeakPolarHBondContact O-CA 3.22Å; L583-G586 PolarHBondContact O-N 3.34Å; L583-E587 PolarHBondContact O-N 3.21Å
584	I	46.7	Very low	43.9	Very low	116 Å²	116	123.5 Å²	123.5	60%	0.595	64%	0.643	S	S	*	*	H	α-helix	trans	-65.2	-37.4	-179.4	-62.4	169.6	0	0	0	111.1	K580 G586	K580-I584 WeakPolarHBondContact O-CG1 3.09Å; K580-I584 PolarHBondContact O-N 2.77Å; I584-G586 PolarHBondContact O-N 2.97Å
585	R	39.2	Very low	42.6	Very low	198 Å²	198	123.4 Å²	123.4	75%	0.747	65%	0.652	S	S	*	*	H	α-helix	trans	-83.8	2.6	172.2	-152.4	176	-168.8	156.6	6	113.5	T581 L583 A589	T581-R585 WeakPolarHBondContact O-CB 3.45Å; T581-R585 PolarHBondContact O-N 3.3Å; L583-R585 VanDerWaalsContact C-N 3.33Å; L583-R585 PolarHBondContact O-N 3.31Å; R585-A589 VanDerWaalsContact O-CB 3.23Å; R585-A589 WeakPolarHBondContact O-CB 3.07Å
586	G	36.4	Very low	41.4	Very low	29 Å²	29	119.9 Å²	119.9	30%	0.299	64%	0.643	S	S	.	*	H	α-helix	trans	-88	-39.8	174.3	0	0	0	0	0	111.9	L582 L583 I584 A589 L590	L582-G586 WeakPolarHBondContact O-CA 3.35Å; L582-G586 PolarHBondContact O-N 3.49Å; L582-G586 VanDerWaalsContact O-N 3.1Å; L583-G586 WeakPolarHBondContact O-CA 3.22Å; L583-G586 PolarHBondContact O-N 3.34Å; I584-G586 PolarHBondContact O-N 2.97Å; G586-A589 PolarHBondContact O-N 2.96Å; G586-L590 PolarHBondContact O-N 3.09Å
587	E	41.1	Very low	40.3	Very low	154 Å²	154	114.8 Å²	114.8	72%	0.72	63%	0.631	S	S	*	*	H	α-helix	trans	-75.2	-44.3	-177	-65.6	179.7	131.4	0	0	112	L583 A589 L590	L583-E587 PolarHBondContact O-N 3.21Å; E587-A589 PolarHBondContact O-N 2.95Å; E587-L590 PolarHBondContact O-N 2.73Å
588	D	37.5	Very low	39.4	Very low	148 Å²	148	115.5 Å²	115.5	79%	0.791	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-10	173.8	-73.6	-29.4	0	0	0	114.1
589	A	38.1	Very low	38.3	Very low	63 Å²	63	121 Å²	121	52%	0.521	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.4	-7.5	-179.9	0	0	0	0	0	114.1	R585 G586 E587	R585-A589 VanDerWaalsContact O-CB 3.23Å; R585-A589 WeakPolarHBondContact O-CB 3.07Å; G586-A589 PolarHBondContact O-N 2.96Å; E587-A589 PolarHBondContact O-N 2.95Å
590	L	34	Very low	37.6	Very low	134 Å²	134	119.5 Å²	119.5	70%	0.702	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-9.3	-171.1	-147.3	67.2	0	0	0	114.8	G586 E587 V592	G586-L590 PolarHBondContact O-N 3.09Å; E587-L590 PolarHBondContact O-N 2.73Å; L590-V592 VanDerWaalsContact C-N 3.33Å; L590-V592 PolarHBondContact O-N 2.8Å
591	N	32.6	Very low	36.9	Very low	155 Å²	155	119.5 Å²	119.5	83%	0.829	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	12.7	178.2	-82.1	-28.2	0	0	0	114.7
592	V	32.9	Very low	36.3	Very low	130 Å²	130	118.7 Å²	118.7	79%	0.788	67%	0.668	S	S	*	*	S	Bend	trans	-132.3	47.2	177.8	-162.6	0	0	0	0	111.2	L590	L590-V592 VanDerWaalsContact C-N 3.33Å; L590-V592 PolarHBondContact O-N 2.8Å
593	C	26.5	Very low	35.6	Very low	114 Å²	114	119.9 Å²	119.9	77%	0.77	68%	0.675	S	S	*	*	S	Bend	trans	-156.5	30.4	177.4	-120.1	0	0	0	0	117
594	T	33.9	Very low	34.9	Very low	119 Å²	119	121.7 Å²	121.7	73%	0.73	69%	0.69	S	S	*	*			trans	-145.3	144.3	172	46.3	0	0	0	0	112.1
595	T	33.8	Very low	34.2	Very low	128 Å²	128	122.6 Å²	122.6	79%	0.785	70%	0.696	S	S	*	*			trans	60.8	140.7	-176.5	73.3	0	0	0	0	115.4
596	T	34	Very low	33.9	Very low	76 Å²	76	120.4 Å²	120.4	47%	0.466	70%	0.698	S	S	.	*			cis	-152.4	160.2	-24.5	22.9	0	0	0	0	105.1	G859 C861	T596-G859 CarbonylContact C-O 3.41Å; T596-G859 WeakPolarHBondContact CB-O 3.29Å; T596-G859 PolarHBondContact OG1-O 2.7Å; T596-C861 PolarHBondContact OG1-N 2.71Å
597	G	33.1	Very low	33.6	Very low	44 Å²	44	126.6 Å²	126.6	45%	0.454	72%	0.723	S	S	.	*			cis	129.9	116.6	8.4	0	0	0	0	0	109.9	G859	G597-G859 VanDerWaalsContact O-CA 3.24Å; G597-G859 WeakPolarHBondContact O-CA 3.3Å
598	L	34.4	Very low	33.2	Very low	150 Å²	150	122.8 Å²	122.8	79%	0.785	73%	0.725	S	S	*	*			trans	95.4	163.2	-175.3	-55.2	162	0	0	0	116
599	R	30.4	Very low	33.2	Very low	203 Å²	203	122 Å²	122	77%	0.766	73%	0.731	S	S	*	*				-167.7	150.8	-51.1	-169.9	173.4	177.5	-171.7	-1.1	111.7
600	S	34.2	Very low	33.1	Very low	91 Å²	91	122.7 Å²	122.7	64%	0.636	74%	0.744	S	S	*	*			trans	82	145.9	157.6	-131.7	0	0	0	0	117.9
601	N	35.3	Very low	33.1	Very low	151 Å²	151	120.2 Å²	120.2	81%	0.807	75%	0.751	S	S	*	*			cis	-171.2	158.4	-30.1	-108.6	14.5	0	0	0	109.5
602	G	33.5	Very low	33.3	Very low	63 Å²	63	121.1 Å²	121.1	65%	0.649	76%	0.756	S	S	*	*			trans	86.6	117.2	166.2	0	0	0	0	0	114.5
603	D	32.8	Very low	33.3	Very low	150 Å²	150	117.9 Å²	117.9	80%	0.802	75%	0.749	S	S	*	*			cis	91.5	115.3	41.3	-70.9	-50.2	0	0	0	114.7
604	V	32.3	Very low	33.7	Very low	140 Å²	140	116 Å²	116	85%	0.848	75%	0.749	S	S	*	*				-177.1	142.2	119.1	148.5	0	0	0	0	110
605	N	31.6	Very low	33.3	Very low	135 Å²	135	121.7 Å²	121.7	72%	0.722	76%	0.759	S	S	*	*			trans	-109.7	165.2	-177.6	-68.5	-72.5	0	0	0	112.6
606	L	32.5	Very low	33.2	Very low	152 Å²	152	120.5 Å²	120.5	80%	0.796	76%	0.762	S	S	*	*			trans	-176.6	112.5	139.6	-89.6	138.3	0	0	0	107.7
607	I	31	Very low	32.9	Very low	159 Å²	159	123.2 Å²	123.2	82%	0.815	78%	0.779	S	S	*	*				70.4	132.2	78.8	-65.8	162.8	0	0	0	112.3
608	G	33.7	Very low	32.6	Very low	74 Å²	74	126.1 Å²	126.1	76%	0.763	79%	0.788	S	S	*	*			cis	-178.3	-163.7	1.5	0	0	0	0	0	109.1
609	S	35.9	Very low	32.3	Very low	131 Å²	131	127.5 Å²	127.5	92%	0.916	78%	0.782	S	S	*	*			cis	-170.1	161.6	-10.5	-166.6	0	0	0	0	110.6
610	G	35.8	Very low	32.3	Very low	77 Å²	77	123.8 Å²	123.8	79%	0.794	78%	0.784	S	S	*	*			trans	86.9	142.4	171.1	0	0	0	0	0	116.8
611	G	35.6	Very low	32	Very low	82 Å²	82	126.2 Å²	126.2	85%	0.845	79%	0.79	S	S	*	*			cis	116.4	134.3	2	0	0	0	0	0	112.4
612	D	36.4	Very low	31.8	Very low	174 Å²	174	127.8 Å²	127.8	93%	0.93	80%	0.795	S	S	*	*			cis	-143	-151.7	-3.6	-162.8	31.5	0	0	0	108.2
613	G	33.5	Very low	31.4	Very low	62 Å²	62	133.9 Å²	133.9	64%	0.639	80%	0.8	S	S	*	*			cis	172.6	163.6	5.4	0	0	0	0	0	111.5
614	G	33.1	Very low	31.5	Very low	76 Å²	76	132.7 Å²	132.7	78%	0.784	80%	0.8	S	S	*	*			trans	132.5	129.8	170.8	0	0	0	0	0	117.6
615	Y	27.1	Very low	31.2	Very low	237 Å²	237	134.3 Å²	134.3	93%	0.929	80%	0.796	S	S	*	*			trans	-95.4	144.7	-166.9	-69	-101.2	0	0	0	116.4
616	A	31.2	Very low	31.2	Very low	103 Å²	103	135.4 Å²	135.4	85%	0.851	80%	0.801	S	S	*	*			trans	-164.8	141.5	143.3	0	0	0	0	0	111.5
617	T	26.7	Very low	31	Very low	134 Å²	134	135 Å²	135	82%	0.822	80%	0.799	S	S	*	*			trans	-100.3	172.6	-171.8	50.5	0	0	0	0	114.9
618	V	27.2	Very low	30.8	Very low	105 Å²	105	133.1 Å²	133.1	64%	0.636	80%	0.8	S	S	*	*			trans	122.2	124.8	150.8	177.6	0	0	0	0	117.3
619	R	27.5	Very low	30.6	Very low	179 Å²	179	134.6 Å²	134.6	68%	0.675	81%	0.805	S	S	*	*			trans	75.1	121.1	169.6	-75.7	171.7	-164.1	-171.4	5.8	118.9	C781	R619-C781 PolarHBondContact NH2-SG 3.11Å
620	P	30.8	Very low	30.3	Very low	124 Å²	124	132.9 Å²	132.9	81%	0.805	80%	0.799	S	S	*	*			trans	-82.1	127.2	165.3	33.1	-31.1	0	0	0	111.5
621	N	29	Very low	30	Very low	143 Å²	143	139.2 Å²	139.2	77%	0.765	80%	0.804	S	S	*	*			trans	-108.5	109	156	-85.1	14.1	0	0	0	106.5	Y623	N621-Y623 PolarHBondContact O-N 3.31Å
622	M	29.8	Very low	29.8	Very low	184 Å²	184	140 Å²	140	91%	0.906	80%	0.795	S	S	*	*			trans	-92.5	86.8	-175.2	-168.7	167.1	177.7	0	0	111.6
623	Y	25.6	Very low	29.4	Very low	190 Å²	190	139.5 Å²	139.5	75%	0.745	79%	0.787	S	S	*	*			trans	-83.8	132.2	156.1	-77.4	-94.5	0	0	0	108.9	N621 F625	N621-Y623 PolarHBondContact O-N 3.31Å; Y623-F625 PolarHBondContact O-N 3.46Å
624	P	34.3	Very low	29	Very low	126 Å²	126	141.4 Å²	141.4	82%	0.818	78%	0.781	S	S	*	*			trans	-85.8	92.1	157	32.1	-27.8	0	0	0	109.3
625	F	27.5	Very low	28.8	Very low	174 Å²	174	141 Å²	141	76%	0.763	78%	0.777	S	S	*	*			trans	-107.6	97.9	166.4	-144.7	-69	0	0	0	107	Y623	Y623-F625 PolarHBondContact O-N 3.46Å
626	L	30.3	Very low	28.7	Very low	158 Å²	158	136.2 Å²	136.2	83%	0.827	77%	0.772	S	S	*	*			trans	-145.4	112.9	164.8	-77.7	179.2	0	0	0	106.6
627	L	30.1	Very low	28.5	Very low	143 Å²	143	136.3 Å²	136.3	75%	0.749	77%	0.766	S	S	*	*				72.4	141.5	74.9	-98.8	77.5	0	0	0	114.3
628	S	25.5	Very low	28.4	Very low	119 Å²	119	135.4 Å²	135.4	83%	0.832	76%	0.761	S	S	*	*			trans	-77.6	144.5	-172.2	46.1	0	0	0	0	113.8
629	A	29.5	Very low	28.4	Very low	106 Å²	106	137 Å²	137	88%	0.876	77%	0.77	S	S	*	*			trans	-136.7	133.8	149.2	0	0	0	0	0	107.4
630	A	30.7	Very low	28.3	Very low	94 Å²	94	134 Å²	134	78%	0.777	77%	0.767	S	S	*	*			trans	-112.4	144.2	-179.1	0	0	0	0	0	110.7
631	K	28.3	Very low	28.3	Very low	210 Å²	210	134 Å²	134	91%	0.913	77%	0.767	S	S	*	*			trans	-170.6	161.5	130.7	-103.4	167.3	-178	-174.5	0	111.3
632	P	31.3	Very low	28.3	Very low	99 Å²	99	133.4 Å²	133.4	64%	0.643	76%	0.764	S	S	*	*			trans	-104.7	169.6	-166.8	38.6	-31	0	0	0	113.3
633	E	28.3	Very low	28.2	Very low	163 Å²	163	128.5 Å²	128.5	76%	0.762	76%	0.761	S	S	*	*				-175.4	142	109	-97.9	178.6	-169.8	0	0	114
634	I	26	Very low	28.1	Very low	103 Å²	103	123.1 Å²	123.1	53%	0.528	76%	0.763	S	S	.	*			trans	35.5	91.4	144.9	-48	177	0	0	0	117.7	Y924	I634-Y924 HydrophobicContact CD1-CD2 4.46Å; I634-Y924 HydrophobicContact CD1-CE2 4.04Å; I634-Y924 HydrophobicContact CG1-CE2 3.76Å
635	G	28.5	Very low	27.8	Very low	67 Å²	67	123.1 Å²	123.1	69%	0.691	76%	0.755	S	S	*	*			trans	-129.5	115.9	155.8	0	0	0	0	0	109.8	S637	G635-S637 PolarHBondContact O-N 3.01Å
636	V	24.6	Very low	27.8	Very low	137 Å²	137	122.4 Å²	122.4	83%	0.83	76%	0.755	S	S	*	*			trans	-78	104.8	179.5	178.7	0	0	0	0	109.3
637	S	27.5	Very low	27.7	Very low	104 Å²	104	118.8 Å²	118.8	73%	0.727	74%	0.743	S	S	*	*			trans	-111.2	105.2	172.2	-65.9	0	0	0	0	110.9	G635 V639	G635-S637 PolarHBondContact O-N 3.01Å; S637-V639 PolarHBondContact O-N 3.41Å; S637-V639 VanDerWaalsContact O-N 3.14Å
638	T	24.8	Very low	27.5	Very low	116 Å²	116	122.2 Å²	122.2	71%	0.712	75%	0.747	S	S	*	*			trans	-66	105.5	167	47.3	0	0	0	0	109.5	L640	T638-L640 PolarHBondContact O-N 2.98Å
639	V	27	Very low	27.7	Very low	137 Å²	137	121.5 Å²	121.5	83%	0.83	73%	0.73	S	S	*	*			trans	-75.9	85.7	179.1	-175.7	0	0	0	0	110	S637	S637-V639 PolarHBondContact O-N 3.41Å; S637-V639 VanDerWaalsContact O-N 3.14Å
640	L	25.8	Very low	27.5	Very low	116 Å²	116	124.1 Å²	124.1	61%	0.607	72%	0.724	S	S	*	*			trans	-76.9	134.9	157.7	-87.8	79.8	0	0	0	109	T638 N642	T638-L640 PolarHBondContact O-N 2.98Å; L640-N642 PolarHBondContact O-N 3.01Å
641	P	29	Very low	27.3	Very low	124 Å²	124	126 Å²	126	81%	0.805	72%	0.72	S	S	*	*			trans	-76.2	74	172.5	32.4	-34.6	0	0	0	110.7	G643	P641-G643 PolarHBondContact O-N 3.28Å; P641-G643 VanDerWaalsContact O-N 3.09Å
642	N	31.1	Very low	27.1	Very low	131 Å²	131	121.3 Å²	121.3	70%	0.701	71%	0.708	S	S	*	*			trans	-74.9	96.8	175.8	-79.6	-8.9	0	0	0	110.8	L640	L640-N642 PolarHBondContact O-N 3.01Å
643	G	26.4	Very low	26.9	Very low	81 Å²	81	123.7 Å²	123.7	84%	0.835	72%	0.715	S	S	*	*	S	Bend	trans	-161.4	17.3	177.3	0	0	0	0	0	115.2	P641	P641-G643 PolarHBondContact O-N 3.28Å; P641-G643 VanDerWaalsContact O-N 3.09Å
644	G	24.7	Very low	26.7	Very low	77 Å²	77	121.4 Å²	121.4	79%	0.794	72%	0.717	S	S	*	*	S	Bend	trans	-176.7	55.4	-172.7	0	0	0	0	0	114.1
645	L	27.3	Very low	26.8	Very low	126 Å²	126	121.9 Å²	121.9	66%	0.66	73%	0.729	S	S	*	*			trans	-131.7	96.5	-176.4	-99.3	164.6	0	0	0	112.9
646	Q	27.3	Very low	26.7	Very low	160 Å²	160	125.6 Å²	125.6	75%	0.748	73%	0.734	S	S	*	*			trans	-125.4	79.7	146.9	-80.3	-161.3	0.6	0	0	109.6
647	S	27.2	Very low	26.9	Very low	82 Å²	82	125.3 Å²	125.3	57%	0.573	73%	0.733	S	S	*	*			trans	-82.7	104.8	159.6	51.2	0	0	0	0	108.8
648	Y	27.3	Very low	27	Very low	215 Å²	215	124.1 Å²	124.1	84%	0.843	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-72.4	147	167.3	-105.7	-86.3	0	0	0	110.6
649	H	29	Very low	27.2	Very low	104 Å²	104	122.8 Å²	122.8	48%	0.481	72%	0.716	S	S	.	*	P	Polyproline II helix	trans	-77.8	131.6	-163.7	-102.4	-95.8	0	0	0	114.6	I651 L901	H649-I651 PolarHBondContact O-N 3.46Å; H649-L901 WeakPolarHBondContact NE2-CG 3.44Å
650	Q	25.4	Very low	27.4	Very low	161 Å²	161	123 Å²	123	75%	0.752	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-60.9	125	153.8	-177.4	-178.8	17.4	0	0	109	V652	Q650-V652 HydrophobicContact CG-CG2 4.08Å
651	I	27.5	Very low	27.7	Very low	133 Å²	133	122.4 Å²	122.4	68%	0.682	71%	0.714	S	S	*	*			trans	-122.6	92	164.7	-59.9	-177.9	0	0	0	107.7	H649 L653	H649-I651 PolarHBondContact O-N 3.46Å; I651-L653 HydrophobicContact CG2-CB 3.99Å; I651-L653 HydrophobicContact CG2-CD1 3.95Å; I651-L653 HydrophobicContact CG2-CG 3.95Å; I651-L653 PolarHBondContact O-N 3.37Å
652	V	23.5	Very low	28.2	Very low	111 Å²	111	121.5 Å²	121.5	67%	0.673	71%	0.708	S	S	*	*			trans	-86	97.2	159.8	177.2	0	0	0	0	106.6	Q650	Q650-V652 HydrophobicContact CG-CG2 4.08Å
653	L	27.6	Very low	28.3	Very low	149 Å²	149	122.3 Å²	122.3	78%	0.78	71%	0.712	S	S	*	*			trans	-135.1	98.9	168.7	-79.2	178.3	0	0	0	109.6	I651	I651-L653 HydrophobicContact CG2-CB 3.99Å; I651-L653 HydrophobicContact CG2-CD1 3.95Å; I651-L653 HydrophobicContact CG2-CG 3.95Å; I651-L653 PolarHBondContact O-N 3.37Å
654	S	23	Very low	28.6	Very low	116 Å²	116	123.2 Å²	123.2	81%	0.811	71%	0.705	S	S	*	*			trans	-76.8	128.6	164.6	43.5	0	0	0	0	110.1
655	S	29.3	Very low	29	Very low	112 Å²	112	125.2 Å²	125.2	78%	0.783	70%	0.702	S	S	*	*			trans	-155.1	120.2	163.8	59.2	0	0	0	0	111
656	N	26.1	Very low	29.2	Very low	146 Å²	146	124 Å²	124	78%	0.781	70%	0.704	S	S	*	*			trans	-61.4	152.4	-179.9	-51.7	-33.3	0	0	0	112.8
657	T	28.6	Very low	29.6	Very low	131 Å²	131	122.3 Å²	122.3	80%	0.804	70%	0.7	S	S	*	*				-167	152.5	116.2	15.3	0	0	0	0	110.1	L986	T657-L986 HydrophobicContact CG2-CD1 4.35Å
658	S	29	Very low	29.8	Very low	79 Å²	79	124.6 Å²	124.6	55%	0.552	70%	0.702	S	S	*	*			trans	-128.2	-157	-170.6	60.4	0	0	0	0	111.7
659	T	29.6	Very low	30.1	Very low	88 Å²	88	121.3 Å²	121.3	54%	0.54	69%	0.692	S	S	.	*			trans	86.8	139.3	174.5	60.2	0	0	0	0	119.3	L986	T659-L986 HydrophobicContact CG2-CD2 3.56Å; T659-L986 WeakPolarHBondContact CG2-O 3.04Å
660	E	31.6	Very low	30.4	Very low	141 Å²	141	123.3 Å²	123.3	66%	0.659	71%	0.706	S	S	*	*			cis	-172.1	-175	-29	-134.6	-178.5	-165.4	0	0	112.1
661	S	32.4	Very low	30.7	Very low	104 Å²	104	120 Å²	120	73%	0.727	70%	0.7	S	S	*	*			trans	105.8	149.5	143.6	88.2	0	0	0	0	117.2
662	P	39	Very low	31	Very low	105 Å²	105	117.6 Å²	117.6	68%	0.682	70%	0.696	S	S	*	*				-146.4	-161.2	-97.6	37.8	-14.3	0	0	0	115.3
663	N	33.5	Very low	31.4	Very low	147 Å²	147	120 Å²	120	79%	0.786	70%	0.7	S	S	*	*			trans	122.8	140.9	158.5	-64	-26.7	0	0	0	112.7
664	S	31.8	Very low	31.7	Very low	100 Å²	100	119.2 Å²	119.2	70%	0.699	69%	0.692	S	S	*	*			cis	-179.8	139.9	-13.2	49.6	0	0	0	0	107.4
665	V	32.6	Very low	32.1	Very low	120 Å²	120	121.6 Å²	121.6	73%	0.727	69%	0.69	S	S	*	*				166.8	131.9	88.6	158.7	0	0	0	0	109.7
666	S	32.7	Very low	32.3	Very low	99 Å²	99	120.6 Å²	120.6	69%	0.692	69%	0.688	S	S	*	*			trans	46.8	159.1	145.7	97.1	0	0	0	0	123.3
667	N	34.5	Very low	32.6	Very low	125 Å²	125	121.7 Å²	121.7	67%	0.668	69%	0.689	S	S	*	*			cis	-163.3	144.6	3.3	-130.7	12.3	0	0	0	114.4
668	E	32.4	Very low	32.6	Very low	131 Å²	131	121.7 Å²	121.7	61%	0.612	68%	0.683	S	S	*	*			trans	58.1	153.7	141.4	-67.4	-171.9	147.5	0	0	123
669	K	33.6	Very low	32.4	Very low	146 Å²	146	127.7 Å²	127.7	64%	0.635	69%	0.694	S	S	*	*			cis	-162.9	141.1	4.9	-124.1	161.3	-173.7	145.6	0	114
670	N	35.5	Very low	32.4	Very low	145 Å²	145	131.5 Å²	131.5	78%	0.775	71%	0.705	S	S	*	*			trans	43.6	155.6	138.4	-64	10.4	0	0	0	124.5
671	S	32	Very low	32.2	Very low	91 Å²	91	130.1 Å²	130.1	64%	0.636	71%	0.707	S	S	*	*			cis	-176.6	177.8	-19.8	58.8	0	0	0	0	112.2
672	S	31.9	Very low	31.9	Very low	84 Å²	84	129.7 Å²	129.7	59%	0.587	70%	0.704	S	S	*	*			trans	72.5	161.8	158.1	21	0	0	0	0	118
673	Q	33.9	Very low	31.5	Very low	161 Å²	161	133 Å²	133	75%	0.752	71%	0.71	S	S	*	*			cis	-176.4	164.7	-14.5	-103.2	174.7	-67.6	0	0	108.7
674	Q	33.5	Very low	31.2	Very low	133 Å²	133	129.9 Å²	129.9	62%	0.621	70%	0.7	S	S	*	*			cis	-171.6	129.4	-20.2	-156.6	-178.6	-59.7	0	0	113.6
675	Q	31.8	Very low	31.2	Very low	166 Å²	166	132.3 Å²	132.3	78%	0.776	71%	0.705	S	S	*	*			trans	65.4	160.2	144.5	-80.7	174.4	-20.3	0	0	126.5
676	A	32.5	Very low	31.1	Very low	90 Å²	90	133.2 Å²	133.2	74%	0.744	71%	0.711	S	S	*	*			trans	80.1	145.3	161.5	0	0	0	0	0	118.7
677	Q	33.1	Very low	30.8	Very low	169 Å²	169	131.6 Å²	131.6	79%	0.79	71%	0.71	S	S	*	*			cis	-160.8	155.8	-9.7	-118.8	176.9	-3.2	0	0	112.6
678	L	27.3	Very low	30.4	Very low	131 Å²	131	134.1 Å²	134.1	69%	0.686	72%	0.72	S	S	*	*			trans	18.7	149	136.2	-65.1	174.2	0	0	0	121
679	R	25.3	Very low	30.3	Very low	206 Å²	206	135.1 Å²	135.1	78%	0.777	73%	0.727	S	S	*	*			cis	-179.4	179.4	-6.9	-163.7	-174.3	-142.3	171.6	4.2	107.9
680	Q	29.7	Very low	30	Very low	167 Å²	167	135.4 Å²	135.4	78%	0.78	73%	0.734	S	S	*	*			trans	75.5	149.6	162.2	-59.6	-179.9	-42.3	0	0	116.7
681	T	27.9	Very low	29.5	Very low	112 Å²	112	131.8 Å²	131.8	69%	0.687	73%	0.732	S	S	*	*			cis	-164.2	161.1	-15	21.3	0	0	0	0	110
682	S	26.5	Very low	29.5	Very low	96 Å²	96	135.9 Å²	135.9	67%	0.671	74%	0.741	S	S	*	*			trans	64	149	146.4	55.9	0	0	0	0	119.9
683	Q	30.5	Very low	29.4	Very low	174 Å²	174	140 Å²	140	81%	0.813	75%	0.75	S	S	*	*			cis	-158.4	143.5	-5	-122.1	165	-20.1	0	0	113.4
684	S	27.4	Very low	29.2	Very low	82 Å²	82	137.4 Å²	137.4	57%	0.573	75%	0.751	S	S	*	*			trans	21.5	139.5	141.4	60.7	0	0	0	0	123.9
685	N	30.4	Very low	28.8	Very low	151 Å²	151	137.5 Å²	137.5	81%	0.807	76%	0.755	S	S	*	*				-155.9	126.5	109	-85.5	-31.3	0	0	0	108.4
686	V	30.4	Very low	28.7	Very low	138 Å²	138	136.4 Å²	136.4	84%	0.836	76%	0.76	S	S	*	*				77.8	129	62.1	172.3	0	0	0	0	111.7
687	G	28	Very low	28.4	Very low	65 Å²	65	138.3 Å²	138.3	67%	0.67	76%	0.757	S	S	*	*			cis	-158.9	162.3	-3.5	0	0	0	0	0	108.8
688	M	25.1	Very low	28.1	Very low	179 Å²	179	135.8 Å²	135.8	88%	0.882	75%	0.752	S	S	*	*				69.4	145.5	58.5	-144	-155.1	-58.5	0	0	115.7
689	I	29.8	Very low	28	Very low	151 Å²	151	136.8 Å²	136.8	77%	0.774	76%	0.758	S	S	*	*			trans	108.3	94.1	-179.9	-61.8	163.7	0	0	0	112.1
690	I	27.1	Very low	28	Very low	152 Å²	152	137.7 Å²	137.7	78%	0.779	76%	0.762	S	S	*	*				94	96.7	71.4	-69.7	159.9	0	0	0	114.1
691	G	25.5	Very low	27.8	Very low	70 Å²	70	137.9 Å²	137.9	72%	0.722	77%	0.767	S	S	*	*				57.6	125.8	124.8	0	0	0	0	0	123.7
692	Q	31.1	Very low	27.7	Very low	176 Å²	176	138 Å²	138	82%	0.822	77%	0.773	S	S	*	*			trans	-166.3	151.8	139.7	-112.5	174	48.3	0	0	112.5
693	Q	31.2	Very low	27.7	Very low	170 Å²	170	136.5 Å²	136.5	79%	0.794	77%	0.773	S	S	*	*			trans	62.1	123.7	169.1	-57.7	173.6	19.1	0	0	116.6
694	S	28.9	Very low	27.4	Very low	108 Å²	108	134.7 Å²	134.7	76%	0.755	77%	0.769	S	S	*	*			cis	95.2	108.2	18.4	-49	0	0	0	0	116.7
695	N	26.1	Very low	27.3	Very low	134 Å²	134	138 Å²	138	72%	0.717	79%	0.785	S	S	*	*			trans	77.6	70.2	150	-62.8	-2.8	0	0	0	121.9	I697	N695-I697 HydrophobicContact CB-CD1 3.88Å; N695-I697 HydrophobicContact CB-CG1 4.36Å
696	T	29.7	Very low	27.3	Very low	144 Å²	144	136.4 Å²	136.4	88%	0.883	78%	0.775	S	S	*	*			trans	-148.2	87.8	146	34.5	0	0	0	0	108.3
697	I	26.4	Very low	27.1	Very low	130 Å²	130	132.4 Å²	132.4	67%	0.667	76%	0.763	S	S	*	*				60.9	121.1	53.8	-35.7	177.3	0	0	0	113.6	N695	N695-I697 HydrophobicContact CB-CD1 3.88Å; N695-I697 HydrophobicContact CB-CG1 4.36Å
698	V	25.6	Very low	27	Very low	115 Å²	115	134.7 Å²	134.7	70%	0.697	77%	0.766	S	S	*	*			trans	78.5	108.2	171.4	-165.3	0	0	0	0	118.3
699	N	25	Very low	27	Very low	153 Å²	153	130.9 Å²	130.9	82%	0.818	76%	0.757	S	S	*	*			trans	65.3	143.5	162.1	-57.9	-19.7	0	0	0	117.2
700	R	26.7	Very low	27	Very low	225 Å²	225	130.3 Å²	130.3	85%	0.849	76%	0.755	S	S	*	*			cis	-124.9	139.6	14.3	-60.3	174	-178.6	164.1	0.7	112.5
701	L	25.1	Very low	26.8	Very low	170 Å²	170	126 Å²	126	89%	0.89	75%	0.748	S	S	*	*	S	Bend	trans	-86.7	150.9	146.4	-78.1	162.9	0	0	0	108.2
702	S	24.7	Very low	26.8	Very low	115 Å²	115	129.4 Å²	129.4	80%	0.804	75%	0.754	S	S	*	*			trans	65.5	129.6	-166.8	74.1	0	0	0	0	114.8
703	G	26.4	Very low	26.5	Very low	65 Å²	65	125.4 Å²	125.4	67%	0.67	74%	0.742	S	S	*	*			trans	161.7	108.9	-177.8	0	0	0	0	0	112
704	D	24.3	Very low	26.2	Very low	136 Å²	136	122.4 Å²	122.4	73%	0.727	74%	0.74	S	S	*	*			trans	21.5	117.9	146.9	-45.7	-39.1	0	0	0	119	I706	D704-I706 HydrophobicContact CB-CG1 3.88Å; D704-I706 PolarHBondContact O-N 2.97Å
705	T	26.8	Very low	26.1	Very low	151 Å²	151	124.8 Å²	124.8	93%	0.926	74%	0.739	S	S	*	*			trans	-70.8	84.6	151.8	50.2	0	0	0	0	108.7	G707	T705-G707 PolarHBondContact O-N 3.06Å
706	I	28.5	Very low	26.3	Very low	117 Å²	117	125 Å²	125	60%	0.6	75%	0.746	S	S	*	*			trans	-59.7	106	174.1	-65.7	169.5	0	0	0	108.3	D704	D704-I706 HydrophobicContact CB-CG1 3.88Å; D704-I706 PolarHBondContact O-N 2.97Å
707	G	26.1	Very low	26.7	Very low	55 Å²	55	123 Å²	123	57%	0.567	73%	0.726	S	S	*	*			trans	-61.8	149.8	154.7	0	0	0	0	0	108.7	T705 S709	T705-G707 PolarHBondContact O-N 3.06Å; G707-S709 PolarHBondContact O-N 3.12Å
708	P	27.4	Very low	27.1	Very low	113 Å²	113	119.6 Å²	119.6	73%	0.734	72%	0.718	S	S	*	*			trans	-48.6	109	-159.5	18.5	-32.7	0	0	0	112.2	D710	P708-D710 PolarHBondContact O-N 3.21Å
709	S	24.7	Very low	28.4	Very low	99 Å²	99	117.1 Å²	117.1	69%	0.692	70%	0.698	S	S	*	*			trans	-83.1	51.1	176.2	64.1	0	0	0	0	110.2	G707	G707-S709 PolarHBondContact O-N 3.12Å
710	D	28.9	Very low	30	Very low	138 Å²	138	110.3 Å²	110.3	74%	0.738	66%	0.662	S	S	*	*			trans	-67.1	150.5	164.2	-67.3	-50.6	0	0	0	108.6	P708	P708-D710 PolarHBondContact O-N 3.21Å
711	G	24	Very low	31	Very low	61 Å²	61	102.9 Å²	102.9	63%	0.629	64%	0.639	S	S	*	*			trans	-60.4	146	-159.5	0	0	0	0	0	114.2	T713	G711-T713 PolarHBondContact O-N 2.92Å
712	V	25.2	Very low	31.7	Very low	142 Å²	142	101.2 Å²	101.2	86%	0.861	63%	0.631	S	S	*	*			trans	-73.8	66.3	164.5	-173	0	0	0	0	108.9
713	T	25.4	Very low	32.3	Very low	92 Å²	92	100.2 Å²	100.2	56%	0.564	62%	0.616	S	S	*	*			trans	-84	142.1	156.4	48.3	0	0	0	0	108	G711 E715	G711-T713 PolarHBondContact O-N 2.92Å; T713-E715 PolarHBondContact O-N 3.24Å; T713-E715 PolarHBondContact OG1-OE1 3.2Å
714	S	24.6	Very low	32.5	Very low	108 Å²	108	103 Å²	103	76%	0.755	62%	0.616	S	S	*	*			trans	-80.3	53.6	-176.3	63.3	0	0	0	0	111.9
715	E	26.7	Very low	32.8	Very low	157 Å²	157	102.8 Å²	102.8	73%	0.734	62%	0.615	S	S	*	*			trans	-82	139.4	175.8	-68.8	179.2	-148.3	0	0	109.7	T713 E717	T713-E715 PolarHBondContact O-N 3.24Å; T713-E715 PolarHBondContact OG1-OE1 3.2Å; E715-E717 PolarHBondContact O-N 3.35Å; E715-E717 VanDerWaalsContact O-N 3.1Å
716	T	29	Very low	32.9	Very low	139 Å²	139	104.5 Å²	104.5	85%	0.853	61%	0.61	S	S	*	*			trans	-70.1	107.3	-173.1	46.8	0	0	0	0	110.4	A718	T716-A718 PolarHBondContact O-N 3.32Å
717	E	38.3	Very low	33	Very low	102 Å²	102	106.9 Å²	106.9	48%	0.477	62%	0.618	S	S	.	*			trans	-50.5	128	161.8	-79.9	-157.8	132.4	0	0	108.1	R207 E715 F719	R207-E717 IonicContact CZ-OE1 3.03Å; R207-E717 IonicContact NE-OE1 3.37Å; R207-E717 IonicContact NH2-OE1 3.85Å; R207-E717 PolarHBondContact NH2-OE1 3.3Å; E715-E717 PolarHBondContact O-N 3.35Å; E715-E717 VanDerWaalsContact O-N 3.1Å; E717-F719 PolarHBondContact O-N 3.23Å
718	A	35.8	Very low	33	Very low	59 Å²	59	111 Å²	111	49%	0.488	63%	0.627	S	S	.	*			trans	-70	77.7	178.1	0	0	0	0	0	109.7	T716	T716-A718 PolarHBondContact O-N 3.32Å
719	F	53.1	Low	33.3	Very low	63 Å²	63	113.1 Å²	113.1	28%	0.276	63%	0.632	S	S	.	*			trans	-62.4	135.2	180	-147.8	-67.5	0	0	0	108.7	T196 S206 E717 D721	T196-F719 HydrophobicContact CG2-CE1 3.76Å; T196-F719 HydrophobicContact CG2-CZ 4.29Å; S206-F719 VanDerWaalsContact OG-CE2 3.22Å; S206-F719 WeakPolarHBondContact OG-CE2 3.49Å; S206-F719 WeakPolarHBondContact OG-CZ 3.46Å; E717-F719 PolarHBondContact O-N 3.23Å; F719-D721 HydrophobicContact CD1-CB 3.58Å; F719-D721 WeakPolarHBondContact CD1-OD2 2.94Å; F719-D721 HydrophobicContact CE1-CB 4.09Å; F719-D721 WeakPolarHBondContact CE1-OD1 3.12Å; F719-D721 WeakPolarHBondContact CE1-OD2 3.41Å; F719-D721 HydrophobicContact CG-CB 4.34Å; F719-D721 PolarHBondContact O-N 3.04Å
720	C	57.9	Low	33.5	Very low	9 Å²	9	115 Å²	115	6%	0.061	64%	0.635	C	S	.	*	S	Bend	trans	-62.3	0.4	177.6	-49.3	0	0	0	0	114.2	C146 Y182 R184 N722	C146-C720 HydrophobicContact CB-CB 3.39Å; C146-C720 WeakPolarHBondContact CB-SG 3.47Å; C146-C720 VanDerWaalsContact SG-CA 3.59Å; C146-C720 WeakPolarHBondContact SG-CB 3.19Å; C146-C720 CovalentContact SG-SG 2.04Å; C146-C720 PolarHBondContact SG-SG 3.1Å; Y182-C720 WeakPolarHBondContact CD2-SG 3.16Å; Y182-C720 VanDerWaalsContact CE2-SG 3.56Å; R184-C720 VanDerWaalsContact CZ-O 3.29Å; R184-C720 PolarHBondContact NH1-O 3.22Å; R184-C720 PolarHBondContact NH2-O 3.05Å; C720-N722 PolarHBondContact O-N 2.71Å; C720-N722 VanDerWaalsContact O-N 3.1Å
721	D	47.9	Very low	33.6	Very low	70 Å²	70	115.5 Å²	115.5	37%	0.374	64%	0.637	S	S	.	*			trans	-75.4	20.4	-178.5	-76.3	5.1	0	0	0	113.5	R184 T196 R198 F719 N723	R184-D721 IonicContact CZ-OD1 2.71Å; R184-D721 IonicContact NE-OD1 3.93Å; R184-D721 VanDerWaalsContact NH2-CA 3.27Å; R184-D721 IonicContact NH2-OD1 2.7Å; R184-D721 PolarHBondContact NH2-OD1 3.01Å; T196-D721 PolarHBondContact OG1-OD1 3.32Å; R198-D721 IonicContact NH2-OD2 3.06Å; F719-D721 HydrophobicContact CD1-CB 3.58Å; F719-D721 WeakPolarHBondContact CD1-OD2 2.94Å; F719-D721 HydrophobicContact CE1-CB 4.09Å; F719-D721 WeakPolarHBondContact CE1-OD1 3.12Å; F719-D721 WeakPolarHBondContact CE1-OD2 3.41Å; F719-D721 HydrophobicContact CG-CB 4.34Å; F719-D721 PolarHBondContact O-N 3.04Å; D721-N723 PolarHBondContact O-N 2.77Å
722	N	39.1	Very low	34	Very low	135 Å²	135	120.1 Å²	120.1	72%	0.722	65%	0.647	S	S	*	*			trans	-63.7	90.6	150.6	-83.8	-15	0	0	0	109	C720 N724	C720-N722 PolarHBondContact O-N 2.71Å; C720-N722 VanDerWaalsContact O-N 3.1Å; N722-N724 PolarHBondContact O-N 2.84Å
723	N	37.2	Very low	34.2	Very low	93 Å²	93	122 Å²	122	50%	0.497	65%	0.647	S	S	.	*			trans	-59.5	108.8	166.1	-102.1	0.8	0	0	0	108.4	N193 D721 N725	N193-N723 PolarHBondContact OD1-ND2 3.39Å; D721-N723 PolarHBondContact O-N 2.77Å; N723-N725 PolarHBondContact O-N 3.32Å
724	N	31.6	Very low	34.5	Very low	123 Å²	123	124.1 Å²	124.1	66%	0.658	66%	0.66	S	S	*	*			trans	-72.4	51.5	178.5	-93.3	-30.5	0	0	0	112.6	N722 K726	N722-N724 PolarHBondContact O-N 2.84Å; N724-K726 PolarHBondContact O-N 2.97Å
725	N	31.1	Very low	34.7	Very low	133 Å²	133	127.8 Å²	127.8	71%	0.711	66%	0.664	S	S	*	*			trans	-74.4	65.8	156.3	-78.7	0	0	0	0	108.7	N723 H727	N723-N725 PolarHBondContact O-N 3.32Å; N725-H727 PolarHBondContact O-N 2.9Å
726	K	27.9	Very low	35.1	Very low	187 Å²	187	124.3 Å²	124.3	81%	0.813	66%	0.656	S	S	*	*			trans	-68.5	79.1	157.7	-102.7	-172.5	172	-176.9	0	107.4	N724	N724-K726 PolarHBondContact O-N 2.97Å
727	H	30.3	Very low	35.1	Very low	166 Å²	166	125.6 Å²	125.6	77%	0.769	65%	0.652	S	S	*	*			trans	-66	139.2	158.8	-109.6	-72.1	0	0	0	108	N725 D729	N725-H727 PolarHBondContact O-N 2.9Å; H727-D729 PolarHBondContact O-N 3.3Å
728	N	26.9	Very low	34.7	Very low	141 Å²	141	127.7 Å²	127.7	75%	0.754	66%	0.661	S	S	*	*			trans	-72.6	96.9	177.8	-58.2	-16.9	0	0	0	109.3
729	D	33	Very low	34.2	Very low	159 Å²	159	134.3 Å²	134.3	85%	0.85	67%	0.674	S	S	*	*			trans	-107.9	97	153.1	-79.4	-48.9	0	0	0	106.6	H727	H727-D729 PolarHBondContact O-N 3.3Å
730	D	30.2	Very low	32.8	Very low	139 Å²	139	141.8 Å²	141.8	74%	0.743	70%	0.701	S	S	*	*			trans	-65.9	129.4	169.9	-61.9	-66.8	0	0	0	109.2
731	N	30.8	Very low	31.4	Very low	147 Å²	147	147.1 Å²	147.1	79%	0.786	74%	0.739	S	S	*	*				167.7	156.6	128.3	-86.5	-59.5	0	0	0	112.2
732	D	32.8	Very low	30.2	Very low	158 Å²	158	151.9 Å²	151.9	85%	0.845	76%	0.764	S	S	*	*			trans	63.9	115.7	168.7	-60.1	-17.5	0	0	0	119.3
733	E	27.9	Very low	29.5	Very low	182 Å²	182	150.8 Å²	150.8	85%	0.85	77%	0.766	S	S	*	*			trans	-88.1	-173.6	-173.7	-55.4	177.8	114.1	0	0	114.1
734	T	31.6	Very low	29	Very low	136 Å²	136	152.5 Å²	152.5	83%	0.834	78%	0.775	S	S	*	*			trans	100.5	66.8	159.3	69.4	0	0	0	0	120.5
735	H	30.2	Very low	28.8	Very low	185 Å²	185	153.1 Å²	153.1	86%	0.856	77%	0.772	S	S	*	*				-27.4	173.5	129.2	-80.5	-48.1	0	0	0	117.4
736	P	35.2	Very low	28.6	Very low	85 Å²	85	152.6 Å²	152.6	55%	0.552	77%	0.769	S	S	*	*			cis	-147.1	-174.6	-36	41.6	-23.4	0	0	0	115.8
737	H	28.9	Very low	28.7	Very low	166 Å²	166	150 Å²	150	77%	0.769	76%	0.764	S	S	*	*			trans	69.7	150	160.3	-54.2	-36.9	0	0	0	117.6
738	H	28.3	Very low	28.8	Very low	145 Å²	145	150.4 Å²	150.4	67%	0.671	77%	0.766	S	S	*	*			cis	-165.5	153.9	27	-135.2	-5.3	0	0	0	113.4
739	R	26.4	Very low	28.7	Very low	199 Å²	199	151 Å²	151	75%	0.751	76%	0.764	S	S	*	*			trans	70	120.2	151.8	-60	179.1	-168.7	-164.1	3.2	123.4
740	Y	24.4	Very low	28.6	Very low	219 Å²	219	154.4 Å²	154.4	86%	0.859	77%	0.767	S	S	*	*			trans	28.4	127	134.5	-60.9	-83.1	0	0	0	122.5
741	S	27.1	Very low	28.4	Very low	122 Å²	122	154.1 Å²	154.1	85%	0.853	76%	0.761	S	S	*	*				-176.5	150	110.3	36.7	0	0	0	0	112.4
742	L	23.7	Very low	28.3	Very low	170 Å²	170	153.7 Å²	153.7	89%	0.89	75%	0.754	S	S	*	*			trans	-88.6	144.3	164.6	-70.6	84.6	0	0	0	109.5
743	S	24.9	Very low	28	Very low	112 Å²	112	152.3 Å²	152.3	78%	0.783	75%	0.746	S	S	*	*				-174.9	156.2	125.7	53.4	0	0	0	0	114
744	L	25.2	Very low	28.1	Very low	128 Å²	128	152.5 Å²	152.5	67%	0.67	75%	0.747	S	S	*	*			trans	-38.1	152.9	173.9	-58.6	73.8	0	0	0	114.9
745	F	28.7	Very low	27.9	Very low	137 Å²	137	153.7 Å²	153.7	60%	0.601	74%	0.743	S	S	*	*				-167.6	169.6	74.9	-112.4	-82.3	0	0	0	116	N939	F745-N939 HydrophobicContact CE1-CB 4.45Å
746	N	27.1	Very low	27.8	Very low	122 Å²	122	155 Å²	155	65%	0.652	75%	0.747	S	S	*	*			trans	-88.2	166.7	-177.1	-91.9	-40.5	0	0	0	115.4
747	N	28.2	Very low	27.3	Very low	133 Å²	133	160.9 Å²	160.9	71%	0.711	76%	0.758	S	S	*	*			trans	71.5	139.5	167.8	-53.9	-19.1	0	0	0	115.2
748	H	32.5	Very low	27.4	Very low	173 Å²	173	161.7 Å²	161.7	80%	0.801	76%	0.759	S	S	*	*			cis	-142.7	158.5	38.6	-104.4	-86.5	0	0	0	116.4
749	Q	26.5	Very low	27.6	Very low	154 Å²	154	161.8 Å²	161.8	72%	0.72	76%	0.76	S	S	*	*			trans	-69.2	136.6	170.9	172.6	-173.2	8.9	0	0	113.2
750	Y	29.2	Very low	27.7	Very low	230 Å²	230	160.5 Å²	160.5	90%	0.902	76%	0.762	S	S	*	*			trans	-147.1	164.3	157.5	-115.5	-81.7	0	0	0	112.9
751	H	27.1	Very low	28.2	Very low	133 Å²	133	154.7 Å²	154.7	62%	0.616	75%	0.753	S	S	*	*			trans	-114.6	164.2	-155.5	-123.9	-118.4	0	0	0	115
752	H	28.9	Very low	28.5	Very low	139 Å²	139	153.5 Å²	153.5	64%	0.644	75%	0.745	S	S	*	*			trans	76.8	124.9	153.6	-77.1	-54	0	0	0	122.8
753	N	25.4	Very low	28.7	Very low	128 Å²	128	151.9 Å²	151.9	68%	0.684	74%	0.742	S	S	*	*			trans	51.4	118.3	130	-52.9	-1.1	0	0	0	119.4
754	H	30.8	Very low	28.9	Very low	187 Å²	187	154.7 Å²	154.7	87%	0.866	75%	0.747	S	S	*	*				-147.8	134.6	105.6	-120.7	-80.8	0	0	0	113.4
755	Q	27.2	Very low	29.1	Very low	160 Å²	160	153.4 Å²	153.4	75%	0.748	75%	0.749	S	S	*	*			trans	-72	144.8	169.7	-61.7	172.6	-13.2	0	0	110.1
756	F	29	Very low	29.1	Very low	214 Å²	214	152.3 Å²	152.3	94%	0.939	76%	0.758	S	S	*	*			trans	-135	152.9	136.4	-111.3	-83.9	0	0	0	110.4
757	R	24.8	Very low	29.1	Very low	207 Å²	207	154.5 Å²	154.5	78%	0.781	77%	0.769	S	S	*	*			trans	-145.1	134.5	-153.4	171	-172.1	179.5	-168.7	1.9	110.4
758	K	30.3	Very low	29.2	Very low	183 Å²	183	156.5 Å²	156.5	80%	0.796	78%	0.779	S	S	*	*			trans	161.7	143.3	158.6	-92.3	162.4	-175.5	-176.9	0	108.4
759	Q	31.5	Very low	28.9	Very low	148 Å²	148	153.1 Å²	153.1	69%	0.692	77%	0.773	S	S	*	*			cis	-162	130.2	-6	-137.4	162.1	-25.4	0	0	110.3
760	H	29.7	Very low	28.9	Very low	172 Å²	172	153.4 Å²	153.4	80%	0.796	78%	0.778	S	S	*	*			trans	49.3	146.1	147	-64	-127.7	0	0	0	120.4
761	S	35.2	Very low	28.8	Very low	97 Å²	97	147.6 Å²	147.6	68%	0.678	77%	0.771	S	S	*	*			cis	-152.1	158.5	29	-170.2	0	0	0	0	114.4
762	S	33.2	Very low	29	Very low	97 Å²	97	151.2 Å²	151.2	68%	0.678	79%	0.785	S	S	*	*			trans	30.6	116.8	151.5	54.5	0	0	0	0	119.3
763	V	27.2	Very low	28.8	Very low	136 Å²	136	153.1 Å²	153.1	82%	0.824	80%	0.797	S	S	*	*			cis	65.1	93.3	26.2	-166.7	0	0	0	0	115.1
764	L	29.3	Very low	28.9	Very low	170 Å²	170	156.3 Å²	156.3	89%	0.89	81%	0.805	S	S	*	*			trans	159	135.6	148.3	-89	160.1	0	0	0	107.9
765	S	29.5	Very low	28.8	Very low	102 Å²	102	155.6 Å²	155.6	71%	0.713	80%	0.799	S	S	*	*			cis	-144	151.4	-4.1	62.2	0	0	0	0	111.6
766	S	27.6	Very low	28.9	Very low	113 Å²	113	155.4 Å²	155.4	79%	0.79	80%	0.798	S	S	*	*			trans	-122.8	160.4	156.5	-64.2	0	0	0	0	107.1
767	L	28.4	Very low	28.8	Very low	169 Å²	169	155.1 Å²	155.1	89%	0.885	79%	0.79	S	S	*	*			trans	78.1	91.6	-179.6	-51	168.1	0	0	0	116.2
768	L	31.1	Very low	29	Very low	175 Å²	175	155.5 Å²	155.5	92%	0.916	79%	0.792	S	S	*	*			trans	-168.7	85.9	139.8	-101.8	159.1	0	0	0	106.5
769	C	25.2	Very low	28.7	Very low	101 Å²	101	156 Å²	156	68%	0.682	79%	0.794	S	S	*	*				87.7	107.8	75	-166	0	0	0	0	113.5
770	I	27.3	Very low	28.5	Very low	160 Å²	160	157 Å²	157	82%	0.821	80%	0.799	S	S	*	*			trans	25.6	105.1	143	-46.9	172.4	0	0	0	117.2
771	S	27	Very low	28.3	Very low	109 Å²	109	152.3 Å²	152.3	76%	0.762	78%	0.784	S	S	*	*				178.5	108.1	126	-176.3	0	0	0	0	113.5
772	K	30.8	Very low	27.7	Very low	208 Å²	208	152.9 Å²	152.9	90%	0.904	79%	0.788	S	S	*	*			trans	-171.8	83.2	137.5	-108.3	166.2	-175.7	172	0	111.8
773	M	24.5	Very low	27.3	Very low	179 Å²	179	154.3 Å²	154.3	88%	0.882	79%	0.792	S	S	*	*			trans	-73.7	131.1	162.2	-61.7	-174.7	-167.4	0	0	110.5
774	K	28.3	Very low	27.2	Very low	196 Å²	196	157 Å²	157	85%	0.852	79%	0.793	S	S	*	*			trans	177.3	125.4	133.9	-93.4	149.2	-172.9	176.7	0	108.1
775	K	27	Very low	27.2	Very low	172 Å²	172	156.3 Å²	156.3	75%	0.748	79%	0.789	S	S	*	*			cis	99.2	133.8	42.3	-177.7	-168.7	177.5	179.5	0	110.5
776	H	30.8	Very low	27.1	Very low	155 Å²	155	155.1 Å²	155.1	72%	0.718	77%	0.774	S	S	*	*			trans	101.9	112.5	-178.8	-68.1	-90.3	0	0	0	114.2
777	R	26.6	Very low	27.4	Very low	209 Å²	209	157.3 Å²	157.3	79%	0.789	78%	0.777	S	S	*	*			cis	93.3	126.1	17.7	-154.4	-168.6	-160.6	-162.4	7.9	114.4
778	R	28.6	Very low	27.5	Very low	215 Å²	215	153.2 Å²	153.2	81%	0.811	76%	0.756	S	S	*	*			trans	82.8	126.8	179.9	-59.9	174.8	174.2	166.4	-4.6	113.4
779	K	24.9	Very low	27.5	Very low	192 Å²	192	152 Å²	152	84%	0.835	75%	0.751	S	S	*	*				72.5	101.9	55.8	-78.8	-165.7	175.1	-172.3	0	113.4
780	Q	26.8	Very low	27.7	Very low	171 Å²	171	158 Å²	158	80%	0.799	76%	0.759	S	S	*	*				175.8	170.8	112.3	-99.3	-179.6	-8.1	0	0	114.4
781	C	24.6	Very low	27.7	Very low	72 Å²	72	156.8 Å²	156.8	49%	0.486	76%	0.759	S	S	.	*			trans	2.5	126.8	160.7	-57.9	0	0	0	0	119.2	R619	R619-C781 PolarHBondContact NH2-SG 3.11Å
782	S	23.3	Very low	27.8	Very low	109 Å²	109	159.2 Å²	159.2	76%	0.762	76%	0.762	S	S	*	*				69.7	104.7	65.9	174.8	0	0	0	0	115
783	V	25.8	Very low	27.6	Very low	127 Å²	127	153.6 Å²	153.6	77%	0.77	75%	0.749	S	S	*	*			trans	-164	145.2	135	136	0	0	0	0	108.4	I785	V783-I785 HydrophobicContact CG1-CG1 4.12Å
784	K	23.2	Very low	27.6	Very low	194 Å²	194	152.6 Å²	152.6	84%	0.843	74%	0.742	S	S	*	*			trans	-80.4	128.1	166.6	-74.9	-179.1	176.3	-176.1	0	109
785	I	29.8	Very low	27.6	Very low	154 Å²	154	153 Å²	153	79%	0.79	74%	0.744	S	S	*	*			trans	-124.7	128.4	147.7	-64.7	-176.4	0	0	0	107.4	V783	V783-I785 HydrophobicContact CG1-CG1 4.12Å
786	N	27.6	Very low	27.6	Very low	78 Å²	78	150.2 Å²	150.2	42%	0.417	74%	0.738	S	S	.	*			trans	-94.7	136.7	173.4	-168	22.6	0	0	0	108.2	Q1070	N786-Q1070 VanDerWaalsContact CG-NE2 3.28Å; N786-Q1070 PolarHBondContact ND2-NE2 2.69Å; N786-Q1070 PolarHBondContact ND2-OE1 2.94Å; N786-Q1070 PolarHBondContact OD1-NE2 3.37Å
787	N	33.6	Very low	27.5	Very low	158 Å²	158	150.7 Å²	150.7	85%	0.845	74%	0.74	S	S	*	*			trans	-155.8	136.5	151.2	-116.2	-14.6	0	0	0	111.3
788	N	31	Very low	27.5	Very low	84 Å²	84	146.5 Å²	146.5	45%	0.449	74%	0.737	S	S	.	*			trans	-94.6	175.6	-178	-57.1	-48.3	0	0	0	110.5
789	N	30.2	Very low	27.7	Very low	149 Å²	149	142.8 Å²	142.8	80%	0.797	73%	0.734	S	S	*	*			trans	68.7	125	158	-53.8	-23.8	0	0	0	114.8
790	R	30.8	Very low	27.8	Very low	226 Å²	226	140.7 Å²	140.7	85%	0.853	73%	0.732	S	S	*	*			cis	-155.1	146.5	41	-114.2	147.2	-179.3	164.5	-2	111.7
791	T	26.2	Very low	28	Very low	135 Å²	135	140.2 Å²	140.2	83%	0.828	73%	0.733	S	S	*	*			trans	-69.4	138.5	149.1	46.5	0	0	0	0	110.1
792	I	29.2	Very low	28.2	Very low	160 Å²	160	145.9 Å²	145.9	82%	0.821	75%	0.752	S	S	*	*			trans	-142.7	146.2	148.9	-98.6	155.2	0	0	0	106.6
793	S	26.5	Very low	28.6	Very low	90 Å²	90	144.7 Å²	144.7	63%	0.629	76%	0.757	S	S	*	*			trans	-83	167.8	-173.2	46	0	0	0	0	113.4
794	Q	25.1	Very low	28.7	Very low	158 Å²	158	145.6 Å²	145.6	74%	0.738	76%	0.757	S	S	*	*			trans	33.1	125.3	146.6	-65.3	163	-81.3	0	0	119.1
795	F	29	Very low	29.2	Very low	204 Å²	204	143.6 Å²	143.6	90%	0.895	75%	0.754	S	S	*	*				-152.1	165.4	116.4	-110.8	-69.1	0	0	0	110.8
796	D	27.2	Very low	29.1	Very low	115 Å²	115	142.4 Å²	142.4	62%	0.615	75%	0.749	S	S	*	*			trans	-91	174.3	-152.9	-64.7	-77	0	0	0	117
797	H	27.5	Very low	29.1	Very low	165 Å²	165	143.4 Å²	143.4	76%	0.764	76%	0.762	S	S	*	*			trans	-12.5	144	159.1	-56.2	-86.2	0	0	0	118.2
798	T	27.3	Very low	28.8	Very low	120 Å²	120	144.4 Å²	144.4	74%	0.736	76%	0.76	S	S	*	*				174.8	166.9	97.8	36.3	0	0	0	0	113.5
799	N	31.5	Very low	28.8	Very low	137 Å²	137	149.1 Å²	149.1	73%	0.733	78%	0.779	S	S	*	*			trans	76.5	90.4	154.1	-59.2	-33.9	0	0	0	121.1
800	N	26.9	Very low	28.8	Very low	148 Å²	148	148 Å²	148	79%	0.791	77%	0.771	S	S	*	*				16.2	130.9	114.1	-66.7	-29.7	0	0	0	119.7
801	I	32.8	Very low	28.8	Very low	162 Å²	162	143.5 Å²	143.5	83%	0.831	76%	0.764	S	S	*	*			trans	-166.2	112.8	130.2	-97.3	147.7	0	0	0	106.7
802	H	28.8	Very low	29.1	Very low	191 Å²	191	144.2 Å²	144.2	88%	0.884	76%	0.758	S	S	*	*				64.2	120.2	90.2	-109.6	73.3	0	0	0	115
803	G	31.7	Very low	29.2	Very low	84 Å²	84	143.5 Å²	143.5	87%	0.866	75%	0.754	S	S	*	*			trans	155.9	78	173.7	0	0	0	0	0	116.1
804	N	26.1	Very low	29.4	Very low	145 Å²	145	145 Å²	145	78%	0.775	76%	0.76	S	S	*	*			trans	-106.9	138.7	163.5	-179.3	17.1	0	0	0	108.3
805	I	34	Very low	29.7	Very low	153 Å²	153	141.5 Å²	141.5	79%	0.785	76%	0.758	S	S	*	*			trans	-175.5	114.8	158.5	-100.1	148.7	0	0	0	112.9
806	N	28.7	Very low	29.8	Very low	128 Å²	128	137.3 Å²	137.3	68%	0.684	75%	0.749	S	S	*	*			trans	27.1	120.9	133.1	-52.1	-19	0	0	0	123.3
807	S	27.5	Very low	30	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	75%	0.752	S	S	*	*				73.4	142.7	114.6	81.4	0	0	0	0	124.2
808	K	26.9	Very low	30.2	Very low	180 Å²	180	134.3 Å²	134.3	78%	0.783	75%	0.747	S	S	*	*			trans	58.1	117.8	147.6	-69.6	175.6	178.3	-177.5	0	119.3
809	E	31.2	Very low	30.3	Very low	182 Å²	182	134.2 Å²	134.2	85%	0.85	75%	0.747	S	S	*	*				-160.6	141.7	96.8	-91.1	172.9	147.9	0	0	106.3
810	I	29.9	Very low	30.3	Very low	125 Å²	125	132.8 Å²	132.8	64%	0.641	74%	0.743	S	S	*	*			cis	89.5	146.9	44.9	-67.4	171.9	0	0	0	111.9
811	D	31.5	Very low	30.3	Very low	133 Å²	133	130.9 Å²	130.9	71%	0.711	74%	0.737	S	S	*	*			trans	71.6	143.2	174.6	-72.7	-1	0	0	0	120.4
812	H	31.1	Very low	30.1	Very low	149 Å²	149	128.8 Å²	128.8	69%	0.69	73%	0.732	S	S	*	*			cis	-165.2	-179.9	-28.8	-136.6	-27	0	0	0	111.1
813	I	31.5	Very low	30.1	Very low	146 Å²	146	125 Å²	125	75%	0.749	72%	0.722	S	S	*	*			trans	63.7	109.5	162	-64.1	154	0	0	0	116.3
814	T	30.5	Very low	30	Very low	121 Å²	121	127.3 Å²	127.3	74%	0.742	71%	0.714	S	S	*	*			cis	93.1	103.8	43.8	-61.3	0	0	0	0	114.4
815	A	32.9	Very low	30.1	Very low	85 Å²	85	125.9 Å²	125.9	70%	0.702	71%	0.711	S	S	*	*			trans	-179.9	117.5	142.4	0	0	0	0	0	107.3
816	T	30.4	Very low	29.8	Very low	116 Å²	116	124.3 Å²	124.3	71%	0.712	71%	0.709	S	S	*	*				62.2	137.1	65	71.1	0	0	0	0	112.9
817	T	32.5	Very low	29.9	Very low	110 Å²	110	124.5 Å²	124.5	68%	0.675	71%	0.71	S	S	*	*			cis	-160.6	131.5	19.6	-9.9	0	0	0	0	112.6
818	T	30.7	Very low	30.1	Very low	107 Å²	107	126.5 Å²	126.5	66%	0.656	71%	0.713	S	S	*	*			trans	57.1	138	131.8	58.8	0	0	0	0	125.1
819	T	29.3	Very low	30.3	Very low	118 Å²	118	124.8 Å²	124.8	72%	0.724	71%	0.712	S	S	*	*			trans	69.4	156.6	133.3	55.6	0	0	0	0	120.2
820	T	30.9	Very low	30.3	Very low	107 Å²	107	121.1 Å²	121.1	66%	0.656	71%	0.707	S	S	*	*			cis	-155	129	-1.8	9.5	0	0	0	0	108
821	T	27.6	Very low	30.3	Very low	108 Å²	108	121.9 Å²	121.9	66%	0.663	71%	0.712	S	S	*	*				55	149.5	106.7	74	0	0	0	0	118.9
822	T	28.6	Very low	30.2	Very low	118 Å²	118	123 Å²	123	72%	0.724	72%	0.718	S	S	*	*			trans	67.5	142.4	146.9	49.6	0	0	0	0	118.3
823	T	28.5	Very low	30	Very low	110 Å²	110	122.8 Å²	122.8	68%	0.675	72%	0.722	S	S	*	*			cis	-169	164.8	-3.7	13.8	0	0	0	0	112.3
824	N	30.6	Very low	29.8	Very low	133 Å²	133	122.1 Å²	122.1	71%	0.711	73%	0.725	S	S	*	*			trans	63.7	105.5	142.5	-65.4	2.2	0	0	0	122.9
825	T	27.1	Very low	29.7	Very low	115 Å²	115	124.9 Å²	124.9	71%	0.706	73%	0.729	S	S	*	*				36.5	125.3	118.2	62.8	0	0	0	0	121.2
826	T	29	Very low	29.4	Very low	120 Å²	120	128.2 Å²	128.2	74%	0.736	73%	0.728	S	S	*	*				172.2	155.9	99.2	34	0	0	0	0	113.3
827	N	29.6	Very low	29.3	Very low	132 Å²	132	130.7 Å²	130.7	71%	0.706	74%	0.736	S	S	*	*			trans	34.5	118.5	146.2	-55.7	-0.1	0	0	0	118.9
828	N	32.8	Very low	29.3	Very low	142 Å²	142	131.1 Å²	131.1	76%	0.759	74%	0.735	S	S	*	*				-174.5	152.8	64.1	-99.1	-40.4	0	0	0	114.2
829	N	30.6	Very low	29.3	Very low	144 Å²	144	131.6 Å²	131.6	77%	0.77	74%	0.737	S	S	*	*			trans	13.5	152	148.5	-67	-13.6	0	0	0	124.3
830	S	31.4	Very low	29.5	Very low	105 Å²	105	132.2 Å²	132.2	73%	0.734	74%	0.741	S	S	*	*			trans	88.4	109.7	149.3	70.5	0	0	0	0	119.7
831	N	29.5	Very low	29.5	Very low	141 Å²	141	133.4 Å²	133.4	75%	0.754	74%	0.743	S	S	*	*				30.4	111.1	129.3	-50.6	2.4	0	0	0	117.7
832	N	30.2	Very low	29.6	Very low	157 Å²	157	134.5 Å²	134.5	84%	0.84	75%	0.745	S	S	*	*				-171.6	169.9	89.3	-94.4	-43.4	0	0	0	112.6
833	N	26.9	Very low	29.7	Very low	143 Å²	143	138.7 Å²	138.7	77%	0.765	75%	0.753	S	S	*	*			trans	-76.9	176.3	169.9	-66.5	-50.1	0	0	0	111.7
834	T	26.8	Very low	29.7	Very low	132 Å²	132	138.3 Å²	138.3	81%	0.81	76%	0.755	S	S	*	*			trans	74.7	142.7	170.5	63.1	0	0	0	0	116.7
835	E	27.2	Very low	29.6	Very low	179 Å²	179	139.3 Å²	139.3	84%	0.836	76%	0.759	S	S	*	*			trans	65.1	148.8	-174.3	-49.8	-167.9	153.9	0	0	113.7
836	F	27.7	Very low	29.6	Very low	156 Å²	156	140.1 Å²	140.1	68%	0.684	76%	0.763	S	S	*	*			cis	-135.3	129.5	16.4	-158.9	-89.1	0	0	0	111.6
837	L	26.8	Very low	29.5	Very low	167 Å²	167	141.5 Å²	141.5	87%	0.874	77%	0.766	S	S	*	*			trans	-83.2	118.6	179	-85.5	159.8	0	0	0	111.4
838	N	34.5	Very low	29.5	Very low	120 Å²	120	143.2 Å²	143.2	64%	0.642	77%	0.77	S	S	*	*			trans	-114.7	114.1	166.9	-72	-55.3	0	0	0	108.5
839	T	30.4	Very low	29	Very low	116 Å²	116	144.2 Å²	144.2	71%	0.712	78%	0.775	S	S	*	*				64.3	133	70	70.6	0	0	0	0	112.3
840	V	32.4	Very low	28.7	Very low	132 Å²	132	143.7 Å²	143.7	80%	0.8	78%	0.777	S	S	*	*			cis	-163	154.4	-1.1	102.6	0	0	0	0	107.6
841	N	30.4	Very low	28.5	Very low	132 Å²	132	142.5 Å²	142.5	71%	0.706	77%	0.768	S	S	*	*			cis	-158	-174.8	-4.2	-159.1	-4.1	0	0	0	109.4
842	N	31.7	Very low	28.3	Very low	130 Å²	130	140.1 Å²	140.1	70%	0.695	76%	0.763	S	S	*	*			trans	72.6	109.8	169.4	-51.3	-23.2	0	0	0	114.9
843	F	30.5	Very low	28.1	Very low	206 Å²	206	141.4 Å²	141.4	90%	0.904	76%	0.763	S	S	*	*			cis	-133	149.6	35.1	-99.7	-101.7	0	0	0	113.9
844	S	28	Very low	28.1	Very low	103 Å²	103	139.1 Å²	139.1	72%	0.72	76%	0.759	S	S	*	*			trans	-81.1	165.6	172.2	53.9	0	0	0	0	111.2
845	I	29.3	Very low	28.1	Very low	153 Å²	153	136 Å²	136	79%	0.785	75%	0.753	S	S	*	*			cis	-137.2	137.3	34.7	-69.4	170	0	0	0	112.8
846	V	26.4	Very low	28.2	Very low	132 Å²	132	135.1 Å²	135.1	80%	0.8	75%	0.749	S	S	*	*			trans	-100.9	137.1	160.1	169.1	0	0	0	0	108.2
847	N	27.6	Very low	28.3	Very low	149 Å²	149	132.7 Å²	132.7	80%	0.797	74%	0.743	S	S	*	*			trans	-170.7	160.1	148.2	-105.4	-27.2	0	0	0	113.9
848	Q	28	Very low	28.3	Very low	168 Å²	168	130.4 Å²	130.4	79%	0.785	73%	0.731	S	S	*	*			trans	63.5	73	168.2	-70.1	-177.8	-32.3	0	0	118.2
849	L	22.1	Very low	28	Very low	163 Å²	163	126.1 Å²	126.1	85%	0.853	71%	0.714	S	S	*	*				-72.4	160.3	129.4	-132.3	92.8	0	0	0	109.3
850	V	25.3	Very low	27.8	Very low	134 Å²	134	127.3 Å²	127.3	81%	0.812	72%	0.716	S	S	*	*			trans	62.7	84.2	168.1	-167.4	0	0	0	0	117.3
851	S	27.3	Very low	27.5	Very low	79 Å²	79	125.8 Å²	125.8	55%	0.552	71%	0.71	S	S	*	*			trans	-174.8	100	143.9	52.5	0	0	0	0	107.5
852	S	24.4	Very low	27.3	Very low	92 Å²	92	123 Å²	123	64%	0.643	70%	0.701	S	S	*	*				67.7	119.9	81.6	71.1	0	0	0	0	114.1
853	Q	26.7	Very low	27.3	Very low	183 Å²	183	122.4 Å²	122.4	86%	0.855	70%	0.702	S	S	*	*			trans	64.8	156.2	149.8	-66.5	166.2	-14.3	0	0	117.3
854	S	26.4	Very low	27.2	Very low	95 Å²	95	120.6 Å²	120.6	66%	0.664	70%	0.702	S	S	*	*			cis	-169	138.4	-25.7	50.2	0	0	0	0	110.3
855	G	27.8	Very low	27.2	Very low	67 Å²	67	122 Å²	122	69%	0.691	70%	0.7	S	S	*	*			trans	76.8	170	150.1	0	0	0	0	0	119
856	H	28.8	Very low	27.1	Very low	161 Å²	161	121.7 Å²	121.7	75%	0.745	70%	0.7	S	S	*	*			trans	74.4	133.8	160.3	-50.7	-60.3	0	0	0	119.9
857	N	29.6	Very low	27.2	Very low	105 Å²	105	123.2 Å²	123.2	56%	0.561	70%	0.703	S	S	*	*			cis	-163	149	-28.8	-121.5	-2.2	0	0	0	112.2
858	L	26.2	Very low	27.3	Very low	119 Å²	119	120.1 Å²	120.1	62%	0.623	70%	0.699	S	S	*	*			trans	37.5	112.9	142.3	-61.6	167.9	0	0	0	119.6
859	G	28.8	Very low	27.2	Very low	29 Å²	29	120.5 Å²	120.5	30%	0.299	70%	0.7	S	S	.	*			trans	-142.9	28.2	164	0	0	0	0	0	114.7	T596 G597	T596-G859 CarbonylContact C-O 3.41Å; T596-G859 WeakPolarHBondContact CB-O 3.29Å; T596-G859 PolarHBondContact OG1-O 2.7Å; G597-G859 VanDerWaalsContact O-CA 3.24Å; G597-G859 WeakPolarHBondContact O-CA 3.3Å
860	L	27.3	Very low	27.5	Very low	141 Å²	141	120 Å²	120	74%	0.738	70%	0.698	S	S	*	*			trans	-75.5	127.9	-177.8	-79.4	160.4	0	0	0	112.5
861	C	25.5	Very low	27.8	Very low	101 Å²	101	125.6 Å²	125.6	68%	0.682	70%	0.704	S	S	*	*			trans	-95.2	107.1	135.1	-84.6	0	0	0	0	107.5	T596	T596-C861 PolarHBondContact OG1-N 2.71Å
862	S	26.6	Very low	27.7	Very low	73 Å²	73	125.7 Å²	125.7	51%	0.51	72%	0.717	S	S	.	*			trans	-94.1	-174.8	167.7	-165.5	0	0	0	0	109.5
863	T	30.8	Very low	28	Very low	117 Å²	117	130.6 Å²	130.6	72%	0.718	73%	0.73	S	S	*	*			trans	64.3	141.5	178.5	53.6	0	0	0	0	114.8
864	D	28.9	Very low	28.1	Very low	168 Å²	168	128.9 Å²	128.9	90%	0.898	73%	0.732	S	S	*	*			cis	-87.6	134.1	12.7	-72.1	-50.7	0	0	0	115.9
865	L	28.5	Very low	28.1	Very low	132 Å²	132	128.9 Å²	128.9	69%	0.691	73%	0.733	S	S	*	*			trans	-93	151.5	170.8	-141	82.4	0	0	0	108.8
866	L	26.7	Very low	28.2	Very low	148 Å²	148	131.8 Å²	131.8	78%	0.775	74%	0.737	S	S	*	*			trans	50.6	78.7	139	-167.5	80.6	0	0	0	117.6
867	N	27.5	Very low	28.1	Very low	163 Å²	163	133.4 Å²	133.4	87%	0.872	74%	0.744	S	S	*	*			trans	-167.5	155.4	141.8	-102.7	-47.2	0	0	0	112.2
868	A	29.2	Very low	28.1	Very low	85 Å²	85	132.2 Å²	132.2	70%	0.702	75%	0.749	S	S	*	*			trans	47.7	91.2	178.2	0	0	0	0	0	114.8
869	H	26.6	Very low	28.3	Very low	176 Å²	176	131 Å²	131	82%	0.815	76%	0.757	S	S	*	*				42.9	113	65.1	-150.5	90.9	0	0	0	112.6
870	L	28.5	Very low	28.8	Very low	153 Å²	153	137.8 Å²	137.8	80%	0.801	79%	0.786	S	S	*	*			trans	106.2	133.7	-178.9	-60.7	163.6	0	0	0	115.9
871	R	31	Very low	29.4	Very low	250 Å²	250	133.2 Å²	133.2	94%	0.943	77%	0.773	S	S	*	*			trans	68.9	74.5	171.6	-53.4	-176.6	-175.6	-162.7	0.7	117.2
872	G	26.6	Very low	30.1	Very low	81 Å²	81	131.4 Å²	131.4	84%	0.835	76%	0.757	S	S	*	*			trans	-87.4	125.8	168.4	0	0	0	0	0	113.8
873	Q	30	Very low	30.8	Very low	195 Å²	195	133 Å²	133	91%	0.911	76%	0.759	S	S	*	*			trans	-159.3	106.4	165.1	-116.3	-176.4	-3	0	0	110.1
874	T	29.6	Very low	31.6	Very low	147 Å²	147	131.9 Å²	131.9	90%	0.902	75%	0.745	S	S	*	*			trans	-145.9	108.8	171	50.8	0	0	0	0	109.7
875	S	26.3	Very low	32.7	Very low	96 Å²	96	128.8 Å²	128.8	67%	0.671	73%	0.728	S	S	*	*			trans	-109	122.4	178.7	55	0	0	0	0	111
876	V	28.6	Very low	33.6	Very low	128 Å²	128	123.3 Å²	123.3	78%	0.776	70%	0.699	S	S	*	*			trans	-93	126.1	167.8	-178.4	0	0	0	0	108.3	A878	V876-A878 PolarHBondContact O-N 2.85Å
877	Q	26.8	Very low	34.6	Very low	194 Å²	194	122.7 Å²	122.7	91%	0.907	70%	0.696	S	S	*	*			trans	-82.4	106.6	178.2	-73.5	-178.1	-55.9	0	0	110.8
878	A	29.2	Very low	35.8	Very low	80 Å²	80	119.8 Å²	119.8	66%	0.661	69%	0.688	S	S	*	*			trans	-106.8	147.9	153.3	0	0	0	0	0	108.6	V876	V876-A878 PolarHBondContact O-N 2.85Å
879	A	32.4	Very low	36.4	Very low	95 Å²	95	123.8 Å²	123.8	79%	0.785	69%	0.685	S	S	*	*	S	Bend	trans	-66	135.6	171.6	0	0	0	0	0	109.8
880	N	37.6	Very low	37.3	Very low	170 Å²	170	119.2 Å²	119.2	91%	0.909	69%	0.686	S	S	*	*	S	Bend	trans	68.5	70.4	175.5	-53.9	-20.2	0	0	0	116.8
881	G	40	Very low	38.4	Very low	46 Å²	46	117.6 Å²	117.6	47%	0.474	67%	0.674	S	S	.	*			trans	104.8	116.1	155.4	0	0	0	0	0	114.9	N897	G881-N897 WeakPolarHBondContact CA-OD1 3.17Å
882	L	40.1	Very low	38.9	Very low	63 Å²	63	109.7 Å²	109.7	33%	0.33	66%	0.655	S	S	.	*			trans	-95.1	106.3	179.6	-157.4	158	0	0	0	109.6	Q884 N897	L882-Q884 HydrophobicContact CD2-CB 3.91Å; L882-N897 PolarHBondContact N-OD1 3.28Å; L882-N897 PolarHBondContact O-N 2.75Å
883	L	42.7	Very low	40.2	Very low	106 Å²	106	106.8 Å²	106.8	56%	0.555	62%	0.622	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.9	115.6	169.8	-173.1	80.8	0	0	0	108.7	M894 I896	L883-M894 HydrophobicContact CD1-CE 4.44Å; L883-M894 HydrophobicContact CD1-CG 3.96Å; L883-M894 HydrophobicContact CD1-SD 3.92Å; L883-I896 HydrophobicContact CD1-CD1 4.25Å; L883-I896 HydrophobicContact CD1-CG1 3.82Å
884	Q	47.6	Very low	40.8	Very low	93 Å²	93	101.7 Å²	101.7	44%	0.435	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121	126.5	179	177.9	-178	1.3	0	0	109.6	L882 L895	L882-Q884 HydrophobicContact CD2-CB 3.91Å; Q884-L895 HydrophobicContact CB-CB 4.15Å; Q884-L895 HydrophobicContact CB-CD1 4.41Å; Q884-L895 HydrophobicContact CG-CD1 4.11Å; Q884-L895 PolarHBondContact N-O 3.47Å; Q884-L895 WeakPolarHBondContact O-CB 2.95Å; Q884-L895 PolarHBondContact O-N 2.84Å
885	I	51.6	Low	42.3	Very low	104 Å²	104	95.7 Å²	95.7	53%	0.533	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.5	107.6	172.4	-56.1	177.1	0	0	0	106.9	L887	I885-L887 HydrophobicContact CG2-CD2 3.77Å; I885-L887 HydrophobicContact CG2-CG 4.04Å; I885-L887 PolarHBondContact O-N 3.44Å
886	D	47.3	Very low	43.7	Very low	16 Å²	16	94.5 Å²	94.5	9%	0.086	55%	0.547	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	103.7	174.8	-173.3	6.2	0	0	0	109.8	S888 R889 S893 L895	D886-S888 VanDerWaalsContact OD1-CB 3.26Å; D886-S888 WeakPolarHBondContact OD1-CB 3.45Å; D886-S888 PolarHBondContact OD1-N 3.43Å; D886-S888 PolarHBondContact OD1-OG 2.85Å; D886-R889 WeakPolarHBondContact OD2-CD 3.26Å; D886-R889 IonicContact OD2-CZ 2.68Å; D886-R889 IonicContact OD2-NE 3.98Å; D886-R889 PolarHBondContact OD2-NE 3.06Å; D886-R889 IonicContact OD2-NH2 3.67Å; D886-S893 PolarHBondContact N-O 3.23Å; D886-S893 PolarHBondContact O-N 2.04Å; D886-L895 HydrophobicContact CB-CD1 3.91Å
887	L	48.2	Very low	44.6	Very low	135 Å²	135	93.8 Å²	93.8	71%	0.707	54%	0.539	S	S	*	.			trans	-93.3	-0.1	173.1	-59.9	178	0	0	0	112.6	I885 R889 P892	I885-L887 HydrophobicContact CG2-CD2 3.77Å; I885-L887 HydrophobicContact CG2-CG 4.04Å; I885-L887 PolarHBondContact O-N 3.44Å; L887-R889 PolarHBondContact O-N 2.99Å; L887-P892 HydrophobicContact CD2-CB 4.17Å
888	S	51.3	Low	45.6	Very low	103 Å²	103	87 Å²	87	72%	0.72	52%	0.521	S	S	*	.	S	Bend	trans	-79.1	-1.3	-177.8	73.7	0	0	0	0	114	D886	D886-S888 VanDerWaalsContact OD1-CB 3.26Å; D886-S888 WeakPolarHBondContact OD1-CB 3.45Å; D886-S888 PolarHBondContact OD1-N 3.43Å; D886-S888 PolarHBondContact OD1-OG 2.85Å
889	R	43.3	Very low	46.3	Very low	168 Å²	168	92.6 Å²	92.6	63%	0.634	53%	0.525	S	S	*	.	S	Bend	trans	-119.7	145.2	-179.6	-54	-179.9	-166.1	-137.6	-6.8	109.2	D886 L887 H891	D886-R889 WeakPolarHBondContact OD2-CD 3.26Å; D886-R889 IonicContact OD2-CZ 2.68Å; D886-R889 IonicContact OD2-NE 3.98Å; D886-R889 PolarHBondContact OD2-NE 3.06Å; D886-R889 IonicContact OD2-NH2 3.67Å; L887-R889 PolarHBondContact O-N 2.99Å; R889-H891 CarbonylContact O-C 3.53Å; R889-H891 PolarHBondContact O-N 2.77Å
890	G	43.9	Very low	47	Very low	81 Å²	81	92.5 Å²	92.5	84%	0.835	52%	0.516	S	S	*	.	S	Bend	trans	-63.1	2	179.8	0	0	0	0	0	116.1
891	H	52.8	Low	47.5	Very low	119 Å²	119	87.2 Å²	87.2	55%	0.551	49%	0.488	S	S	*	.	S	Bend	trans	-129	116.9	165.8	-51	-65.7	0	0	0	106.9	R889 S893	R889-H891 CarbonylContact O-C 3.53Å; R889-H891 PolarHBondContact O-N 2.77Å; H891-S893 PolarHBondContact O-N 3.33Å
892	P	41.8	Very low	47.2	Very low	83 Å²	83	91.9 Å²	91.9	54%	0.539	50%	0.499	S	S	.	.			trans	-65	121.7	-178.3	26.3	-33.6	0	0	0	109.6	L887	L887-P892 HydrophobicContact CD2-CB 4.17Å
893	S	52.4	Low	46.9	Very low	21 Å²	21	99.7 Å²	99.7	15%	0.147	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	120.1	-178.5	59.1	0	0	0	0	111.4	D886 H891	D886-S893 PolarHBondContact N-O 3.23Å; D886-S893 PolarHBondContact O-N 2.04Å; H891-S893 PolarHBondContact O-N 3.33Å
894	M	43.4	Very low	46.5	Very low	88 Å²	88	100.3 Å²	100.3	43%	0.433	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	125.8	170.1	-175.1	175.9	-77.7	0	0	109.6	L883 L901	L883-M894 HydrophobicContact CD1-CE 4.44Å; L883-M894 HydrophobicContact CD1-CG 3.96Å; L883-M894 HydrophobicContact CD1-SD 3.92Å; M894-L901 PolarHBondContact O-N 3.36Å; M894-L901 HydrophobicContact SD-CD2 4.4Å
895	L	61.4	Low	45.7	Very low	21 Å²	21	101.1 Å²	101.1	11%	0.11	54%	0.543	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	131.3	177.5	-58.4	164.9	0	0	0	108.7	Q884 D886 R899 P900	Q884-L895 HydrophobicContact CB-CB 4.15Å; Q884-L895 HydrophobicContact CB-CD1 4.41Å; Q884-L895 HydrophobicContact CG-CD1 4.11Å; Q884-L895 PolarHBondContact N-O 3.47Å; Q884-L895 WeakPolarHBondContact O-CB 2.95Å; Q884-L895 PolarHBondContact O-N 2.84Å; D886-L895 HydrophobicContact CB-CD1 3.91Å; L895-R899 VanDerWaalsContact CA-O 3.3Å; L895-R899 WeakPolarHBondContact CA-O 3.32Å; L895-P900 HydrophobicContact CD2-CB 4.07Å
896	I	55.2	Low	44.8	Very low	71 Å²	71	99.7 Å²	99.7	36%	0.364	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	123.8	163.9	-68.9	179.1	0	0	0	107.4	L883 G898 R899 L901	L883-I896 HydrophobicContact CD1-CD1 4.25Å; L883-I896 HydrophobicContact CD1-CG1 3.82Å; I896-G898 PolarHBondContact O-N 2.84Å; I896-G898 VanDerWaalsContact O-N 3.15Å; I896-R899 PolarHBondContact N-O 3.01Å; I896-R899 PolarHBondContact O-N 3.1Å; I896-L901 HydrophobicContact CB-CD1 4Å; I896-L901 HydrophobicContact CD1-CD1 3.82Å; I896-L901 HydrophobicContact CD1-CD2 4.01Å; I896-L901 HydrophobicContact CG1-CD1 3.97Å
897	N	47.1	Very low	44	Very low	113 Å²	113	104.7 Å²	104.7	60%	0.604	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	49.6	39.7	-176.2	-60	-25.3	0	0	0	112.6	G881 L882 R899	G881-N897 WeakPolarHBondContact CA-OD1 3.17Å; L882-N897 PolarHBondContact N-OD1 3.28Å; L882-N897 PolarHBondContact O-N 2.75Å; N897-R899 VanDerWaalsContact C-N 3.31Å; N897-R899 PolarHBondContact O-N 2.87Å
898	G	47.3	Very low	43.2	Very low	51 Å²	51	103.2 Å²	103.2	53%	0.526	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	76.3	2.9	-179.3	0	0	0	0	0	116.3	I896	I896-G898 PolarHBondContact O-N 2.84Å; I896-G898 VanDerWaalsContact O-N 3.15Å
899	R	45.7	Very low	42.1	Very low	198 Å²	198	105.4 Å²	105.4	75%	0.747	59%	0.587	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.8	130.7	177.2	-65.7	-173.1	175.3	-164	-1.7	111.7	L895 I896 N897 L901	L895-R899 VanDerWaalsContact CA-O 3.3Å; L895-R899 WeakPolarHBondContact CA-O 3.32Å; I896-R899 PolarHBondContact N-O 3.01Å; I896-R899 PolarHBondContact O-N 3.1Å; N897-R899 VanDerWaalsContact C-N 3.31Å; N897-R899 PolarHBondContact O-N 2.87Å; R899-L901 PolarHBondContact O-N 2.68Å
900	P	47.3	Very low	41.5	Very low	93 Å²	93	103.5 Å²	103.5	60%	0.604	60%	0.597	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.9	126.9	179.9	29.1	-34.1	0	0	0	111.5	L895	L895-P900 HydrophobicContact CD2-CB 4.07Å
901	L	47.7	Very low	40.9	Very low	58 Å²	58	104.3 Å²	104.3	30%	0.304	59%	0.589	S	S	.	*			trans	-83.5	-32	-174.9	-132	77.6	0	0	0	113.4	H649 M894 I896 R899	H649-L901 WeakPolarHBondContact NE2-CG 3.44Å; M894-L901 PolarHBondContact O-N 3.36Å; M894-L901 HydrophobicContact SD-CD2 4.4Å; I896-L901 HydrophobicContact CB-CD1 4Å; I896-L901 HydrophobicContact CD1-CD1 3.82Å; I896-L901 HydrophobicContact CD1-CD2 4.01Å; I896-L901 HydrophobicContact CG1-CD1 3.97Å; R899-L901 PolarHBondContact O-N 2.68Å
902	M	32.9	Very low	39.9	Very low	144 Å²	144	106.7 Å²	106.7	71%	0.709	61%	0.606	S	S	*	*			trans	-158.7	146.8	-177.9	-155.2	175.2	-165.6	0	0	109.8
903	R	34.1	Very low	39.4	Very low	227 Å²	227	109.4 Å²	109.4	86%	0.857	62%	0.621	S	S	*	*			trans	-103.4	129.3	159.4	-81.8	-172.5	179	179	1.3	108.2
904	I	34.3	Very low	38.4	Very low	120 Å²	120	114.3 Å²	114.3	62%	0.615	65%	0.65	S	S	*	*			trans	-91.3	107.8	165.6	-58.7	176	0	0	0	107	A906	I904-A906 PolarHBondContact O-N 3.47Å
905	S	31.1	Very low	37.8	Very low	110 Å²	110	116.7 Å²	116.7	77%	0.769	66%	0.664	S	S	*	*			trans	-77.5	113.9	174.9	-59.6	0	0	0	0	109.6
906	A	32.8	Very low	36.2	Very low	74 Å²	74	123 Å²	123	61%	0.612	70%	0.698	S	S	*	*			trans	-71.7	130.4	169.8	0	0	0	0	0	109.9	I904	I904-A906 PolarHBondContact O-N 3.47Å
907	S	30.2	Very low	35	Very low	121 Å²	121	124.5 Å²	124.5	85%	0.846	72%	0.715	S	S	*	*			trans	-69.7	133.5	174.5	-172.3	0	0	0	0	110.5	N909	S907-N909 PolarHBondContact O-N 3.12Å
908	S	30.5	Very low	34	Very low	104 Å²	104	130.5 Å²	130.5	73%	0.727	73%	0.729	S	S	*	*			trans	-92.3	94.5	-176.1	57.1	0	0	0	0	112
909	N	29.8	Very low	33.1	Very low	148 Å²	148	136 Å²	136	79%	0.791	75%	0.746	S	S	*	*			trans	-157.2	94.7	155.1	-107.3	-9.7	0	0	0	110.6	S907 S911	S907-N909 PolarHBondContact O-N 3.12Å; N909-S911 PolarHBondContact O-N 2.84Å
910	P	29.2	Very low	32.1	Very low	129 Å²	129	134.1 Å²	134.1	84%	0.838	75%	0.75	S	S	*	*			trans	-96.1	85.1	-178.6	35.6	-30.7	0	0	0	111.5
911	S	32.4	Very low	31.2	Very low	97 Å²	97	139 Å²	139	68%	0.678	76%	0.764	S	S	*	*			trans	-152.7	65.6	176.4	65.1	0	0	0	0	113	N909	N909-S911 PolarHBondContact O-N 2.84Å
912	D	31.6	Very low	30.2	Very low	169 Å²	169	142.4 Å²	142.4	90%	0.904	79%	0.788	S	S	*	*			trans	-172.6	112.8	133.2	-95	-20.7	0	0	0	109.2
913	V	30.1	Very low	30	Very low	140 Å²	140	139.2 Å²	139.2	85%	0.848	79%	0.792	S	S	*	*			trans	-131.1	105.9	-179.9	175.6	0	0	0	0	108.7
914	T	32.1	Very low	29.6	Very low	125 Å²	125	136.1 Å²	136.1	77%	0.767	78%	0.782	S	S	*	*			trans	-151.3	121.8	155.4	38.4	0	0	0	0	109.8
915	D	30.2	Very low	29.3	Very low	137 Å²	137	142 Å²	142	73%	0.733	80%	0.796	S	S	*	*			trans	43.1	109.8	146.9	-51.7	-32.3	0	0	0	120
916	N	29.6	Very low	29.1	Very low	154 Å²	154	143 Å²	143	82%	0.824	79%	0.793	S	S	*	*				-158.8	133	108.2	-104.2	-62.1	0	0	0	114.7
917	S	29.8	Very low	29	Very low	102 Å²	102	147.1 Å²	147.1	71%	0.713	81%	0.805	S	S	*	*			trans	33.3	94.8	153	63.8	0	0	0	0	120.1
918	W	25.6	Very low	28.8	Very low	239 Å²	239	148.9 Å²	148.9	91%	0.905	80%	0.804	S	S	*	*			trans	-75.4	119.7	153.3	17.8	-82.9	0	0	0	110.3
919	L	28.1	Very low	28.8	Very low	168 Å²	168	148.2 Å²	148.2	88%	0.88	81%	0.806	S	S	*	*			trans	-167.5	151.9	161.5	-113.1	166.3	0	0	0	112.9
920	L	25.6	Very low	28.6	Very low	158 Å²	158	148 Å²	148	83%	0.827	81%	0.809	S	S	*	*			trans	-84.8	148.9	168.8	-74.2	78.5	0	0	0	110.3
921	Q	27.7	Very low	28.4	Very low	194 Å²	194	147.7 Å²	147.7	91%	0.907	81%	0.809	S	S	*	*			trans	-144.4	128.9	157.3	-151.4	167.2	21.2	0	0	111.4
922	T	26.9	Very low	27.9	Very low	131 Å²	131	148.6 Å²	148.6	80%	0.804	81%	0.814	S	S	*	*			trans	-93.1	149.7	178.7	46.8	0	0	0	0	111.1
923	G	27.7	Very low	27.8	Very low	77 Å²	77	146.8 Å²	146.8	79%	0.794	81%	0.809	S	S	*	*			trans	-163.3	81.7	-177.6	0	0	0	0	0	114.1
924	Y	26.7	Very low	27.7	Very low	161 Å²	161	143.3 Å²	143.3	63%	0.631	79%	0.791	S	S	*	*			trans	-77.6	137.4	169.2	-109.9	-105.9	0	0	0	111.2	I634	I634-Y924 HydrophobicContact CD1-CD2 4.46Å; I634-Y924 HydrophobicContact CD1-CE2 4.04Å; I634-Y924 HydrophobicContact CG1-CE2 3.76Å
925	R	27.4	Very low	27.3	Very low	245 Å²	245	142 Å²	142	93%	0.925	79%	0.787	S	S	*	*			trans	-160.2	122.9	143.3	-114	174.6	-166.1	-144.5	1.8	111.9
926	N	27.1	Very low	27.2	Very low	129 Å²	129	144.5 Å²	144.5	69%	0.69	80%	0.796	S	S	*	*			trans	-79.1	159	164.6	-64.4	-16.9	0	0	0	109.8
927	N	30.4	Very low	27	Very low	162 Å²	162	140.7 Å²	140.7	87%	0.866	79%	0.794	S	S	*	*			trans	-151.5	136.5	145.7	-102.2	-14.8	0	0	0	110
928	N	27	Very low	26.9	Very low	157 Å²	157	144.5 Å²	144.5	84%	0.84	80%	0.802	S	S	*	*			trans	-103.4	-175.6	170.1	-74.9	-13.1	0	0	0	109.5
929	A	28.7	Very low	26.8	Very low	91 Å²	91	137.4 Å²	137.4	75%	0.752	78%	0.782	S	S	*	*			trans	78.6	124.2	-174.3	0	0	0	0	0	113.2
930	V	26.5	Very low	26.8	Very low	143 Å²	143	137.4 Å²	137.4	87%	0.867	78%	0.782	S	S	*	*			cis	72.1	102.2	46.8	-178.5	0	0	0	0	112.5
931	C	24.6	Very low	26.8	Very low	123 Å²	123	135.6 Å²	135.6	83%	0.831	77%	0.773	S	S	*	*				-168.8	169.5	114	-149.9	0	0	0	0	111.3
932	C	23.2	Very low	26.9	Very low	116 Å²	116	133.6 Å²	133.6	78%	0.784	77%	0.768	S	S	*	*			trans	-91.3	142.4	-179.5	-48.9	0	0	0	0	113
933	T	28.5	Very low	27	Very low	130 Å²	130	132.4 Å²	132.4	80%	0.798	77%	0.765	S	S	*	*			trans	-168.2	106.4	151.4	34.1	0	0	0	0	106.7
934	S	27.6	Very low	27.2	Very low	67 Å²	67	137.4 Å²	137.4	47%	0.469	77%	0.768	S	S	.	*				68.8	106.6	80.2	72.7	0	0	0	0	114.4
935	S	24.7	Very low	27.5	Very low	98 Å²	98	136 Å²	136	69%	0.685	78%	0.779	S	S	*	*			trans	32	117.1	147.7	-167.5	0	0	0	0	120.3
936	M	27.8	Very low	27.7	Very low	190 Å²	190	127.1 Å²	127.1	94%	0.936	76%	0.763	S	S	*	*				-172.8	142.6	111.5	-97.8	175.4	-158.5	0	0	109.9
937	G	24.6	Very low	27.8	Very low	74 Å²	74	126.5 Å²	126.5	76%	0.763	76%	0.763	S	S	*	*			trans	-119.5	151.2	-179.9	0	0	0	0	0	112.8
938	M	28.5	Very low	27.7	Very low	182 Å²	182	130 Å²	130	90%	0.897	77%	0.766	S	S	*	*			trans	-141.9	137.1	164.7	-86.6	-62.2	-70	0	0	109.6
939	N	24	Very low	27.8	Very low	89 Å²	89	127.6 Å²	127.6	48%	0.476	76%	0.758	S	S	.	*			trans	-86.8	150.4	172.6	-54.7	-79.8	0	0	0	110.1	F745	F745-N939 HydrophobicContact CE1-CB 4.45Å
940	L	28.6	Very low	27.9	Very low	169 Å²	169	129.7 Å²	129.7	89%	0.885	76%	0.761	S	S	*	*			trans	-149.2	140.4	155.9	-109.1	153.7	0	0	0	109
941	L	25.3	Very low	28.1	Very low	120 Å²	120	129 Å²	129	63%	0.628	76%	0.757	S	S	*	*			trans	-95.4	-178.2	-171.7	-69.5	88	0	0	0	112
942	N	29	Very low	28.3	Very low	151 Å²	151	128.5 Å²	128.5	81%	0.807	76%	0.755	S	S	*	*			trans	95.3	141.4	164.3	-49.4	-21.9	0	0	0	115.1
943	S	29.6	Very low	28.6	Very low	106 Å²	106	126.4 Å²	126.4	74%	0.741	75%	0.753	S	S	*	*			cis	-171.6	151.9	-16.4	46.2	0	0	0	0	109.9
944	E	31.2	Very low	28.7	Very low	182 Å²	182	124.7 Å²	124.7	85%	0.85	75%	0.752	S	S	*	*			trans	-67.1	160.9	169	-61.3	-170.6	128.6	0	0	112.6
945	P	33.6	Very low	28.8	Very low	133 Å²	133	130 Å²	130	86%	0.864	77%	0.769	S	S	*	*				-140.9	167.8	95.5	39.5	-27.4	0	0	0	114
946	G	31.8	Very low	29.3	Very low	58 Å²	58	130.7 Å²	130.7	60%	0.598	77%	0.774	S	S	*	*			cis	156.6	131.6	-9.4	0	0	0	0	0	114.5
947	V	28.8	Very low	29.4	Very low	115 Å²	115	129.1 Å²	129.1	70%	0.697	77%	0.769	S	S	*	*			trans	57.3	125	147.3	-178.3	0	0	0	0	121	T949	V947-T949 HydrophobicContact CG1-CG2 4.49Å
948	Y	28.5	Very low	30	Very low	236 Å²	236	132.3 Å²	132.3	93%	0.925	77%	0.774	S	S	*	*				-147	137.6	124.7	-98.9	-69.1	0	0	0	110.7
949	T	28.6	Very low	30	Very low	107 Å²	107	130.5 Å²	130.5	66%	0.656	77%	0.768	S	S	*	*			trans	-150	139.1	-166.4	53.4	0	0	0	0	114.3	V947	V947-T949 HydrophobicContact CG1-CG2 4.49Å
950	T	31.6	Very low	30.4	Very low	135 Å²	135	132.2 Å²	132.2	83%	0.828	79%	0.787	S	S	*	*			trans	-145.8	114.6	156.7	49.5	0	0	0	0	107.6
951	V	29.4	Very low	30.4	Very low	127 Å²	127	132.5 Å²	132.5	77%	0.77	79%	0.789	S	S	*	*				69.3	123.3	57.7	-177.2	0	0	0	0	109.7
952	S	30.7	Very low	30.7	Very low	114 Å²	114	130.6 Å²	130.6	80%	0.797	80%	0.798	S	S	*	*			cis	-162	164.3	16.9	37.6	0	0	0	0	114
953	G	29.3	Very low	30.7	Very low	71 Å²	71	128 Å²	128	73%	0.732	80%	0.798	S	S	*	*			trans	91.6	134.8	167.5	0	0	0	0	0	114.2
954	A	30	Very low	30.6	Very low	94 Å²	94	128.2 Å²	128.2	78%	0.777	80%	0.799	S	S	*	*			cis	66.9	130.7	21.7	0	0	0	0	0	113.8
955	E	29.7	Very low	30.4	Very low	180 Å²	180	125.1 Å²	125.1	84%	0.841	79%	0.793	S	S	*	*			cis	-160.6	174.3	12.2	-149.7	162.8	-119.7	0	0	112.7
956	S	34.9	Very low	30.1	Very low	112 Å²	112	127.2 Å²	127.2	78%	0.783	79%	0.794	S	S	*	*			trans	74.6	152.1	162.1	70.5	0	0	0	0	121.8
957	D	29.8	Very low	29.8	Very low	157 Å²	157	128.9 Å²	128.9	84%	0.84	80%	0.796	S	S	*	*			trans	-92.5	171.4	-175.8	-43.4	-94.7	0	0	0	114.2
958	V	37.2	Very low	30.1	Very low	141 Å²	141	128.3 Å²	128.3	86%	0.855	79%	0.794	S	S	*	*			trans	164.1	145.3	131.6	154.2	0	0	0	0	110.9
959	D	28	Very low	30	Very low	144 Å²	144	124.3 Å²	124.3	77%	0.77	78%	0.784	S	S	*	*			trans	-60.6	149.2	178.4	-51.2	-89.2	0	0	0	114.8
960	S	32.9	Very low	29.9	Very low	125 Å²	125	129.5 Å²	129.5	87%	0.874	79%	0.793	S	S	*	*			trans	-160.2	136.3	137	-87.5	0	0	0	0	113.2
961	N	29.1	Very low	29.7	Very low	174 Å²	174	126.9 Å²	126.9	93%	0.93	79%	0.785	S	S	*	*			trans	-74.1	139.8	173.6	-65.7	-76.1	0	0	0	110.9
962	G	31.6	Very low	29.6	Very low	80 Å²	80	125.6 Å²	125.6	83%	0.825	78%	0.782	S	S	*	*			trans	-152.5	76.4	178.4	0	0	0	0	0	111.8
963	A	28.4	Very low	29.4	Very low	98 Å²	98	126.2 Å²	126.2	81%	0.81	78%	0.781	S	S	*	*			trans	-78.4	154.8	-177.1	0	0	0	0	0	113.1
964	S	27.2	Very low	29.4	Very low	109 Å²	109	127.9 Å²	127.9	76%	0.762	78%	0.781	S	S	*	*			trans	134.4	141.4	153.3	-63.5	0	0	0	0	112
965	T	27.5	Very low	29.3	Very low	117 Å²	117	131.2 Å²	131.2	72%	0.718	78%	0.783	S	S	*	*			cis	-173.4	161.4	-17.7	29.4	0	0	0	0	107
966	M	28	Very low	29.4	Very low	178 Å²	178	128.9 Å²	128.9	88%	0.877	78%	0.776	S	S	*	*			trans	65.5	104.9	156.3	-70.6	166.2	60.3	0	0	119.9
967	S	24.6	Very low	29.2	Very low	93 Å²	93	131 Å²	131	65%	0.65	77%	0.773	S	S	*	*			trans	-68.3	178	138.1	-19.2	0	0	0	0	111.1
968	P	35.6	Very low	29.1	Very low	102 Å²	102	130 Å²	130	66%	0.662	77%	0.767	S	S	*	*			cis	-137	-167.9	-8.7	44.1	-27	0	0	0	114.4
969	E	25.3	Very low	29.2	Very low	153 Å²	153	133.6 Å²	133.6	72%	0.715	77%	0.767	S	S	*	*			trans	70.1	152.1	152.6	-71.4	176.8	-163.6	0	0	122.1
970	Y	27.2	Very low	29.5	Very low	216 Å²	216	132.9 Å²	132.9	85%	0.847	77%	0.77	S	S	*	*			trans	56.9	142.4	174.6	-61.1	-89.3	0	0	0	118.9
971	A	27.8	Very low	29.3	Very low	79 Å²	79	134.3 Å²	134.3	65%	0.653	77%	0.767	S	S	*	*			cis	-166	151.9	-20.2	0	0	0	0	0	113.1
972	S	27.2	Very low	29.3	Very low	100 Å²	100	133.9 Å²	133.9	70%	0.699	76%	0.763	S	S	*	*			trans	59.5	107	138.8	-62.6	0	0	0	0	123.7
973	T	27	Very low	29.3	Very low	128 Å²	128	134.7 Å²	134.7	79%	0.785	76%	0.763	S	S	*	*				82.6	158.6	120.9	64.4	0	0	0	0	123
974	S	28.5	Very low	29.6	Very low	105 Å²	105	134.3 Å²	134.3	73%	0.734	76%	0.759	S	S	*	*			trans	86.1	131	160.4	88.7	0	0	0	0	115.7
975	M	28.9	Very low	30	Very low	164 Å²	164	134.8 Å²	134.8	81%	0.808	76%	0.758	S	S	*	*			cis	-150.8	177.8	-13.9	-70.1	-152.6	178.1	0	0	108.1
976	L	31.5	Very low	30	Very low	132 Å²	132	133.4 Å²	133.4	69%	0.691	75%	0.745	S	S	*	*			cis	176.7	166.5	-42.6	-154.3	155.7	0	0	0	104.9
977	H	30.8	Very low	30	Very low	156 Å²	156	127.5 Å²	127.5	72%	0.722	73%	0.725	S	S	*	*			trans	84.6	129.6	-179.2	-61.2	-74.5	0	0	0	116
978	D	27.2	Very low	30.3	Very low	135 Å²	135	131.8 Å²	131.8	72%	0.722	74%	0.735	S	S	*	*	S	Bend	cis	-131.2	125.2	3.5	-80.3	-47.8	0	0	0	113.1
979	Y	38.7	Very low	30.2	Very low	217 Å²	217	135.3 Å²	135.3	85%	0.851	75%	0.747	S	S	*	*			trans	-157.1	139.2	158.1	-100.2	-82.8	0	0	0	108.4
980	P	33.9	Very low	30.3	Very low	129 Å²	129	135.1 Å²	135.1	84%	0.838	75%	0.751	S	S	*	*			trans	-80	130.4	-174.9	30.8	-34.1	0	0	0	112.3
981	I	30.2	Very low	30.4	Very low	156 Å²	156	133.1 Å²	133.1	80%	0.8	75%	0.75	S	S	*	*			trans	-114.4	145.2	-171.3	-68.2	177.9	0	0	0	113.3
982	L	29.3	Very low	30.7	Very low	164 Å²	164	137.8 Å²	137.8	86%	0.859	76%	0.758	S	S	*	*			trans	-35.2	-179.2	164.6	-139.7	71.9	0	0	0	118.4
983	A	30.8	Very low	31	Very low	98 Å²	98	143.8 Å²	143.8	81%	0.81	77%	0.765	S	S	*	*			trans	79	22.8	161.9	0	0	0	0	0	118.2	T985	A983-T985 PolarHBondContact O-N 3.26Å
984	A	33.8	Very low	31	Very low	90 Å²	90	145.7 Å²	145.7	74%	0.744	77%	0.769	S	S	*	*			trans	-79	113.7	161.5	0	0	0	0	0	112.1
985	T	36.4	Very low	30.8	Very low	118 Å²	118	145.3 Å²	145.3	72%	0.724	77%	0.773	S	S	*	*			trans	53.4	63.5	144.9	60.8	0	0	0	0	119.1	A983 A987	A983-T985 PolarHBondContact O-N 3.26Å; T985-A987 VanDerWaalsContact C-N 3.28Å; T985-A987 PolarHBondContact O-N 3.48Å
986	L	27.7	Very low	30.9	Very low	88 Å²	88	142.1 Å²	142.1	46%	0.461	77%	0.773	S	S	.	*	S	Bend	trans	-87.3	75.9	149.1	-136.8	165.2	0	0	0	107.4	T657 T659	T657-L986 HydrophobicContact CG2-CD1 4.35Å; T659-L986 HydrophobicContact CG2-CD2 3.56Å; T659-L986 WeakPolarHBondContact CG2-O 3.04Å
987	A	27.4	Very low	30.9	Very low	55 Å²	55	142.5 Å²	142.5	46%	0.455	78%	0.78	S	S	.	*	S	Bend	trans	-160.6	4	-175.6	0	0	0	0	0	115.5	T985	T985-A987 VanDerWaalsContact C-N 3.28Å; T985-A987 PolarHBondContact O-N 3.48Å
988	Q	32	Very low	30.8	Very low	182 Å²	182	142.1 Å²	142.1	85%	0.85	78%	0.783	S	S	*	*			trans	-153.6	64.4	-170.3	-137.9	170.6	29.6	0	0	116.4
989	L	32.8	Very low	30.9	Very low	177 Å²	177	141.8 Å²	141.8	93%	0.927	79%	0.786	S	S	*	*			trans	-149.7	54.8	156.3	-127.3	168.7	0	0	0	112.4
990	N	27.9	Very low	30.6	Very low	149 Å²	149	136.8 Å²	136.8	80%	0.797	78%	0.78	S	S	*	*			trans	-82.6	158.8	170	-159.7	-17	0	0	0	110.1
991	Q	27.8	Very low	30.2	Very low	174 Å²	174	135.1 Å²	135.1	81%	0.813	77%	0.771	S	S	*	*			trans	63.2	94.6	175.7	-55.1	-175.1	-0.7	0	0	118.2
992	Q	34.5	Very low	30.1	Very low	177 Å²	177	135.9 Å²	135.9	83%	0.827	77%	0.774	S	S	*	*			trans	-151.1	121.2	133.1	-110.8	-174.1	44.7	0	0	111.7
993	R	33.9	Very low	29.9	Very low	226 Å²	226	135 Å²	135	85%	0.853	77%	0.77	S	S	*	*			trans	54.2	105.8	160.4	-60.8	-179.9	179	-176.5	-0.8	116.8
994	L	26.7	Very low	29.9	Very low	167 Å²	167	138.4 Å²	138.4	87%	0.874	77%	0.773	S	S	*	*			cis	69	120.2	24	-147.2	157.7	0	0	0	114
995	A	25.8	Very low	29.8	Very low	97 Å²	97	141.4 Å²	141.4	80%	0.802	77%	0.772	S	S	*	*			trans	72.2	88.1	171.4	0	0	0	0	0	120.6
996	A	30.3	Very low	29.6	Very low	98 Å²	98	140.7 Å²	140.7	81%	0.81	77%	0.769	S	S	*	*			trans	-167.3	130.8	146.2	0	0	0	0	0	108.5
997	T	31.3	Very low	29.7	Very low	139 Å²	139	142.8 Å²	142.8	85%	0.853	78%	0.781	S	S	*	*			cis	-141.7	144	-4.6	-58.4	0	0	0	0	109.8
998	L	28	Very low	29.8	Very low	149 Å²	149	144.1 Å²	144.1	78%	0.78	78%	0.78	S	S	*	*			trans	-76.8	147.6	178.1	-61.6	123.7	0	0	0	112.3
999	T	31	Very low	29.7	Very low	128 Å²	128	144.9 Å²	144.9	79%	0.785	78%	0.776	S	S	*	*			trans	41.9	157.4	140.5	58.2	0	0	0	0	121
1000	P	32	Very low	29.7	Very low	111 Å²	111	141.1 Å²	141.1	72%	0.721	76%	0.762	S	S	*	*			cis	-144.3	-168.8	23	41	-18.5	0	0	0	117.4
1001	S	25.6	Very low	29.6	Very low	94 Å²	94	139 Å²	139	66%	0.657	76%	0.758	S	S	*	*			trans	75.2	118.7	141.9	63.4	0	0	0	0	123.1
1002	M	27	Very low	29.7	Very low	173 Å²	173	136.3 Å²	136.3	85%	0.852	76%	0.758	S	S	*	*				77.1	118.5	127.3	-68.4	179.5	174.6	0	0	122.3
1003	N	25.2	Very low	29.8	Very low	145 Å²	145	135.1 Å²	135.1	78%	0.775	76%	0.758	S	S	*	*			trans	43.4	120.3	135	-70.1	-13.5	0	0	0	120.4
1004	I	30.9	Very low	29.8	Very low	170 Å²	170	128.6 Å²	128.6	87%	0.872	74%	0.744	S	S	*	*				-155.9	114.2	88.9	-92.7	152.8	0	0	0	110
1005	Q	30.9	Very low	29.8	Very low	153 Å²	153	127.3 Å²	127.3	72%	0.715	74%	0.738	S	S	*	*			trans	-88.2	167.4	153.9	-108	-173.6	-8.2	0	0	107.8
1006	P	33.1	Very low	29.8	Very low	102 Å²	102	128.3 Å²	128.3	66%	0.662	73%	0.73	S	S	*	*			cis	-143.3	-163.1	34.6	46.4	-27.1	0	0	0	113.2	L1008	P1006-L1008 HydrophobicContact CB-CD1 4.34Å
1007	N	30.6	Very low	29.6	Very low	133 Å²	133	131 Å²	131	71%	0.711	73%	0.729	S	S	*	*			cis	-129	144.9	-2.1	-93.3	-56.1	0	0	0	107.5
1008	L	27.8	Very low	29.3	Very low	83 Å²	83	127 Å²	127	44%	0.435	72%	0.716	S	S	.	*				61.4	138.4	62.5	-72	85.3	0	0	0	112.5	P1006	P1006-L1008 HydrophobicContact CB-CD1 4.34Å
1009	Y	30	Very low	29.1	Very low	197 Å²	197	125.2 Å²	125.2	77%	0.773	72%	0.715	S	S	*	*			cis	-174	-173.4	1.9	-118.8	-164.8	0	0	0	107.8
1010	P	33.7	Very low	28.8	Very low	98 Å²	98	124.1 Å²	124.1	64%	0.636	71%	0.713	S	S	*	*			cis	-135.5	176.7	-28.8	35.7	-17	0	0	0	115
1011	C	25.3	Very low	28.4	Very low	106 Å²	106	123 Å²	123	72%	0.716	71%	0.708	S	S	*	*			trans	2.2	156	135	-45.2	0	0	0	0	120
1012	S	30.6	Very low	28.3	Very low	117 Å²	117	125.8 Å²	125.8	82%	0.818	72%	0.715	S	S	*	*			cis	-156	157.3	39.7	-59.6	0	0	0	0	117
1013	N	35.4	Very low	28.1	Very low	152 Å²	152	122.8 Å²	122.8	81%	0.813	71%	0.71	S	S	*	*			trans	-77	-156.7	158.6	-146.1	12.1	0	0	0	108.5
1014	P	35.7	Very low	28	Very low	88 Å²	88	120.7 Å²	120.7	57%	0.571	71%	0.707	S	S	*	*			cis	-143.5	-161.5	-6.5	25.8	3.6	0	0	0	114.9
1015	L	25.9	Very low	27.6	Very low	141 Å²	141	118.2 Å²	118.2	74%	0.738	70%	0.7	S	S	*	*			trans	76.1	152.8	154.8	-51.1	-174.4	0	0	0	117.5
1016	N	25.6	Very low	27.3	Very low	117 Å²	117	116.6 Å²	116.6	63%	0.626	70%	0.696	S	S	*	*			cis	-161.6	166.6	-9.4	-121.8	-12.7	0	0	0	111.7
1017	I	25.7	Very low	27	Very low	154 Å²	154	117.7 Å²	117.7	79%	0.79	69%	0.691	S	S	*	*			trans	46.1	132.2	144	-58.5	160.9	0	0	0	117.9
1018	G	24.7	Very low	26.7	Very low	57 Å²	57	118.1 Å²	118.1	59%	0.588	69%	0.693	S	S	*	*			cis	155.1	-173.9	9.6	0	0	0	0	0	109.3
1019	S	24.8	Very low	26.6	Very low	110 Å²	110	120.7 Å²	120.7	77%	0.769	71%	0.706	S	S	*	*			trans	53	106.6	173.3	46.3	0	0	0	0	117.4
1020	S	23.8	Very low	26.4	Very low	105 Å²	105	118.5 Å²	118.5	73%	0.734	71%	0.706	S	S	*	*				91.5	154	60.4	71.7	0	0	0	0	115.3
1021	S	24.8	Very low	26	Very low	89 Å²	89	117.7 Å²	117.7	62%	0.622	70%	0.703	S	S	*	*			trans	66.2	108	155.1	55	0	0	0	0	121.6
1022	N	23.6	Very low	26.1	Very low	151 Å²	151	120.1 Å²	120.1	81%	0.807	71%	0.709	S	S	*	*				81.6	153.9	118.9	-61.3	-2.2	0	0	0	122.6
1023	C	22.2	Very low	26.7	Very low	110 Å²	110	119.8 Å²	119.8	74%	0.743	70%	0.704	S	S	*	*			trans	67.4	110.3	157.1	-66.2	0	0	0	0	117.4
1024	S	22.2	Very low	26.9	Very low	101 Å²	101	117.4 Å²	117.4	71%	0.706	70%	0.697	S	S	*	*				70.9	140.8	65.2	83.6	0	0	0	0	112.4
1025	V	23.6	Very low	26.5	Very low	119 Å²	119	119.8 Å²	119.8	72%	0.721	70%	0.704	S	S	*	*			cis	175	152.7	9	123.6	0	0	0	0	105.5
1026	N	24	Very low	26.5	Very low	118 Å²	118	119.9 Å²	119.9	63%	0.631	71%	0.705	S	S	*	*			trans	72.3	122.6	160.3	-72.4	0.9	0	0	0	124.7
1027	F	26.3	Very low	26.7	Very low	126 Å²	126	119.4 Å²	119.4	55%	0.553	71%	0.711	S	S	*	*				38.1	130.4	123.1	-70.4	-95	0	0	0	122.4	Y1150	F1027-Y1150 HydrophobicContact CE2-CE2 4.37Å; F1027-Y1150 AromaticContact CE2-CZ 3.98Å; F1027-Y1150 WeakPolarHBondContact CE2-OH 3.47Å; F1027-Y1150 AromaticContact CZ-CE2 3.81Å; F1027-Y1150 HydrophobicContact CZ-CE2 3.81Å; F1027-Y1150 AromaticContact CZ-CZ 3.89Å; F1027-Y1150 VanDerWaalsContact CZ-OH 3.27Å; F1027-Y1150 WeakPolarHBondContact CZ-OH 3.25Å
1028	N	26.1	Very low	27.2	Very low	142 Å²	142	116.7 Å²	116.7	76%	0.759	70%	0.704	S	S	*	*				161.8	154.4	120.6	-86.6	-20.3	0	0	0	110.2
1029	I	25.5	Very low	27.3	Very low	137 Å²	137	120.4 Å²	120.4	70%	0.703	70%	0.704	S	S	*	*			cis	-169	179.5	-20.6	-123.2	173	0	0	0	106.8
1030	L	25	Very low	27.6	Very low	150 Å²	150	118.8 Å²	118.8	79%	0.785	69%	0.692	S	S	*	*			trans	79.2	105.8	160.3	-116.7	70.4	0	0	0	121.4
1031	S	25.5	Very low	27.9	Very low	82 Å²	82	116.9 Å²	116.9	57%	0.573	67%	0.674	S	S	*	*				68.7	115.4	118.8	71.3	0	0	0	0	124.8
1032	N	26.7	Very low	28.2	Very low	156 Å²	156	119 Å²	119	83%	0.834	68%	0.679	S	S	*	*				90.4	146.3	121.3	-66.8	-2.6	0	0	0	122.6
1033	P	42.9	Very low	28.6	Very low	110 Å²	110	117.3 Å²	117.3	71%	0.714	68%	0.678	S	S	*	*			trans	-112.3	-148	-179.7	48.2	-36.4	0	0	0	109.9
1034	P	40.5	Very low	29.1	Very low	102 Å²	102	119 Å²	119	66%	0.662	68%	0.68	S	S	*	*			cis	-123.9	-160.1	-24.2	37.6	-19.1	0	0	0	111.6
1035	L	26.8	Very low	29.4	Very low	138 Å²	138	121.7 Å²	121.7	72%	0.723	69%	0.685	S	S	*	*				156.7	134.2	127.6	-82.5	158.8	0	0	0	115.1
1036	N	27.1	Very low	29.6	Very low	143 Å²	143	122 Å²	122	77%	0.765	68%	0.682	S	S	*	*			trans	57.8	152.8	142.8	-63.1	-6.4	0	0	0	122.1
1037	S	28.4	Very low	29.9	Very low	107 Å²	107	122.9 Å²	122.9	75%	0.748	69%	0.686	S	S	*	*			cis	-169.9	173.1	-19.7	57	0	0	0	0	108.9
1038	P	37	Very low	29.9	Very low	98 Å²	98	123.3 Å²	123.3	64%	0.636	69%	0.694	S	S	*	*			trans	-118.9	-174.1	-157.1	43.8	-35.3	0	0	0	116.6
1039	F	27.4	Very low	29.9	Very low	134 Å²	134	121.5 Å²	121.5	59%	0.588	69%	0.692	S	S	*	*				172.4	175.3	122.4	-93.1	-69.4	0	0	0	111.6	I1117 L1119	F1039-I1117 HydrophobicContact CB-CD1 3.29Å; F1039-I1117 HydrophobicContact CB-CG1 3.79Å; F1039-L1119 HydrophobicContact CD1-CD1 4.25Å; F1039-L1119 HydrophobicContact CE1-CD1 4.06Å; F1039-L1119 HydrophobicContact CE1-CD2 3.89Å; F1039-L1119 HydrophobicContact CE1-CG 4.44Å
1040	S	30.6	Very low	29.9	Very low	76 Å²	76	120.1 Å²	120.1	53%	0.531	70%	0.695	S	S	.	*			trans	-145.3	169.9	-172.9	55.5	0	0	0	0	113.4	I1117 G1118	S1040-I1117 VanDerWaalsContact O-CA 3.29Å; S1040-I1117 WeakPolarHBondContact O-CA 3.2Å; S1040-G1118 CarbonylContact C-O 3.56Å; S1040-G1118 CarbonylContact O-C 3.31Å; S1040-G1118 WeakPolarHBondContact O-CA 3.17Å; S1040-G1118 PolarHBondContact O-N 3.15Å
1041	N	29.3	Very low	30.1	Very low	66 Å²	66	118.4 Å²	118.4	35%	0.353	69%	0.691	S	S	.	*			trans	-174.7	-178.6	159.7	-142.7	-7.5	0	0	0	108.7	I1117 G1118	N1041-I1117 VanDerWaalsContact CB-CA 3.47Å; N1041-I1117 PolarHBondContact ND2-O 2.82Å; N1041-G1118 WeakPolarHBondContact CA-O 3.38Å; N1041-G1118 WeakPolarHBondContact CB-O 3.5Å; N1041-G1118 PolarHBondContact ND2-N 2.58Å; N1041-G1118 VanDerWaalsContact ND2-N 3.15Å; N1041-G1118 PolarHBondContact ND2-O 2.56Å; N1041-G1118 PolarHBondContact OD1-O 2.94Å
1042	N	31.2	Very low	30	Very low	133 Å²	133	125.6 Å²	125.6	71%	0.711	71%	0.707	S	S	*	*			cis	75.6	141.9	0.5	-3.7	-83	0	0	0	123.9
1043	S	32.8	Very low	30.1	Very low	115 Å²	115	121.9 Å²	121.9	80%	0.804	71%	0.705	S	S	*	*			trans	-164.3	150.8	131.2	70.5	0	0	0	0	108.4
1044	N	31.9	Very low	29.2	Very low	146 Å²	146	123.3 Å²	123.3	78%	0.781	71%	0.707	S	S	*	*			trans	-102.5	159.5	-176.2	-66.7	-46.6	0	0	0	112
1045	I	28.3	Very low	28.8	Very low	157 Å²	157	125.4 Å²	125.4	81%	0.805	71%	0.711	S	S	*	*			trans	-176.4	106.1	143.7	-96.9	148.1	0	0	0	107.4
1046	I	27.6	Very low	28.7	Very low	127 Å²	127	126.2 Å²	126.2	65%	0.651	72%	0.716	S	S	*	*				78	100.6	77.7	-68.2	164.6	0	0	0	113.5
1047	N	30.6	Very low	28.6	Very low	135 Å²	135	123.8 Å²	123.8	72%	0.722	71%	0.71	S	S	*	*				175.3	109.2	115.6	-99.1	-44.4	0	0	0	115.6
1048	N	26.2	Very low	28.5	Very low	136 Å²	136	126 Å²	126	73%	0.727	71%	0.709	S	S	*	*				45.4	156	116.1	-67	-31.2	0	0	0	125.1
1049	S	26.9	Very low	28.1	Very low	103 Å²	103	128.9 Å²	128.9	72%	0.72	71%	0.711	S	S	*	*			trans	65.6	103.9	159.7	43.5	0	0	0	0	117
1050	S	25.1	Very low	28.1	Very low	108 Å²	108	129 Å²	129	76%	0.755	72%	0.718	S	S	*	*				80.1	147.1	89.1	79.5	0	0	0	0	112.7
1051	T	28.5	Very low	27.9	Very low	115 Å²	115	132.1 Å²	132.1	71%	0.706	73%	0.728	S	S	*	*			cis	-161.9	153.5	46.6	-46.3	0	0	0	0	111.2
1052	Y	24.9	Very low	27.8	Very low	233 Å²	233	137.6 Å²	137.6	91%	0.914	75%	0.75	S	S	*	*			trans	8.7	132.5	163	-77.3	-112	0	0	0	120.9
1053	G	29.1	Very low	27.5	Very low	77 Å²	77	137.5 Å²	137.5	79%	0.794	75%	0.748	S	S	*	*			trans	-168.6	54	170.8	0	0	0	0	0	114.6
1054	N	24.2	Very low	27.3	Very low	140 Å²	140	138.9 Å²	138.9	75%	0.749	75%	0.745	S	S	*	*			trans	-79.1	116.6	-179.2	-179.7	14.1	0	0	0	111.9
1055	I	30.4	Very low	26.9	Very low	147 Å²	147	136.6 Å²	136.6	75%	0.754	74%	0.741	S	S	*	*			trans	-134.9	86.4	165.6	-53	-178	0	0	0	110.1
1056	N	25	Very low	27	Very low	155 Å²	155	137 Å²	137	83%	0.829	74%	0.741	S	S	*	*			trans	-88.5	114.4	153.1	-97.3	-24.8	0	0	0	108.7
1057	S	25.8	Very low	27.1	Very low	91 Å²	91	137.2 Å²	137.2	64%	0.636	74%	0.744	S	S	*	*			trans	169.2	153.6	167.6	34.6	0	0	0	0	109.2
1058	H	26.5	Very low	26.9	Very low	155 Å²	155	136.9 Å²	136.9	72%	0.718	75%	0.747	S	S	*	*			cis	-162.2	167.4	-28.3	-127.9	-15.8	0	0	0	107.6
1059	K	27	Very low	27	Very low	157 Å²	157	137 Å²	137	68%	0.683	75%	0.746	S	S	*	*			trans	10.1	121.9	149.2	-59.8	164.7	178.1	168.1	0	118.2
1060	N	28	Very low	27.1	Very low	138 Å²	138	137.7 Å²	137.7	74%	0.738	74%	0.738	S	S	*	*				170.7	129.5	104.3	-85	-43.8	0	0	0	109.6
1061	N	26.6	Very low	27.1	Very low	140 Å²	140	141.2 Å²	141.2	75%	0.749	74%	0.742	S	S	*	*				50.6	111.1	74	-84.2	-16.9	0	0	0	114
1062	F	26.8	Very low	27.4	Very low	182 Å²	182	140 Å²	140	80%	0.798	74%	0.737	S	S	*	*			trans	-175.1	118.6	133.5	-114.4	-140.6	0	0	0	112.5
1063	L	26.2	Very low	27.5	Very low	131 Å²	131	136.3 Å²	136.3	69%	0.686	73%	0.732	S	S	*	*			trans	60.6	156.1	136.4	-49.5	-174.8	0	0	0	119.3
1064	I	28.2	Very low	27.3	Very low	143 Å²	143	138.4 Å²	138.4	73%	0.733	72%	0.724	S	S	*	*			cis	-150.5	172.1	-11.7	-125	168.1	0	0	0	110.9
1065	S	23.6	Very low	27.4	Very low	98 Å²	98	139.7 Å²	139.7	69%	0.685	72%	0.723	S	S	*	*			trans	-71.3	152.7	177.4	51	0	0	0	0	115.6
1066	M	29	Very low	27.2	Very low	167 Å²	167	136.7 Å²	136.7	82%	0.823	71%	0.712	S	S	*	*			trans	169.5	145.9	140.3	-91.3	-159.3	178.2	0	0	108.3
1067	N	31.1	Very low	27.4	Very low	131 Å²	131	136.1 Å²	136.1	70%	0.701	71%	0.709	S	S	*	*			cis	-147.2	154.5	0.1	-104.6	-32.8	0	0	0	111.2
1068	T	25	Very low	27.9	Very low	128 Å²	128	136.1 Å²	136.1	79%	0.785	71%	0.707	S	S	*	*			trans	-85.1	138.5	166.1	16	0	0	0	0	111.6
1069	I	29.4	Very low	28	Very low	139 Å²	139	134 Å²	134	71%	0.713	70%	0.697	S	S	*	*			trans	-159.2	107.1	151.5	-101.4	145.7	0	0	0	112.1
1070	Q	28	Very low	28.2	Very low	116 Å²	116	130.2 Å²	130.2	54%	0.542	69%	0.69	S	S	.	*			trans	36.3	110.3	136.6	-53.1	-177.4	-69	0	0	122.8	N786	N786-Q1070 VanDerWaalsContact CG-NE2 3.28Å; N786-Q1070 PolarHBondContact ND2-NE2 2.69Å; N786-Q1070 PolarHBondContact ND2-OE1 2.94Å; N786-Q1070 PolarHBondContact OD1-NE2 3.37Å
1071	Q	26.5	Very low	28.3	Very low	182 Å²	182	132.1 Å²	132.1	85%	0.85	70%	0.697	S	S	*	*				10	159	121	-70.6	-171.9	4.2	0	0	121.4
1072	P	34	Very low	28.5	Very low	91 Å²	91	136.9 Å²	136.9	59%	0.591	71%	0.706	S	S	*	*			cis	-140.3	-138.1	-29.2	41.3	-21.3	0	0	0	111.1
1073	L	27.6	Very low	28.6	Very low	154 Å²	154	135.8 Å²	135.8	81%	0.806	71%	0.709	S	S	*	*			trans	85.9	145.2	179.4	-51	164.9	0	0	0	113.7
1074	L	25.1	Very low	28.8	Very low	122 Å²	122	137 Å²	137	64%	0.639	71%	0.712	S	S	*	*			cis	-175.8	145.7	-29	-118.1	-179.8	0	0	0	105.6
1075	F	26.1	Very low	28.9	Very low	167 Å²	167	138.9 Å²	138.9	73%	0.732	72%	0.72	S	S	*	*			trans	62.6	158.1	171.8	-59.9	-64.2	0	0	0	117.2
1076	T	26.6	Very low	29.1	Very low	84 Å²	84	142.6 Å²	142.6	52%	0.515	73%	0.729	S	S	.	*				-169	143.1	-51.2	17.3	0	0	0	0	107.3
1077	N	27.6	Very low	29	Very low	143 Å²	143	143 Å²	143	77%	0.765	73%	0.731	S	S	*	*			trans	66.5	164.7	167.9	-106.3	-15.6	0	0	0	115.4
1078	P	37.9	Very low	28.9	Very low	91 Å²	91	143.9 Å²	143.9	59%	0.591	74%	0.735	S	S	*	*			cis	-136.3	149.7	38.6	39.8	-21.5	0	0	0	118.8
1079	H	28.7	Very low	29.3	Very low	110 Å²	110	145 Å²	145	51%	0.509	74%	0.742	S	S	.	*			trans	-73.4	134.9	140.8	-80.1	-124	0	0	0	109.1	Q81	Q81-H1079 PolarHBondContact OE1-CE1 2.7Å; Q81-H1079 VanDerWaalsContact OE1-CE1 3.27Å; Q81-H1079 PolarHBondContact OE1-ND1 2.86Å
1080	S	30.6	Very low	29.4	Very low	78 Å²	78	143.9 Å²	143.9	55%	0.545	74%	0.742	S	S	.	*			trans	153	77.9	154.9	-178.7	0	0	0	0	111
1081	M	30.5	Very low	29.6	Very low	178 Å²	178	147.1 Å²	147.1	88%	0.877	75%	0.754	S	S	*	*			trans	-147.5	60.3	170	-80	-165.7	65.3	0	0	111.9
1082	Y	30.5	Very low	29.9	Very low	239 Å²	239	144.2 Å²	144.2	94%	0.937	75%	0.749	S	S	*	*	S	Bend	trans	-153.1	24.2	161.4	-120.3	-70.7	0	0	0	114.7
1083	D	29.2	Very low	29.9	Very low	160 Å²	160	145.8 Å²	145.8	86%	0.856	76%	0.757	S	S	*	*	S	Bend	trans	-135	34	-168.1	-145.2	6.5	0	0	0	112.2
1084	M	30.7	Very low	30.1	Very low	155 Å²	155	144.1 Å²	144.1	76%	0.764	75%	0.753	S	S	*	*	S	Bend	trans	-151.8	36.1	-173.9	-155.1	179.2	-70.3	0	0	114.7
1085	M	29.6	Very low	30.4	Very low	183 Å²	183	144.6 Å²	144.6	90%	0.901	76%	0.761	S	S	*	*	S	Bend	trans	-142.6	39.8	168.8	-151.5	171.6	76.9	0	0	114.3
1086	M	26.6	Very low	30.6	Very low	177 Å²	177	140.7 Å²	140.7	87%	0.872	76%	0.76	S	S	*	*			trans	-139.1	68.1	171.3	-79.8	-64.1	-75.4	0	0	112
1087	M	28.6	Very low	30.9	Very low	174 Å²	174	143.8 Å²	143.8	86%	0.857	78%	0.779	S	S	*	*			trans	-164.1	112	150.3	-118.2	-175.4	-79.9	0	0	114.4
1088	L	28.4	Very low	30.9	Very low	150 Å²	150	141.8 Å²	141.8	79%	0.785	78%	0.783	S	S	*	*			trans	35.1	116.5	139.9	-63.9	165.5	0	0	0	120.7
1089	T	33.9	Very low	30.6	Very low	151 Å²	151	141.8 Å²	141.8	93%	0.926	79%	0.79	S	S	*	*				-161.3	159.9	118	8	0	0	0	0	111.3
1090	T	30.8	Very low	30.5	Very low	116 Å²	116	144.2 Å²	144.2	71%	0.712	81%	0.805	S	S	*	*			trans	-126.4	144	-162.9	53.7	0	0	0	0	114
1091	K	32.3	Very low	30.6	Very low	185 Å²	185	146.5 Å²	146.5	80%	0.804	82%	0.816	S	S	*	*				157.5	136	124	-87.6	175.4	179.3	-179.6	0	114.5
1092	T	32.2	Very low	30.4	Very low	120 Å²	120	144.1 Å²	144.1	74%	0.736	81%	0.812	S	S	*	*			trans	35.4	131.5	142.4	65.1	0	0	0	0	120
1093	T	33.9	Very low	30.5	Very low	124 Å²	124	137.6 Å²	137.6	76%	0.761	80%	0.801	S	S	*	*				-157.9	151.9	50.4	25.2	0	0	0	0	114.7
1094	T	31.9	Very low	30.8	Very low	120 Å²	120	135.6 Å²	135.6	74%	0.736	80%	0.796	S	S	*	*			trans	-1.9	133.8	149.2	57.5	0	0	0	0	118.1
1095	T	32.8	Very low	30.7	Very low	131 Å²	131	133.6 Å²	133.6	80%	0.804	79%	0.793	S	S	*	*				-170.8	150.9	65.5	43.1	0	0	0	0	115.1
1096	A	30.2	Very low	30.7	Very low	86 Å²	86	130.3 Å²	130.3	71%	0.711	78%	0.783	S	S	*	*			trans	76.5	147.3	142.6	0	0	0	0	0	123.6
1097	T	32.1	Very low	30.7	Very low	149 Å²	149	130.6 Å²	130.6	91%	0.914	78%	0.779	S	S	*	*			trans	67.7	137.1	164	41.4	0	0	0	0	120.1
1098	A	27.9	Very low	30.7	Very low	101 Å²	101	130.2 Å²	130.2	84%	0.835	78%	0.78	S	S	*	*			trans	-115.9	161.5	176.7	0	0	0	0	0	110.7
1099	A	31.3	Very low	30.6	Very low	90 Å²	90	127.4 Å²	127.4	74%	0.744	77%	0.773	S	S	*	*			trans	-134.4	97.9	173.3	0	0	0	0	0	110.8
1100	I	26.6	Very low	30.2	Very low	161 Å²	161	127.7 Å²	127.7	83%	0.826	77%	0.769	S	S	*	*			trans	-91.6	124.9	155.2	-63	170.8	0	0	0	105.6
1101	T	32.3	Very low	30	Very low	126 Å²	126	125.4 Å²	125.4	77%	0.773	77%	0.768	S	S	*	*			trans	-133.1	92.1	175.3	52.3	0	0	0	0	111.7
1102	T	26.9	Very low	29.7	Very low	129 Å²	129	124 Å²	124	79%	0.791	77%	0.768	S	S	*	*			trans	-68.7	176.8	142.8	44.6	0	0	0	0	110.1
1103	S	33	Very low	29.4	Very low	101 Å²	101	126.5 Å²	126.5	71%	0.706	77%	0.771	S	S	*	*			trans	-74.1	166.9	-170.1	57.2	0	0	0	0	115.9
1104	P	35.1	Very low	28.9	Very low	118 Å²	118	125.5 Å²	125.5	77%	0.766	77%	0.769	S	S	*	*				-129.2	149.9	123	36.8	-29.1	0	0	0	111.2
1105	V	28.4	Very low	28.6	Very low	113 Å²	113	124.3 Å²	124.3	69%	0.685	77%	0.766	S	S	*	*			cis	80	112.7	28.1	-173.3	0	0	0	0	114.6
1106	T	29	Very low	28.3	Very low	115 Å²	115	125.1 Å²	125.1	71%	0.706	76%	0.761	S	S	*	*				168.3	144.9	125.1	33	0	0	0	0	115.2
1107	K	27.6	Very low	28	Very low	182 Å²	182	125 Å²	125	79%	0.791	75%	0.747	S	S	*	*			trans	69.7	149.6	157.9	-65.3	158.7	-175	174.9	0	117.3
1108	L	28.3	Very low	27.8	Very low	166 Å²	166	118.6 Å²	118.6	87%	0.869	71%	0.711	S	S	*	*			cis	-91.1	-144.2	6	-86.4	79.5	0	0	0	113.6
1109	S	26.2	Very low	27.7	Very low	91 Å²	91	119 Å²	119	64%	0.636	70%	0.698	S	S	*	*			trans	-173.2	153.4	-150.4	55	0	0	0	0	115.4
1110	N	25.7	Very low	27.5	Very low	158 Å²	158	123.2 Å²	123.2	85%	0.845	71%	0.707	S	S	*	*			trans	76.4	146.9	154.6	-59.8	-4.3	0	0	0	119.9
1111	G	27.6	Very low	27.5	Very low	67 Å²	67	120.2 Å²	120.2	69%	0.691	70%	0.697	S	S	*	*			trans	98	94.7	-170.3	0	0	0	0	0	110.6
1112	I	24.4	Very low	27.3	Very low	155 Å²	155	123.9 Å²	123.9	80%	0.795	71%	0.705	S	S	*	*			cis	71.5	130.3	31.4	-48.7	178.3	0	0	0	112.6
1113	Q	25.6	Very low	27.2	Very low	174 Å²	174	122.9 Å²	122.9	81%	0.813	70%	0.699	S	S	*	*			trans	74.4	128.7	-167.4	-48.3	-172.4	-56.1	0	0	112.5
1114	S	24.1	Very low	27	Very low	103 Å²	103	127.3 Å²	127.3	72%	0.72	71%	0.708	S	S	*	*			cis	66.6	128.5	37.4	85.7	0	0	0	0	112.3
1115	S	25	Very low	26.8	Very low	94 Å²	94	125.3 Å²	125.3	66%	0.657	71%	0.709	S	S	*	*			cis	179.7	169.7	37.1	52.6	0	0	0	0	114.3
1116	Q	26.3	Very low	26.8	Very low	149 Å²	149	127 Å²	127	70%	0.696	71%	0.714	S	S	*	*			trans	70.7	179.5	144.5	-81.3	-170.8	-34	0	0	121.4
1117	I	25.9	Very low	26.9	Very low	84 Å²	84	127.3 Å²	127.3	43%	0.431	71%	0.712	S	S	.	*				-161.5	155.5	-60.5	-104.8	175.6	0	0	0	108	F1039 S1040 N1041	F1039-I1117 HydrophobicContact CB-CD1 3.29Å; F1039-I1117 HydrophobicContact CB-CG1 3.79Å; S1040-I1117 VanDerWaalsContact O-CA 3.29Å; S1040-I1117 WeakPolarHBondContact O-CA 3.2Å; N1041-I1117 VanDerWaalsContact CB-CA 3.47Å; N1041-I1117 PolarHBondContact ND2-O 2.82Å
1118	G	26.7	Very low	27	Very low	14 Å²	14	125 Å²	125	14%	0.144	71%	0.708	C	S	.	*			cis	-103.7	-145.9	-1.5	0	0	0	0	0	116.3	S1040 N1041	S1040-G1118 CarbonylContact C-O 3.56Å; S1040-G1118 CarbonylContact O-C 3.31Å; S1040-G1118 WeakPolarHBondContact O-CA 3.17Å; S1040-G1118 PolarHBondContact O-N 3.15Å; N1041-G1118 WeakPolarHBondContact CA-O 3.38Å; N1041-G1118 WeakPolarHBondContact CB-O 3.5Å; N1041-G1118 PolarHBondContact ND2-N 2.58Å; N1041-G1118 VanDerWaalsContact ND2-N 3.15Å; N1041-G1118 PolarHBondContact ND2-O 2.56Å; N1041-G1118 PolarHBondContact OD1-O 2.94Å
1119	L	26.1	Very low	27	Very low	110 Å²	110	120.5 Å²	120.5	58%	0.576	69%	0.69	S	S	*	*			cis	46.8	106.4	44.5	-97.9	74	0	0	0	116.2	F1039	F1039-L1119 HydrophobicContact CD1-CD1 4.25Å; F1039-L1119 HydrophobicContact CE1-CD1 4.06Å; F1039-L1119 HydrophobicContact CE1-CD2 3.89Å; F1039-L1119 HydrophobicContact CE1-CG 4.44Å
1120	L	26.6	Very low	27.3	Very low	177 Å²	177	121.8 Å²	121.8	93%	0.927	69%	0.69	S	S	*	*				-135.3	135.3	110.5	-97.6	176	0	0	0	111.5
1121	T	26.4	Very low	27.6	Very low	99 Å²	99	120.5 Å²	120.5	61%	0.607	68%	0.683	S	S	*	*			trans	-99.5	146.9	172	47.3	0	0	0	0	109.7
1122	E	28.2	Very low	27.8	Very low	202 Å²	202	126 Å²	126	94%	0.944	69%	0.69	S	S	*	*			trans	-125.3	131.6	149.3	-74.3	-158.6	143.9	0	0	110.8
1123	T	26	Very low	28	Very low	108 Å²	108	128.9 Å²	128.9	66%	0.663	69%	0.691	S	S	*	*			trans	-108.2	141.8	179.1	47	0	0	0	0	110
1124	H	28.4	Very low	28.2	Very low	194 Å²	194	130.9 Å²	130.9	90%	0.898	69%	0.693	S	S	*	*			trans	149	136.8	141.2	-79.7	-62.1	0	0	0	110.5
1125	G	30.7	Very low	28.4	Very low	77 Å²	77	128.7 Å²	128.7	79%	0.794	69%	0.687	S	S	*	*			trans	172.8	31	-176.2	0	0	0	0	0	117.5	N1127	G1125-N1127 PolarHBondContact O-N 3.21Å
1126	N	28.6	Very low	28.5	Very low	147 Å²	147	130.7 Å²	130.7	79%	0.786	70%	0.695	S	S	*	*			trans	-26.1	122.5	173	-101	2	0	0	0	117.2
1127	N	30.5	Very low	28.5	Very low	123 Å²	123	131.7 Å²	131.7	66%	0.658	70%	0.699	S	S	*	*				162.1	125.3	100.5	-87	-34.9	0	0	0	117.1	G1125	G1125-N1127 PolarHBondContact O-N 3.21Å
1128	N	29.3	Very low	28.5	Very low	133 Å²	133	131.7 Å²	131.7	71%	0.711	71%	0.707	S	S	*	*				59.3	97.1	129.1	-58.9	-20.3	0	0	0	123.7
1129	S	29.5	Very low	28.5	Very low	71 Å²	71	137 Å²	137	50%	0.497	73%	0.732	S	S	.	*				118.4	101.6	94	74.9	0	0	0	0	121.5	K1350	S1129-K1350 PolarHBondContact O-NZ 2.92Å; S1129-K1350 PolarHBondContact OG-NZ 3.04Å
1130	N	31.7	Very low	28.5	Very low	119 Å²	119	138.4 Å²	138.4	64%	0.636	74%	0.739	S	S	*	*				74	113	123.9	-58	8.4	0	0	0	121.2
1131	N	32.2	Very low	28.4	Very low	131 Å²	131	135.4 Å²	135.4	70%	0.701	73%	0.727	S	S	*	*				71.3	133	123.9	-56.8	-5	0	0	0	118.6
1132	H	31.1	Very low	28.4	Very low	182 Å²	182	138.6 Å²	138.6	84%	0.843	74%	0.735	S	S	*	*				-146.3	159	62.6	-98.9	-93.9	0	0	0	117
1133	R	28.6	Very low	28.3	Very low	215 Å²	215	135 Å²	135	81%	0.811	72%	0.722	S	S	*	*			trans	-64.8	167.5	163.6	-84.8	175.3	164.9	166.7	-7.3	111.4
1134	Y	29.9	Very low	28.2	Very low	217 Å²	217	134.8 Å²	134.8	85%	0.851	72%	0.721	S	S	*	*			cis	-133.6	166.7	25.7	-70	-105.1	0	0	0	110.8
1135	G	28.3	Very low	28.1	Very low	57 Å²	57	132.2 Å²	132.2	59%	0.588	71%	0.707	S	S	*	*			cis	125.8	91.3	7.4	0	0	0	0	0	110.1
1136	V	28.1	Very low	27.9	Very low	136 Å²	136	133 Å²	133	82%	0.824	69%	0.69	S	S	*	*				81.6	139.7	71.8	163.9	0	0	0	0	112
1137	E	26	Very low	27.8	Very low	169 Å²	169	129.8 Å²	129.8	79%	0.79	67%	0.67	S	S	*	*			cis	-174.9	-159.6	-21.4	-161.6	153.9	-159.9	0	0	106.5
1138	S	25.3	Very low	27.6	Very low	85 Å²	85	129.6 Å²	129.6	59%	0.594	67%	0.669	S	S	*	*			trans	-71.3	-177.7	158.1	58.1	0	0	0	0	110.5
1139	D	27.5	Very low	27.5	Very low	126 Å²	126	128.8 Å²	128.8	67%	0.674	67%	0.665	S	S	*	*			cis	-163.5	158.8	28.7	-121.5	-44.4	0	0	0	114.9
1140	I	25.1	Very low	27.3	Very low	139 Å²	139	132.8 Å²	132.8	71%	0.713	67%	0.67	S	S	*	*			trans	16.9	112.4	138.4	-71.8	173.7	0	0	0	121.3
1141	V	24.9	Very low	27.1	Very low	113 Å²	113	134.6 Å²	134.6	69%	0.685	68%	0.675	S	S	*	*				77.9	145.2	124.1	173.7	0	0	0	0	123.4
1142	Q	25.8	Very low	26.9	Very low	166 Å²	166	133 Å²	133	78%	0.776	67%	0.674	S	S	*	*			trans	71	150.4	164.6	-80.4	162.9	5.9	0	0	118.2
1143	N	26	Very low	26.7	Very low	126 Å²	126	131.9 Å²	131.9	67%	0.674	67%	0.669	S	S	*	*			cis	-147.7	140	-5.9	-101.3	-40.2	0	0	0	107.1
1144	V	24.6	Very low	26.7	Very low	105 Å²	105	127.1 Å²	127.1	64%	0.636	66%	0.66	S	S	*	*				89.8	113.1	55.8	171.6	0	0	0	0	115.2
1145	F	25.7	Very low	26.8	Very low	140 Å²	140	126 Å²	126	61%	0.614	66%	0.662	S	S	*	*			trans	64.7	140.1	172.2	-66.6	-57.6	0	0	0	118.3	A1210 P1211 H1212	F1145-A1210 HydrophobicContact CD2-CB 4.38Å; F1145-P1211 HydrophobicContact CB-CB 3.41Å; F1145-P1211 VanDerWaalsContact CB-CB 3.41Å; F1145-P1211 HydrophobicContact CB-CG 3.44Å; F1145-P1211 VanDerWaalsContact CB-CG 3.44Å; F1145-P1211 HydrophobicContact CG-CB 4.48Å; F1145-P1211 HydrophobicContact CG-CG 4.32Å; F1145-H1212 PolarHBondContact O-CD2 3.48Å
1146	Q	26.6	Very low	26.8	Very low	93 Å²	93	131.2 Å²	131.2	44%	0.435	67%	0.672	S	S	.	*				-137.4	122.6	64.6	-174.7	164.1	35	0	0	117.7	P1211 H1212	Q1146-P1211 HydrophobicContact CB-CB 4.36Å; Q1146-P1211 HydrophobicContact CB-CG 3.62Å; Q1146-P1211 HydrophobicContact CG-CG 3.69Å; Q1146-P1211 VanDerWaalsContact NE2-CD 3.27Å; Q1146-H1212 HydrophobicContact CB-CB 3.97Å; Q1146-H1212 WeakPolarHBondContact CB-CD2 3.29Å; Q1146-H1212 VanDerWaalsContact CB-CG 3.49Å; Q1146-H1212 VanDerWaalsContact OE1-CG 3.24Å; Q1146-H1212 PolarHBondContact OE1-ND1 3.02Å
1147	Q	27.2	Very low	26.8	Very low	79 Å²	79	131.2 Å²	131.2	37%	0.369	67%	0.666	S	S	.	*			trans	36.6	145	134.6	-58.2	179.2	-66.8	0	0	125.2	P1211	Q1147-P1211 HydrophobicContact CG-CG 4.49Å
1148	N	26.2	Very low	27.1	Very low	119 Å²	119	133.9 Å²	133.9	64%	0.636	67%	0.67	S	S	*	*			trans	70.1	145.1	140.8	-64.1	-4.6	0	0	0	119
1149	N	26.1	Very low	27.4	Very low	116 Å²	116	137.1 Å²	137.1	62%	0.62	68%	0.68	S	S	*	*			cis	-165.7	146.3	-14	-110.9	-17.9	0	0	0	108.2
1150	Y	26.9	Very low	27.3	Very low	155 Å²	155	134.7 Å²	134.7	61%	0.608	68%	0.678	S	S	*	*				-179.1	174.5	116.7	-114.5	-87.1	0	0	0	113.5	F1027	F1027-Y1150 HydrophobicContact CE2-CE2 4.37Å; F1027-Y1150 AromaticContact CE2-CZ 3.98Å; F1027-Y1150 WeakPolarHBondContact CE2-OH 3.47Å; F1027-Y1150 AromaticContact CZ-CE2 3.81Å; F1027-Y1150 HydrophobicContact CZ-CE2 3.81Å; F1027-Y1150 AromaticContact CZ-CZ 3.89Å; F1027-Y1150 VanDerWaalsContact CZ-OH 3.27Å; F1027-Y1150 WeakPolarHBondContact CZ-OH 3.25Å
1151	Q	27	Very low	27.5	Very low	158 Å²	158	138.5 Å²	138.5	74%	0.738	69%	0.685	S	S	*	*			trans	-88.6	177.5	-167.5	-53	169.7	-76.2	0	0	111.4
1152	S	28.9	Very low	27.9	Very low	96 Å²	96	140 Å²	140	67%	0.671	69%	0.69	S	S	*	*			cis	-166.4	161.1	27.6	59.6	0	0	0	0	114.7
1153	Q	26.3	Very low	28	Very low	159 Å²	159	139.3 Å²	139.3	74%	0.743	69%	0.69	S	S	*	*			trans	26.5	145.8	131.8	-65.8	-177.7	-37.9	0	0	120.3
1154	N	27.4	Very low	28	Very low	116 Å²	116	139.1 Å²	139.1	62%	0.62	70%	0.696	S	S	*	*			cis	-167.8	149.5	8.9	-115.3	-6.5	0	0	0	109.9
1155	Q	33.9	Very low	28.3	Very low	192 Å²	192	140.5 Å²	140.5	90%	0.897	71%	0.705	S	S	*	*				-177.5	163.7	122.4	-101.8	173.4	-10.6	0	0	112.1
1156	Q	28.1	Very low	28.3	Very low	168 Å²	168	139.9 Å²	139.9	79%	0.785	72%	0.715	S	S	*	*			trans	-136.3	-175.5	-165.6	-64.2	174.8	-83.8	0	0	111.3
1157	I	27.5	Very low	28.4	Very low	136 Å²	136	140.6 Å²	140.6	70%	0.697	73%	0.73	S	S	*	*			trans	82.6	92.3	161.8	-44.1	174.4	0	0	0	115.6
1158	Y	33	Very low	28.4	Very low	224 Å²	224	140.5 Å²	140.5	88%	0.878	74%	0.743	S	S	*	*				-151.4	144.8	91.7	-112.2	-79.5	0	0	0	110.2
1159	D	29.7	Very low	28.3	Very low	153 Å²	153	140.7 Å²	140.7	82%	0.818	75%	0.751	S	S	*	*			trans	-137.6	170.3	-161.2	-127.7	-41.5	0	0	0	112.4
1160	A	27.4	Very low	28.3	Very low	76 Å²	76	140.2 Å²	140.2	63%	0.628	75%	0.747	S	S	*	*			trans	68.7	102.2	162.7	0	0	0	0	0	120.4
1161	Y	28.8	Very low	28.2	Very low	218 Å²	218	143.3 Å²	143.3	86%	0.855	76%	0.759	S	S	*	*				173	124.6	128.3	-86.7	-61.9	0	0	0	106
1162	N	32	Very low	28.2	Very low	146 Å²	146	144.8 Å²	144.8	78%	0.781	76%	0.759	S	S	*	*			cis	-134	171.9	17.9	-90	-64.2	0	0	0	113.9
1163	L	27.8	Very low	28.1	Very low	150 Å²	150	145.2 Å²	145.2	79%	0.785	76%	0.759	S	S	*	*			trans	-76	157.4	-171.3	-89.9	64.7	0	0	0	115.1
1164	P	27.9	Very low	28.2	Very low	122 Å²	122	144.7 Å²	144.7	79%	0.792	77%	0.767	S	S	*	*			trans	-73	149.2	167.7	32.9	-35.6	0	0	0	111.8
1165	T	30	Very low	28.2	Very low	134 Å²	134	144.5 Å²	144.5	82%	0.822	77%	0.771	S	S	*	*			trans	-121.7	133.7	169.8	41.9	0	0	0	0	110.8
1166	P	26.3	Very low	28.1	Very low	128 Å²	128	144.8 Å²	144.8	83%	0.831	77%	0.771	S	S	*	*			trans	-99.5	130.4	-173	35.5	-32.7	0	0	0	113.8
1167	S	28.5	Very low	28	Very low	107 Å²	107	144.1 Å²	144.1	75%	0.748	77%	0.769	S	S	*	*			trans	-150.2	86.7	164.7	51.7	0	0	0	0	108.6
1168	A	26.5	Very low	28.1	Very low	77 Å²	77	145.9 Å²	145.9	64%	0.636	78%	0.777	S	S	*	*				62.6	117.6	76	0	0	0	0	0	112.1	I1170	A1168-I1170 PolarHBondContact O-N 3.24Å
1169	P	24.1	Very low	27.8	Very low	124 Å²	124	141 Å²	141	81%	0.805	77%	0.766	S	S	*	*			trans	-77.5	95.8	-172.7	31.1	-34.7	0	0	0	111.2	Y1171	P1169-Y1171 PolarHBondContact O-N 3.4Å
1170	I	26.2	Very low	28	Very low	106 Å²	106	139.3 Å²	139.3	54%	0.544	76%	0.763	S	S	.	*			trans	-78.2	88.2	178.5	-46.5	-177.5	0	0	0	110.4	A1168 Y1172	A1168-I1170 PolarHBondContact O-N 3.24Å; I1170-Y1172 HydrophobicContact CB-CD2 4.15Å; I1170-Y1172 HydrophobicContact CB-CE2 3.78Å; I1170-Y1172 HydrophobicContact CD1-CE2 4.47Å; I1170-Y1172 HydrophobicContact CG2-CD1 4.07Å; I1170-Y1172 HydrophobicContact CG2-CD2 3.67Å; I1170-Y1172 HydrophobicContact CG2-CE1 3.84Å; I1170-Y1172 HydrophobicContact CG2-CE2 3.43Å; I1170-Y1172 VanDerWaalsContact CG2-CE2 3.43Å; I1170-Y1172 HydrophobicContact CG2-CG 3.99Å; I1170-Y1172 WeakPolarHBondContact O-CD2 3.43Å; I1170-Y1172 PolarHBondContact O-N 2.68Å
1171	Y	25.4	Very low	28.1	Very low	220 Å²	220	140.2 Å²	140.2	86%	0.863	76%	0.764	S	S	*	*			trans	-53.2	103	151	-93.5	-103.1	0	0	0	108.6	P1169 P1173	P1169-Y1171 PolarHBondContact O-N 3.4Å; Y1171-P1173 WeakPolarHBondContact O-CD 3.36Å
1172	Y	26.8	Very low	28.1	Very low	189 Å²	189	135.5 Å²	135.5	74%	0.741	76%	0.758	S	S	*	*			trans	-82.7	118.8	171.8	-83.1	-75.6	0	0	0	110.2	I1170 T1174	I1170-Y1172 HydrophobicContact CB-CD2 4.15Å; I1170-Y1172 HydrophobicContact CB-CE2 3.78Å; I1170-Y1172 HydrophobicContact CD1-CE2 4.47Å; I1170-Y1172 HydrophobicContact CG2-CD1 4.07Å; I1170-Y1172 HydrophobicContact CG2-CD2 3.67Å; I1170-Y1172 HydrophobicContact CG2-CE1 3.84Å; I1170-Y1172 HydrophobicContact CG2-CE2 3.43Å; I1170-Y1172 VanDerWaalsContact CG2-CE2 3.43Å; I1170-Y1172 HydrophobicContact CG2-CG 3.99Å; I1170-Y1172 WeakPolarHBondContact O-CD2 3.43Å; I1170-Y1172 PolarHBondContact O-N 2.68Å; Y1172-T1174 PolarHBondContact O-N 3.28Å
1173	P	25.6	Very low	28.1	Very low	104 Å²	104	136 Å²	136	68%	0.675	76%	0.759	S	S	*	*			trans	-82.4	116.9	-173.4	31.3	-33.8	0	0	0	111.9	Y1171 T1175	Y1171-P1173 WeakPolarHBondContact O-CD 3.36Å; P1173-T1175 PolarHBondContact O-N 2.64Å
1174	T	29.6	Very low	28.3	Very low	148 Å²	148	132 Å²	132	91%	0.908	76%	0.755	S	S	*	*			trans	-80.4	59	172.3	40.8	0	0	0	0	112.4	Y1172	Y1172-T1174 PolarHBondContact O-N 3.28Å
1175	T	27.9	Very low	28.4	Very low	113 Å²	113	133.6 Å²	133.6	69%	0.693	75%	0.752	S	S	*	*			trans	-125.9	86.9	168.7	53	0	0	0	0	111.3	P1173	P1173-T1175 PolarHBondContact O-N 2.64Å
1176	H	30.5	Very low	28.5	Very low	197 Å²	197	136.6 Å²	136.6	91%	0.912	75%	0.749	S	S	*	*			trans	-112.4	103.6	155.5	-109.3	-78.7	0	0	0	108.6
1177	Q	27.1	Very low	28.6	Very low	155 Å²	155	139.2 Å²	139.2	72%	0.724	75%	0.748	S	S	*	*			trans	-72.7	138.8	174.9	-67.6	175.2	-36.2	0	0	110.2	I1179	Q1177-I1179 HydrophobicContact CB-CD1 4.45Å; Q1177-I1179 HydrophobicContact CB-CG1 4.36Å
1178	I	29.4	Very low	28.9	Very low	172 Å²	172	139.8 Å²	139.8	88%	0.882	75%	0.749	S	S	*	*			trans	-114.1	99.6	151.6	-61.3	-178.2	0	0	0	106.8
1179	I	27.3	Very low	28.7	Very low	123 Å²	123	141.2 Å²	141.2	63%	0.631	75%	0.753	S	S	*	*			trans	-79.9	151.8	164.2	-72.6	165	0	0	0	106.7	Q1177	Q1177-I1179 HydrophobicContact CB-CD1 4.45Å; Q1177-I1179 HydrophobicContact CB-CG1 4.36Å
1180	P	32.6	Very low	29.1	Very low	117 Å²	117	142.4 Å²	142.4	76%	0.76	75%	0.751	S	S	*	*			cis	-117.4	-176.5	14.7	19.4	6.8	0	0	0	112.8
1181	S	29	Very low	29.1	Very low	94 Å²	94	145 Å²	145	66%	0.657	77%	0.765	S	S	*	*			cis	-157.8	142.8	30.4	53.6	0	0	0	0	115.6
1182	T	30.5	Very low	29.4	Very low	119 Å²	119	140.8 Å²	140.8	73%	0.73	76%	0.762	S	S	*	*			trans	61.7	141.9	148.4	57.6	0	0	0	0	120.5
1183	I	30.9	Very low	29.4	Very low	156 Å²	156	137.1 Å²	137.1	80%	0.8	76%	0.764	S	S	*	*			cis	-154.5	133	-7.4	-108.4	156.4	0	0	0	109.4
1184	G	31.2	Very low	29.8	Very low	67 Å²	67	139.1 Å²	139.1	69%	0.691	77%	0.774	S	S	*	*			trans	63.4	160.1	144.8	0	0	0	0	0	122.9
1185	Q	30.8	Very low	29.7	Very low	156 Å²	156	141.1 Å²	141.1	73%	0.729	77%	0.773	S	S	*	*			cis	-169.1	156.2	-20.6	-138.3	168.1	6.1	0	0	112.7
1186	Y	31.7	Very low	29.9	Very low	197 Å²	197	142.1 Å²	142.1	77%	0.773	78%	0.78	S	S	*	*			trans	81.2	108	164	-63.5	-67.8	0	0	0	122.8
1187	F	29.6	Very low	29.8	Very low	183 Å²	183	139.3 Å²	139.3	80%	0.803	78%	0.776	S	S	*	*			trans	-83.6	171.6	145.7	-88.6	-98.6	0	0	0	110.5
1188	P	33.5	Very low	29.8	Very low	119 Å²	119	135.3 Å²	135.3	77%	0.773	78%	0.777	S	S	*	*				-145.9	153.5	94.1	38	-22.2	0	0	0	116.1
1189	C	23.7	Very low	30	Very low	107 Å²	107	135.9 Å²	135.9	72%	0.723	78%	0.781	S	S	*	*			trans	-93.1	158.2	159.5	-57.9	0	0	0	0	110.3
1190	I	32.1	Very low	30	Very low	149 Å²	149	133.8 Å²	133.8	76%	0.764	78%	0.777	S	S	*	*			trans	-134.2	135.9	164.1	-63	-178	0	0	0	109	T1192	I1190-T1192 HydrophobicContact CG2-CG2 4.29Å
1191	I	26.3	Very low	29.9	Very low	161 Å²	161	138.7 Å²	138.7	83%	0.826	79%	0.787	S	S	*	*			trans	-117	130.6	172.4	-60.8	169.8	0	0	0	107.3
1192	T	31.8	Very low	29.8	Very low	130 Å²	130	140.9 Å²	140.9	80%	0.798	79%	0.789	S	S	*	*			trans	-145.7	128.9	166.9	50.4	0	0	0	0	110.5	I1190	I1190-T1192 HydrophobicContact CG2-CG2 4.29Å
1193	S	27.3	Very low	29.8	Very low	113 Å²	113	140.6 Å²	140.6	79%	0.79	79%	0.793	S	S	*	*			trans	-110.7	139.4	178.6	55.8	0	0	0	0	111.7
1194	T	33.5	Very low	29.5	Very low	146 Å²	146	136.7 Å²	136.7	90%	0.896	78%	0.784	S	S	*	*			trans	-139.7	135	165.6	47.7	0	0	0	0	110.9
1195	Q	26.8	Very low	29.3	Very low	189 Å²	189	139.3 Å²	139.3	88%	0.883	79%	0.791	S	S	*	*			trans	-91	146.2	177.1	-57.4	166.8	-11.1	0	0	110.7
1196	T	32.1	Very low	29.1	Very low	135 Å²	135	137.1 Å²	137.1	83%	0.828	79%	0.793	S	S	*	*			trans	-154.9	101.7	143	42.3	0	0	0	0	111.1
1197	T	29	Very low	28.9	Very low	137 Å²	137	133 Å²	133	84%	0.84	79%	0.794	S	S	*	*			trans	10.5	134.3	140.9	54.1	0	0	0	0	120.5
1198	G	28	Very low	28.7	Very low	72 Å²	72	127.5 Å²	127.5	74%	0.742	79%	0.788	S	S	*	*				119.6	82.6	124.8	0	0	0	0	0	118.8
1199	L	32.6	Very low	28.3	Very low	184 Å²	184	129 Å²	129	96%	0.963	79%	0.788	S	S	*	*				-171	147.6	111.3	-99.9	166.1	0	0	0	110.4
1200	S	27	Very low	28.7	Very low	78 Å²	78	127.1 Å²	127.1	55%	0.545	78%	0.781	S	S	.	*			trans	-110.9	140.5	-166.7	55	0	0	0	0	113.4
1201	F	30.9	Very low	28.9	Very low	221 Å²	221	122.2 Å²	122.2	97%	0.969	76%	0.758	S	S	*	*			trans	-130	144.8	143.3	-93.8	-79.2	0	0	0	109.6
1202	I	26	Very low	29	Very low	139 Å²	139	120 Å²	120	71%	0.713	74%	0.744	S	S	*	*			trans	-128.3	115.7	-161.8	-60.2	170.3	0	0	0	110.6	A1204	I1202-A1204 HydrophobicContact CG2-CB 4.26Å
1203	S	30.7	Very low	28.9	Very low	114 Å²	114	118.8 Å²	118.8	80%	0.797	74%	0.736	S	S	*	*			trans	-168.6	114.6	148.5	45.4	0	0	0	0	106.6
1204	A	26	Very low	28.9	Very low	74 Å²	74	119.6 Å²	119.6	61%	0.612	74%	0.737	S	S	*	*			cis	67.6	104.8	24	0	0	0	0	0	114.4	I1202	I1202-A1204 HydrophobicContact CG2-CB 4.26Å
1205	S	25.5	Very low	28.6	Very low	121 Å²	121	119.2 Å²	119.2	85%	0.846	73%	0.728	S	S	*	*			trans	60.4	152.9	157.9	68.6	0	0	0	0	117.1
1206	S	28	Very low	28.7	Very low	110 Å²	110	114.7 Å²	114.7	77%	0.769	72%	0.718	S	S	*	*			cis	-157.7	-176.4	30.7	59.9	0	0	0	0	113.5
1207	S	27.1	Very low	28.7	Very low	112 Å²	112	114.1 Å²	114.1	78%	0.783	72%	0.716	S	S	*	*			trans	-65.5	137.1	175.4	51.5	0	0	0	0	115.6
1208	G	25.5	Very low	28.6	Very low	67 Å²	67	112.6 Å²	112.6	69%	0.691	71%	0.711	S	S	*	*				91.7	153.3	115.6	0	0	0	0	0	120.4
1209	I	25.4	Very low	28.7	Very low	149 Å²	149	114.4 Å²	114.4	76%	0.764	71%	0.712	S	S	*	*			trans	74.4	135.8	163	-52.1	174.2	0	0	0	115.1
1210	A	31.5	Very low	28.4	Very low	69 Å²	69	111.5 Å²	111.5	57%	0.57	71%	0.707	S	S	*	*			trans	-97.9	-141	177.9	0	0	0	0	0	109.1	F1145	F1145-A1210 HydrophobicContact CD2-CB 4.38Å
1211	P	36.4	Very low	28.6	Very low	45 Å²	45	112.4 Å²	112.4	29%	0.292	71%	0.714	S	S	.	*			cis	-143.6	-164.1	-18.4	17.5	12.5	0	0	0	113.4	F1145 Q1146 Q1147	F1145-P1211 HydrophobicContact CB-CB 3.41Å; F1145-P1211 VanDerWaalsContact CB-CB 3.41Å; F1145-P1211 HydrophobicContact CB-CG 3.44Å; F1145-P1211 VanDerWaalsContact CB-CG 3.44Å; F1145-P1211 HydrophobicContact CG-CB 4.48Å; F1145-P1211 HydrophobicContact CG-CG 4.32Å; Q1146-P1211 HydrophobicContact CB-CB 4.36Å; Q1146-P1211 HydrophobicContact CB-CG 3.62Å; Q1146-P1211 HydrophobicContact CG-CG 3.69Å; Q1146-P1211 VanDerWaalsContact NE2-CD 3.27Å; Q1147-P1211 HydrophobicContact CG-CG 4.49Å
1212	H	28	Very low	28.6	Very low	115 Å²	115	111.5 Å²	111.5	53%	0.532	71%	0.71	S	S	.	*				137.3	127.3	125.5	-150.8	-166.2	0	0	0	118	F1145 Q1146	F1145-H1212 PolarHBondContact O-CD2 3.48Å; Q1146-H1212 HydrophobicContact CB-CB 3.97Å; Q1146-H1212 WeakPolarHBondContact CB-CD2 3.29Å; Q1146-H1212 VanDerWaalsContact CB-CG 3.49Å; Q1146-H1212 VanDerWaalsContact OE1-CG 3.24Å; Q1146-H1212 PolarHBondContact OE1-ND1 3.02Å
1213	T	29.2	Very low	28.7	Very low	104 Å²	104	109.3 Å²	109.3	64%	0.638	71%	0.706	S	S	*	*			trans	-4.2	138.9	154.3	-48.7	0	0	0	0	121.8
1214	V	27	Very low	28.8	Very low	131 Å²	131	111.6 Å²	111.6	79%	0.794	71%	0.71	S	S	*	*			trans	-134.9	104.2	153.3	177.8	0	0	0	0	112.4
1215	L	27.1	Very low	29.1	Very low	138 Å²	138	111.4 Å²	111.4	72%	0.723	72%	0.715	S	S	*	*			trans	44.9	98.7	141.2	-60.9	168.3	0	0	0	121.8
1216	S	30.6	Very low	29.3	Very low	94 Å²	94	112.9 Å²	112.9	66%	0.657	71%	0.713	S	S	*	*				35	148.5	109.6	72.9	0	0	0	0	121.3
1217	P	30.5	Very low	29.2	Very low	122 Å²	122	113.2 Å²	113.2	79%	0.792	71%	0.711	S	S	*	*				-134	152.3	91	27.5	-11.8	0	0	0	116.7
1218	S	27.9	Very low	29.3	Very low	105 Å²	105	115.1 Å²	115.1	73%	0.734	71%	0.709	S	S	*	*			trans	-37.6	156.7	161.4	58.6	0	0	0	0	115
1219	S	28.8	Very low	29.4	Very low	110 Å²	110	117.6 Å²	117.6	77%	0.769	71%	0.707	S	S	*	*			cis	-167.1	149.5	49.6	47.3	0	0	0	0	115.3
1220	S	26.6	Very low	29.6	Very low	123 Å²	123	117.2 Å²	117.2	86%	0.86	71%	0.706	S	S	*	*			trans	-113.8	136.4	153.1	55.2	0	0	0	0	108.2
1221	S	32.2	Very low	29.5	Very low	98 Å²	98	119.7 Å²	119.7	69%	0.685	71%	0.714	S	S	*	*			trans	-119.5	118.7	-169.3	62.2	0	0	0	0	113.3
1222	K	29.8	Very low	29.1	Very low	202 Å²	202	121.5 Å²	121.5	88%	0.878	73%	0.733	S	S	*	*			trans	69.1	153.1	151.8	-66.8	173.7	-178.8	177.7	0	115.4
1223	S	29.4	Very low	29	Very low	92 Å²	92	122.4 Å²	122.4	64%	0.643	75%	0.746	S	S	*	*			cis	-153.8	170.7	2	34.8	0	0	0	0	111.6
1224	N	32.8	Very low	29	Very low	163 Å²	163	122.4 Å²	122.4	87%	0.872	76%	0.757	S	S	*	*			trans	81.3	142.4	166.8	-50.4	-21.9	0	0	0	115.7
1225	G	31.3	Very low	29	Very low	69 Å²	69	122.5 Å²	122.5	71%	0.711	76%	0.758	S	S	*	*			cis	171.5	89.2	-6.3	0	0	0	0	0	115.7
1226	N	29.2	Very low	29	Very low	152 Å²	152	119.7 Å²	119.7	81%	0.813	76%	0.755	S	S	*	*			trans	48.4	102.4	150.4	-70.3	9.2	0	0	0	121.6
1227	T	27	Very low	28.9	Very low	117 Å²	117	121.9 Å²	121.9	72%	0.718	76%	0.76	S	S	*	*				75.5	148.5	117	-27.9	0	0	0	0	121.3
1228	M	29.2	Very low	29.1	Very low	152 Å²	152	122.4 Å²	122.4	75%	0.749	76%	0.755	S	S	*	*			trans	101.1	92	154.9	-63	-156.4	174	0	0	120.5
1229	N	27.4	Very low	29.4	Very low	120 Å²	120	123.3 Å²	123.3	64%	0.642	75%	0.752	S	S	*	*				78	137.6	113.6	-59.8	-7.9	0	0	0	121.8
1230	N	28.8	Very low	29.6	Very low	140 Å²	140	124.4 Å²	124.4	75%	0.749	75%	0.75	S	S	*	*			trans	70.4	147.8	150	-60.1	-7.7	0	0	0	117.1
1231	T	30.3	Very low	29.8	Very low	122 Å²	122	124.8 Å²	124.8	75%	0.748	74%	0.742	S	S	*	*			cis	-156.8	130.1	-9	13.5	0	0	0	0	105.9
1232	A	27.4	Very low	29.8	Very low	82 Å²	82	126.4 Å²	126.4	68%	0.678	74%	0.743	S	S	*	*				70.7	147.5	87.3	0	0	0	0	0	116.2
1233	T	26.3	Very low	29.7	Very low	134 Å²	134	123 Å²	123	82%	0.822	73%	0.734	S	S	*	*			trans	68.9	114.5	170.8	62.4	0	0	0	0	120
1234	A	29.2	Very low	29.6	Very low	105 Å²	105	124.1 Å²	124.1	87%	0.868	74%	0.737	S	S	*	*				-149.6	133.5	123	0	0	0	0	0	107.7
1235	T	26.6	Very low	29.3	Very low	132 Å²	132	123 Å²	123	81%	0.81	73%	0.73	S	S	*	*			trans	-139.5	139.1	-168.8	-13.6	0	0	0	0	113
1236	A	27.8	Very low	29	Very low	80 Å²	80	127.3 Å²	127.3	66%	0.661	74%	0.736	S	S	*	*			trans	72.5	135	153.2	0	0	0	0	0	121.3
1237	N	28.9	Very low	28.9	Very low	140 Å²	140	123.4 Å²	123.4	75%	0.749	73%	0.731	S	S	*	*			trans	57.4	123.2	141.8	-56.2	-2	0	0	0	119.4
1238	N	34.7	Very low	28.9	Very low	132 Å²	132	129.8 Å²	129.8	71%	0.706	74%	0.742	S	S	*	*				-169.8	143.6	65.1	-93.9	-59.8	0	0	0	114.9
1239	N	34.2	Very low	28.7	Very low	124 Å²	124	126.5 Å²	126.5	66%	0.663	75%	0.747	S	S	*	*			trans	37	114.3	130.9	-55.7	-15.9	0	0	0	122.3
1240	N	32.1	Very low	28.7	Very low	134 Å²	134	124.2 Å²	124.2	72%	0.717	75%	0.752	S	S	*	*				69.7	131.3	115.7	-63.8	-1.2	0	0	0	123.6
1241	N	32.5	Very low	28.5	Very low	130 Å²	130	126.3 Å²	126.3	70%	0.695	76%	0.757	S	S	*	*			trans	96.8	136.9	132.4	-73.2	-1.5	0	0	0	122
1242	N	30.9	Very low	28.4	Very low	132 Å²	132	126.9 Å²	126.9	71%	0.706	75%	0.754	S	S	*	*			trans	75.8	146.2	146.1	-69	-1.6	0	0	0	119.6
1243	L	27.8	Very low	28.3	Very low	132 Å²	132	129.2 Å²	129.2	69%	0.691	76%	0.755	S	S	*	*			cis	-171.8	163.7	-26.1	-153.6	66.3	0	0	0	107.7
1244	T	27.3	Very low	28.3	Very low	115 Å²	115	129.9 Å²	129.9	71%	0.706	75%	0.753	S	S	*	*			trans	62.8	162.5	157.9	59.4	0	0	0	0	118.3
1245	L	26.6	Very low	28.2	Very low	138 Å²	138	133.1 Å²	133.1	72%	0.723	75%	0.751	S	S	*	*			cis	-159.5	163.7	-24.9	-105.7	166	0	0	0	108.1
1246	L	25.6	Very low	28.1	Very low	161 Å²	161	137.1 Å²	137.1	84%	0.843	75%	0.753	S	S	*	*			trans	45.5	124.4	148.4	-67.9	160.6	0	0	0	120.6
1247	G	26.7	Very low	28.1	Very low	69 Å²	69	142.8 Å²	142.8	71%	0.711	76%	0.762	S	S	*	*				129.6	98	107.1	0	0	0	0	0	120
1248	R	26.4	Very low	28.1	Very low	252 Å²	252	141.3 Å²	141.3	95%	0.951	76%	0.763	S	S	*	*				66.3	70.5	122.3	-157.2	-171.6	-165.9	175.3	5	119.6
1249	G	25.7	Very low	28.2	Very low	83 Å²	83	139.9 Å²	139.9	86%	0.856	76%	0.761	S	S	*	*				79.2	168.8	127.8	0	0	0	0	0	119.8
1250	G	26.9	Very low	28	Very low	72 Å²	72	142.8 Å²	142.8	74%	0.742	77%	0.768	S	S	*	*			trans	104.3	92.7	168.7	0	0	0	0	0	116.5
1251	H	25.6	Very low	28	Very low	184 Å²	184	146.4 Å²	146.4	85%	0.852	77%	0.771	S	S	*	*				56	147	118.9	-120	-76.9	0	0	0	122
1252	I	27.5	Very low	28	Very low	134 Å²	134	145.2 Å²	145.2	69%	0.687	77%	0.765	S	S	*	*			trans	84.7	95.8	161.6	-49.9	174.7	0	0	0	118
1253	N	25.3	Very low	28.2	Very low	130 Å²	130	145 Å²	145	70%	0.695	76%	0.764	S	S	*	*				49.2	129.6	125.9	-50.2	0.2	0	0	0	123.6
1254	N	25.9	Very low	28.4	Very low	148 Å²	148	144.2 Å²	144.2	79%	0.791	76%	0.764	S	S	*	*			trans	84.1	156.3	130.6	-70.9	5.8	0	0	0	123.1
1255	E	26.9	Very low	28.7	Very low	174 Å²	174	144.9 Å²	144.9	81%	0.813	77%	0.768	S	S	*	*			trans	68.4	107.1	170.8	-60.8	-168	170.2	0	0	118.3
1256	Y	24.9	Very low	29	Very low	216 Å²	216	144.4 Å²	144.4	85%	0.847	77%	0.766	S	S	*	*				68.5	97.7	76.3	-94.5	-85.1	0	0	0	115.6
1257	K	28.8	Very low	29.4	Very low	198 Å²	198	143.1 Å²	143.1	86%	0.861	76%	0.758	S	S	*	*				179.7	125.8	118.4	-97	151	-171.1	157.6	0	114.3
1258	S	27.7	Very low	29.7	Very low	110 Å²	110	146 Å²	146	77%	0.769	75%	0.754	S	S	*	*			trans	-75.9	-178.6	152.2	-25.5	0	0	0	0	109.4
1259	P	36	Very low	30.1	Very low	101 Å²	101	141.9 Å²	141.9	66%	0.656	75%	0.745	S	S	*	*			cis	-160.2	-178	44.5	46.3	-24.3	0	0	0	120.2
1260	K	30.2	Very low	30.4	Very low	186 Å²	186	142 Å²	142	81%	0.809	73%	0.732	S	S	*	*			trans	73.3	157.7	154.9	-72.5	160.6	-170.5	175.8	0	116.9
1261	R	33.3	Very low	30.5	Very low	209 Å²	209	147 Å²	147	79%	0.789	74%	0.736	S	S	*	*			cis	-150.7	141.6	16.2	-159.6	171.4	176.5	168.1	-3.2	114.5
1262	N	32.5	Very low	30.8	Very low	105 Å²	105	148.1 Å²	148.1	56%	0.561	74%	0.739	S	S	*	*			trans	20.1	178.5	148.6	-44.3	14	0	0	0	123.6
1263	D	33.6	Very low	30.8	Very low	129 Å²	129	152.3 Å²	152.3	69%	0.69	75%	0.746	S	S	*	*			cis	-132	146.8	3	-66.6	-76.9	0	0	0	108.8
1264	V	32.9	Very low	31.1	Very low	114 Å²	114	151.6 Å²	151.6	69%	0.691	75%	0.751	S	S	*	*			cis	68.7	125.7	49.7	-166.7	0	0	0	0	110.5
1265	V	34.3	Very low	31.2	Very low	130 Å²	130	151.1 Å²	151.1	79%	0.788	75%	0.748	S	S	*	*				-157.5	163.2	60.9	177.9	0	0	0	0	109.5
1266	N	32.1	Very low	31.6	Very low	127 Å²	127	149.8 Å²	149.8	68%	0.679	75%	0.752	S	S	*	*			cis	170.8	-169.8	-38.3	-166.4	25.7	0	0	0	108.5
1267	I	34.4	Very low	31.8	Very low	134 Å²	134	146.6 Å²	146.6	69%	0.687	75%	0.749	S	S	*	*			trans	88.2	129.6	162.9	-56.6	176	0	0	0	114.3
1268	E	33.3	Very low	31.6	Very low	131 Å²	131	146 Å²	146	61%	0.612	75%	0.747	S	S	*	*			cis	-170.8	177.3	-26.4	-114.8	171.7	70.6	0	0	106.9
1269	Q	33.3	Very low	31.6	Very low	165 Å²	165	146.9 Å²	146.9	77%	0.771	74%	0.742	S	S	*	*			cis	-129.6	-144.9	10.5	-155.9	157.8	74.7	0	0	112.1
1270	S	32	Very low	31.1	Very low	84 Å²	84	148.3 Å²	148.3	59%	0.587	74%	0.744	S	S	*	*			trans	-149.6	140.5	-155.8	68.3	0	0	0	0	116.7
1271	H	30.5	Very low	31	Very low	177 Å²	177	148.5 Å²	148.5	82%	0.819	75%	0.745	S	S	*	*				29.7	149.7	127	-56.5	-65.6	0	0	0	122.1
1272	K	30.2	Very low	30.5	Very low	209 Å²	209	145.9 Å²	145.9	91%	0.909	75%	0.747	S	S	*	*				-167.3	174.6	114.5	-107.2	164.9	-174.5	175.3	0	116.6
1273	R	27.8	Very low	30.2	Very low	222 Å²	222	146.1 Å²	146.1	84%	0.838	75%	0.752	S	S	*	*			trans	-143.5	147.7	-153.4	155.4	-165.7	-179.8	176.4	5.8	110.6
1274	S	31.7	Very low	29.7	Very low	115 Å²	115	148.9 Å²	148.9	80%	0.804	76%	0.758	S	S	*	*			trans	-175.9	161.2	151.8	44.9	0	0	0	0	114.5
1275	D	28.2	Very low	29.4	Very low	137 Å²	137	148.9 Å²	148.9	73%	0.733	76%	0.763	S	S	*	*			trans	-98.1	166.8	-168.4	-31.8	-106.7	0	0	0	114.5
1276	V	36.6	Very low	29	Very low	147 Å²	147	147.9 Å²	147.9	89%	0.891	76%	0.762	S	S	*	*			trans	-177.9	160.3	140.5	139.4	0	0	0	0	113.1
1277	N	27.2	Very low	28.7	Very low	148 Å²	148	149.5 Å²	149.5	79%	0.791	77%	0.77	S	S	*	*			trans	-94.6	166.2	-170.7	-68.2	-85.4	0	0	0	116.2
1278	K	25.7	Very low	28.4	Very low	187 Å²	187	149.9 Å²	149.9	81%	0.813	78%	0.778	S	S	*	*			trans	101.9	134.1	132.1	-109.3	-172.2	172	-172.2	0	122.4
1279	L	27.8	Very low	28	Very low	128 Å²	128	149.6 Å²	149.6	67%	0.67	79%	0.786	S	S	*	*			trans	81.3	101.9	143.9	-112.7	72.4	0	0	0	122.4
1280	D	24.4	Very low	27.7	Very low	130 Å²	130	149.3 Å²	149.3	70%	0.695	79%	0.79	S	S	*	*				56.4	161.3	122.3	-65.2	-39.4	0	0	0	124.6
1281	F	28.5	Very low	27.3	Very low	190 Å²	190	151.3 Å²	151.3	83%	0.833	80%	0.798	S	S	*	*			trans	72.9	101.1	179.7	-61.2	-87.9	0	0	0	115
1282	N	23.4	Very low	27	Very low	155 Å²	155	148.9 Å²	148.9	83%	0.829	80%	0.8	S	S	*	*			cis	78	151.7	37.9	-155.2	-3	0	0	0	114.3
1283	V	26.6	Very low	26.7	Very low	110 Å²	110	146.2 Å²	146.2	67%	0.667	80%	0.795	S	S	*	*			trans	93.3	84.6	175	-167.2	0	0	0	0	118.2
1284	K	23.9	Very low	26.7	Very low	186 Å²	186	141.2 Å²	141.2	81%	0.809	79%	0.794	S	S	*	*				58.2	152.3	125.9	-64.8	-178.9	177.5	179.2	0	123.1
1285	S	25.6	Very low	26.3	Very low	115 Å²	115	143.9 Å²	143.9	80%	0.804	79%	0.791	S	S	*	*			trans	76.1	142.6	153.7	70.1	0	0	0	0	117.5
1286	S	26.3	Very low	26.3	Very low	109 Å²	109	142.2 Å²	142.2	76%	0.762	79%	0.791	S	S	*	*			cis	-161	171.8	-11	40.5	0	0	0	0	111.1
1287	L	25.5	Very low	25.8	Very low	161 Å²	161	141.9 Å²	141.9	84%	0.843	78%	0.784	S	S	*	*			trans	-42.6	140.8	172.3	-85.7	63.5	0	0	0	113.8
1288	T	27.6	Very low	25.7	Very low	141 Å²	141	144.9 Å²	144.9	87%	0.865	79%	0.785	S	S	*	*				-153.6	136.6	125.1	1.1	0	0	0	0	110.8
1289	T	24.4	Very low	25.6	Very low	126 Å²	126	147.9 Å²	147.9	77%	0.773	79%	0.792	S	S	*	*			trans	-74.3	134.9	175.4	48.5	0	0	0	0	110.9
1290	N	26.9	Very low	25.6	Very low	159 Å²	159	146.6 Å²	146.6	85%	0.85	79%	0.789	S	S	*	*			trans	-147.7	147.6	153.3	-110.1	-36.5	0	0	0	111.9
1291	T	23.8	Very low	25.8	Very low	125 Å²	125	145.2 Å²	145.2	77%	0.767	79%	0.789	S	S	*	*			trans	-74.9	122	-175.5	49.3	0	0	0	0	111.9
1292	C	24.7	Very low	25.7	Very low	127 Å²	127	143.1 Å²	143.1	86%	0.858	79%	0.787	S	S	*	*			trans	-115.3	113.7	164.8	-77.4	0	0	0	0	110
1293	L	24	Very low	26	Very low	152 Å²	152	144.1 Å²	144.1	80%	0.796	79%	0.786	S	S	*	*			trans	-70.5	127.6	164.9	-71.1	79	0	0	0	108.1	K1295	L1293-K1295 PolarHBondContact O-N 2.85Å; L1293-K1295 VanDerWaalsContact O-N 3.12Å
1294	S	27.5	Very low	26.2	Very low	118 Å²	118	145.7 Å²	145.7	83%	0.825	79%	0.791	S	S	*	*			trans	-71	105.5	162.7	-173	0	0	0	0	108.8	S1296	S1294-S1296 PolarHBondContact O-N 3.39Å
1295	K	24.1	Very low	26.3	Very low	170 Å²	170	141 Å²	141	74%	0.739	78%	0.78	S	S	*	*			trans	-78.3	92.2	169	-72.1	-178.8	178.3	177.6	0	109.1	L1293 N1297	L1293-K1295 PolarHBondContact O-N 2.85Å; L1293-K1295 VanDerWaalsContact O-N 3.12Å; K1295-N1297 PolarHBondContact O-N 3.02Å
1296	S	27.1	Very low	26.6	Very low	103 Å²	103	141.4 Å²	141.4	72%	0.72	76%	0.763	S	S	*	*			trans	-67.1	89.3	156.6	40.2	0	0	0	0	108.5	S1294 Y1298	S1294-S1296 PolarHBondContact O-N 3.39Å; S1296-Y1298 PolarHBondContact O-N 2.96Å
1297	N	27.5	Very low	26.8	Very low	139 Å²	139	141.5 Å²	141.5	74%	0.743	75%	0.754	S	S	*	*			trans	-63.2	119.6	-179.3	-74.4	-42.1	0	0	0	110.1	K1295 R1299	K1295-N1297 PolarHBondContact O-N 3.02Å; N1297-R1299 PolarHBondContact O-N 3.43Å
1298	Y	25	Very low	26.8	Very low	212 Å²	212	143.9 Å²	143.9	83%	0.831	76%	0.758	S	S	*	*			trans	-59.2	120.8	177.7	-77.1	-103.2	0	0	0	111.6	S1296 V1300	S1296-Y1298 PolarHBondContact O-N 2.96Å; Y1298-V1300 HydrophobicContact CD1-CG2 3.91Å
1299	R	23.8	Very low	26.9	Very low	250 Å²	250	140.9 Å²	140.9	94%	0.943	74%	0.739	S	S	*	*			trans	-108.2	90	144.4	-100.4	-172.4	173.5	179.1	0	108.3	N1297 S1301	N1297-R1299 PolarHBondContact O-N 3.43Å; R1299-S1301 PolarHBondContact O-N 3.38Å
1300	V	27.6	Very low	27.1	Very low	100 Å²	100	139.5 Å²	139.5	61%	0.606	74%	0.735	S	S	*	*			trans	-65.3	119.7	162.2	179.7	0	0	0	0	107	Y1298 N1302	Y1298-V1300 HydrophobicContact CD1-CG2 3.91Å; V1300-N1302 PolarHBondContact O-N 2.8Å
1301	S	27.5	Very low	27.1	Very low	101 Å²	101	138.5 Å²	138.5	71%	0.706	73%	0.729	S	S	*	*			trans	-68.2	117.2	168.6	37.8	0	0	0	0	108.6	R1299 H1303	R1299-S1301 PolarHBondContact O-N 3.38Å; S1301-H1303 PolarHBondContact O-N 3.36Å
1302	N	26.5	Very low	27.4	Very low	147 Å²	147	137.4 Å²	137.4	79%	0.786	73%	0.727	S	S	*	*	S	Bend	trans	-76	65.5	-172.8	-81.6	-27.2	0	0	0	112.9	V1300	V1300-N1302 PolarHBondContact O-N 2.8Å
1303	H	30.3	Very low	27.5	Very low	175 Å²	175	138.9 Å²	138.9	81%	0.81	73%	0.726	S	S	*	*			trans	-128.6	52.6	170.6	-74	-63.7	0	0	0	111.7	S1301	S1301-H1303 PolarHBondContact O-N 3.36Å
1304	N	30.9	Very low	27.8	Very low	144 Å²	144	142.9 Å²	142.9	77%	0.77	73%	0.73	S	S	*	*			trans	-144.9	81.8	168.8	-138.1	-3.1	0	0	0	111.5
1305	P	26.5	Very low	28	Very low	88 Å²	88	147.8 Å²	147.8	57%	0.571	73%	0.733	S	S	*	*			trans	-67.8	176.4	149	24	-14	0	0	0	109.3
1306	W	32	Very low	28.2	Very low	122 Å²	122	142.8 Å²	142.8	46%	0.462	73%	0.729	S	S	.	*			trans	78.6	129.4	173.3	-48.9	90.3	0	0	0	118.3	V420 H421	V420-W1306 HydrophobicContact CB-CD2 4.17Å; V420-W1306 HydrophobicContact CB-CE3 4.4Å; V420-W1306 HydrophobicContact CB-CG 4.42Å; V420-W1306 HydrophobicContact CG1-CD2 3.57Å; V420-W1306 VanDerWaalsContact CG1-CE2 3.45Å; V420-W1306 HydrophobicContact CG1-CE3 3.68Å; V420-W1306 HydrophobicContact CG1-CG 4.26Å; V420-W1306 HydrophobicContact CG1-CH2 3.76Å; V420-W1306 HydrophobicContact CG1-CZ2 3.58Å; V420-W1306 HydrophobicContact CG1-CZ3 3.78Å; V420-W1306 HydrophobicContact CG2-CB 4.26Å; V420-W1306 HydrophobicContact CG2-CD2 3.93Å; V420-W1306 HydrophobicContact CG2-CG 3.69Å; H421-W1306 AromaticContact CD2-CH2 3.94Å; H421-W1306 AromaticContact CE1-CH2 3.51Å; H421-W1306 AromaticContact CE1-CZ3 3.7Å; H421-W1306 AromaticContact ND1-CZ3 3.98Å; H421-W1306 AromaticContact NE2-CH2 3.28Å; H421-W1306 VanDerWaalsContact NE2-CH2 3.28Å; H421-W1306 WeakPolarHBondContact NE2-CH2 3.07Å; H421-W1306 AromaticContact NE2-CZ3 3.79Å
1307	I	30.5	Very low	28.4	Very low	111 Å²	111	147.4 Å²	147.4	57%	0.569	74%	0.739	S	S	*	*			cis	-152.3	144	-31.8	-145.2	168.9	0	0	0	111.5	V1309	I1307-V1309 HydrophobicContact CB-CG2 4.33Å; I1307-V1309 HydrophobicContact CD1-CG2 3.53Å; I1307-V1309 HydrophobicContact CG1-CG2 3.76Å; I1307-V1309 HydrophobicContact CG2-CB 3.85Å; I1307-V1309 HydrophobicContact CG2-CG2 3.72Å; I1307-V1309 PolarHBondContact O-N 3.48Å
1308	K	25.2	Very low	28.6	Very low	211 Å²	211	148.1 Å²	148.1	92%	0.917	74%	0.742	S	S	*	*			trans	-86.5	92.3	157.5	-81.3	-173.4	175.2	-177.8	0	108.7
1309	V	28.3	Very low	28.9	Very low	79 Å²	79	146.5 Å²	146.5	48%	0.479	74%	0.742	S	S	.	*			trans	-134.7	79.1	168.6	-179.1	0	0	0	0	110	I1307 N1311	I1307-V1309 HydrophobicContact CB-CG2 4.33Å; I1307-V1309 HydrophobicContact CD1-CG2 3.53Å; I1307-V1309 HydrophobicContact CG1-CG2 3.76Å; I1307-V1309 HydrophobicContact CG2-CB 3.85Å; I1307-V1309 HydrophobicContact CG2-CG2 3.72Å; I1307-V1309 PolarHBondContact O-N 3.48Å; V1309-N1311 VanDerWaalsContact CG1-OD1 3.31Å; V1309-N1311 WeakPolarHBondContact CG1-OD1 3.27Å
1310	S	29.2	Very low	29.4	Very low	97 Å²	97	138.7 Å²	138.7	68%	0.678	72%	0.724	S	S	*	*			trans	-85.2	100.2	148.1	48.5	0	0	0	0	107.1	S1312	S1310-S1312 PolarHBondContact O-N 3.34Å
1311	N	28.3	Very low	29.7	Very low	138 Å²	138	138.6 Å²	138.6	74%	0.738	73%	0.733	S	S	*	*			trans	-66.1	105	-179.5	-98.7	-5.3	0	0	0	110.8	V1309	V1309-N1311 VanDerWaalsContact CG1-OD1 3.31Å; V1309-N1311 WeakPolarHBondContact CG1-OD1 3.27Å
1312	S	29.6	Very low	29.8	Very low	101 Å²	101	140.4 Å²	140.4	71%	0.706	73%	0.731	S	S	*	*			trans	-129.5	52.7	175.1	66.4	0	0	0	0	112.3	S1310 R1314	S1310-S1312 PolarHBondContact O-N 3.34Å; S1312-R1314 VanDerWaalsContact C-N 3.34Å; S1312-R1314 PolarHBondContact O-N 3.47Å
1313	N	27.3	Very low	29.9	Very low	159 Å²	159	142.1 Å²	142.1	85%	0.85	73%	0.726	S	S	*	*			trans	-65.9	93.3	165	-83.9	-1.8	0	0	0	109.5
1314	R	30.1	Very low	29.8	Very low	235 Å²	235	142.5 Å²	142.5	89%	0.887	72%	0.721	S	S	*	*			trans	-127.3	95.3	163.1	-171.2	-178.9	-66.5	-151	1.3	108.6	S1312	S1312-R1314 VanDerWaalsContact C-N 3.34Å; S1312-R1314 PolarHBondContact O-N 3.47Å
1315	Y	31.6	Very low	30	Very low	222 Å²	222	142.2 Å²	142.2	87%	0.871	72%	0.715	S	S	*	*			trans	-69.4	146.6	176.7	-111.1	-101.4	0	0	0	111.8
1316	G	28.3	Very low	30.5	Very low	64 Å²	64	145 Å²	145	66%	0.66	72%	0.719	S	S	*	*			trans	63.1	100.7	142	0	0	0	0	0	119.2
1317	E	31.4	Very low	30.7	Very low	201 Å²	201	144.8 Å²	144.8	94%	0.939	73%	0.727	S	S	*	*				-151	132.6	114.2	-116	168.4	-171.3	0	0	109.2
1318	L	31.3	Very low	31	Very low	154 Å²	154	147.9 Å²	147.9	81%	0.806	74%	0.74	S	S	*	*			trans	-113.6	153.6	176	-102.5	79.4	0	0	0	108.9
1319	E	31	Very low	31.6	Very low	177 Å²	177	144.1 Å²	144.1	83%	0.827	73%	0.729	S	S	*	*			trans	-151.8	118.7	150.7	-126.1	-59.4	100.8	0	0	109.4
1320	P	34.8	Very low	32.1	Very low	87 Å²	87	147.9 Å²	147.9	57%	0.565	75%	0.746	S	S	*	*			trans	-126.9	125.8	-171.3	38.1	-23.3	0	0	0	116.1
1321	A	32.8	Very low	32.4	Very low	97 Å²	97	150.7 Å²	150.7	80%	0.802	75%	0.753	S	S	*	*			trans	-165	153.9	164.3	0	0	0	0	0	113.5
1322	Q	31.1	Very low	33.2	Very low	140 Å²	140	149.6 Å²	149.6	65%	0.654	75%	0.753	S	S	*	*			cis	-172.6	147.6	-38.4	-126.6	-173.2	22.5	0	0	109.9
1323	R	27.4	Very low	33.6	Very low	183 Å²	183	150.4 Å²	150.4	69%	0.691	76%	0.756	S	S	*	*			trans	68.3	155.9	157.2	-65.8	-172.8	-126.3	-145.6	4	117.1
1324	R	28.8	Very low	34.1	Very low	183 Å²	183	148.8 Å²	148.8	69%	0.691	75%	0.752	S	S	*	*			cis	-159.5	158.4	0.3	-128.4	-179.1	-63.7	-172.8	-2.7	111.7
1325	Q	34.5	Very low	34.4	Very low	138 Å²	138	143 Å²	143	65%	0.645	75%	0.745	S	S	*	*			trans	68.2	149.9	153.7	-68.7	166.7	-75.8	0	0	116.9
1326	H	36.8	Very low	34.4	Very low	145 Å²	145	138 Å²	138	67%	0.671	74%	0.743	S	S	*	*			cis	-165.9	160.9	-1.5	-105.7	-35.1	0	0	0	107.6
1327	D	36.7	Very low	34.9	Very low	118 Å²	118	140.4 Å²	140.4	63%	0.631	75%	0.749	S	S	*	*			cis	-162.8	-151.9	-21.1	-147.9	89.3	0	0	0	110.5
1328	E	37.4	Very low	35.5	Very low	177 Å²	177	136.3 Å²	136.3	83%	0.827	74%	0.74	S	S	*	*			trans	67.7	76.2	165.4	-67.5	-163	156.7	0	0	120.9
1329	N	36.8	Very low	36	Very low	131 Å²	131	134.6 Å²	134.6	70%	0.701	74%	0.738	S	S	*	*				32.1	126.8	115	-58.2	-46.5	0	0	0	121.4
1330	L	38.3	Very low	37.1	Very low	159 Å²	159	132 Å²	132	83%	0.832	74%	0.737	S	S	*	*				-165.3	114.6	101.5	-125.5	93.1	0	0	0	114.2
1331	L	36.7	Very low	37.3	Very low	156 Å²	156	133.6 Å²	133.6	82%	0.817	75%	0.747	S	S	*	*			trans	43.3	116.7	150.1	-72.6	157.8	0	0	0	123
1332	P	44	Very low	37.4	Very low	114 Å²	114	136.9 Å²	136.9	74%	0.74	75%	0.75	S	S	*	*			trans	-98.4	165.9	164.2	40.6	-34.7	0	0	0	113.2
1333	P	39.2	Very low	37.9	Very low	119 Å²	119	136.2 Å²	136.2	77%	0.773	76%	0.758	S	S	*	*				-141.5	-160.3	92.9	32	-9.6	0	0	0	111
1334	T	38.2	Very low	38.2	Very low	125 Å²	125	138.5 Å²	138.5	77%	0.767	77%	0.766	S	S	*	*			cis	-156.2	150.2	8.2	-30.2	0	0	0	0	109.2
1335	P	35.1	Very low	38.4	Very low	113 Å²	113	135.8 Å²	135.8	73%	0.734	77%	0.771	S	S	*	*			trans	-101.7	174.9	-176.2	39.2	-36.7	0	0	0	116.2
1336	S	32.4	Very low	38.4	Very low	118 Å²	118	137.2 Å²	137.2	83%	0.825	78%	0.781	S	S	*	*			trans	85.8	139.8	160.2	80.7	0	0	0	0	120.3
1337	S	37.8	Very low	38.4	Very low	113 Å²	113	135.8 Å²	135.8	79%	0.79	78%	0.782	S	S	*	*			trans	-151.8	121.7	157.4	55.7	0	0	0	0	108.6
1338	P	44.7	Very low	38.1	Very low	116 Å²	116	136 Å²	136	75%	0.753	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-88.1	166.1	-175.7	35.2	-35.9	0	0	0	113.2
1339	P	41.7	Very low	37.9	Very low	118 Å²	118	134.1 Å²	134.1	77%	0.766	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-66.9	155.1	170.3	29.5	-35.5	0	0	0	112.3
1340	P	53.1	Low	37.5	Very low	123 Å²	123	134 Å²	134	80%	0.799	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-71.8	151.3	-173.1	28.8	-35.7	0	0	0	113.8
1341	P	39.4	Very low	37.2	Very low	120 Å²	120	134.8 Å²	134.8	78%	0.779	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-86.5	154.8	-171.8	34.5	-36.7	0	0	0	114.6
1342	L	35.6	Very low	36.8	Very low	166 Å²	166	138.9 Å²	138.9	87%	0.869	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.2	135.2	164.4	-75.2	161.3	0	0	0	110.7
1343	P	41.7	Very low	36.5	Very low	125 Å²	125	140.2 Å²	140.2	81%	0.812	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-73.4	141.6	170.6	31	-33.7	0	0	0	110.8
1344	R	32.9	Very low	36.3	Very low	231 Å²	231	141.3 Å²	141.3	87%	0.872	80%	0.8	S	S	*	*			trans	-144.6	152.4	177	-134	-176.7	-170	-168.3	3.6	112.1
1345	T	32.5	Very low	36.2	Very low	127 Å²	127	142.2 Å²	142.2	78%	0.779	80%	0.802	S	S	*	*			trans	57.7	115.8	164.3	43.9	0	0	0	0	118.9
1346	I	35.2	Very low	36.3	Very low	168 Å²	168	143.9 Å²	143.9	86%	0.862	81%	0.806	S	S	*	*			trans	-127.5	145.9	130	-93.3	172.9	0	0	0	108.3
1347	T	36.4	Very low	36.6	Very low	114 Å²	114	145.5 Å²	145.5	70%	0.699	80%	0.804	S	S	*	*			trans	-53.7	144.4	-164.9	47.3	0	0	0	0	120.1
1348	T	31	Very low	36.5	Very low	123 Å²	123	147.7 Å²	147.7	76%	0.755	81%	0.805	S	S	*	*			trans	37.8	139.2	134.1	67.9	0	0	0	0	120.6
1349	T	34.3	Very low	35.9	Very low	137 Å²	137	149.9 Å²	149.9	84%	0.84	81%	0.809	S	S	*	*				-151.5	176.5	56.1	37.8	0	0	0	0	114.4
1350	K	27.8	Very low	35.4	Very low	130 Å²	130	152.4 Å²	152.4	57%	0.565	81%	0.812	S	S	*	*			trans	-86.3	168.5	-177.3	-82.1	-176.3	171.3	178.9	0	113.6	S1129	S1129-K1350 PolarHBondContact O-NZ 2.92Å; S1129-K1350 PolarHBondContact OG-NZ 3.04Å
1351	H	31.1	Very low	34	Very low	174 Å²	174	154.8 Å²	154.8	81%	0.806	81%	0.814	S	S	*	*			trans	85.5	134.6	175.6	-55.1	-86	0	0	0	114.9
1352	H	29.8	Very low	33.5	Very low	243 Å²	243	158 Å²	158	100%	1.125	82%	0.817	S	S	*	*			cis	-115.7	0	11.1	-148	-44.6	0	0	0	114.7

Retrieved 1,352 of 1,352 residues in 295.5 ms (Link to these results)

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